#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 -0.46 -0.04 1.61 1.04 -1.26 -5.17 113.70 109.42 2eob s SER 2 Ca 0.00 0.16 0.06 0.00 0.48 0.00 0.00 55.95 56.65 2eob s SER 2 Cb 0.00 0.45 -0.01 0.00 0.10 0.00 0.00 66.02 66.56 2eob s SER 2 CO 0.00 -0.67 -0.24 -0.55 0.98 0.00 0.00 173.24 172.76 2eob s SER 3 N -2.18 2.85 -0.35 7.02 0.15 -1.26 -5.04 113.70 114.89 2eob s SER 3 Ca 0.01 -0.46 0.14 0.00 0.70 0.00 0.00 55.95 56.33 2eob s SER 3 Cb -0.01 -0.63 0.45 0.00 -1.71 0.00 0.00 66.02 64.12 2eob s SER 3 CO -0.06 0.25 1.04 0.61 1.20 0.00 0.00 173.24 176.28 2eob n GLY 4 N 2.82 3.37 3.65 9.45 0.00 -1.26 -5.06 105.19 118.17 2eob n GLY 4 Ca -0.17 -1.85 -0.55 0.00 0.00 0.00 0.00 46.02 43.46 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 -0.31 2.08 -4.38 1.61 2.88 -1.26 -0.45 113.62 113.79 2eob n SER 5 Ca 0.21 1.09 -0.39 0.00 -1.33 0.00 0.00 58.87 58.45 2eob n SER 5 Cb 0.78 -1.17 -0.06 0.00 -0.75 0.00 0.00 64.21 63.01 2eob n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2eob n SER 6 N 4.07 -2.32 -3.59 -3.46 2.88 -1.26 -4.89 113.62 105.05 2eob n SER 6 Ca 0.23 -1.14 -0.03 0.00 -1.33 0.00 0.00 58.87 56.60 2eob n SER 6 Cb 0.16 -2.14 -0.06 0.00 -0.75 0.00 0.00 64.21 61.43 2eob n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2eob s GLY 7 N -3.35 -0.40 0.31 0.46 0.00 0.41 -5.16 107.32 99.59 2eob s GLY 7 Ca 0.74 2.73 -0.20 0.00 0.00 0.00 0.00 44.72 47.99 2eob s GLY 7 CO 0.98 2.79 0.82 0.51 0.00 0.00 0.00 173.10 178.20 2eob s ASP 8 N 2.03 7.03 0.95 1.64 -4.77 -1.26 -4.48 116.67 117.81 2eob s ASP 8 Ca -0.07 1.53 -0.12 0.00 -3.30 0.00 0.00 52.55 50.59 2eob s ASP 8 Cb -0.07 -2.47 0.16 0.00 -1.09 0.00 0.00 42.92 39.46 2eob s ASP 8 CO -0.18 -0.12 1.09 -2.16 0.70 0.00 0.00 175.17 174.51 2eob s PRO 9 N -2.45 0.81 0.44 2.11 0.04 -1.26 -4.97 135.00 129.71 2eob s PRO 9 Ca 0.51 0.66 -0.26 0.00 0.04 0.00 0.00 61.00 61.95 2eob s PRO 9 Cb -0.14 -1.77 -0.09 0.00 0.04 0.00 0.00 34.50 32.54 2eob s PRO 9 CO 0.19 -2.51 1.43 0.14 0.04 0.00 0.00 177.00 176.30 2eob s VAL 10 N -2.95 2.08 -0.20 -0.36 -7.23 -1.26 -4.91 120.40 105.57 2eob s VAL 10 Ca 0.64 0.07 -0.29 0.00 -1.81 0.00 0.00 61.98 60.59 2eob s VAL 10 Cb -0.18 -3.04 -0.03 0.00 0.56 0.00 0.00 36.38 33.69 2eob s VAL 10 CO 0.57 0.01 1.59 -2.16 -0.31 0.00 0.00 175.10 174.81 2eob s PRO 11 N -2.39 3.87 -0.11 4.82 0.04 -1.26 -5.00 135.00 134.96 2eob s PRO 11 Ca 0.60 1.72 -0.08 0.00 0.04 0.00 0.00 61.00 63.27 2eob s PRO 11 Cb -0.44 -4.01 -0.04 0.00 0.04 0.00 0.00 34.50 30.05 2eob s PRO 11 CO 0.57 -1.21 0.17 1.21 0.04 0.00 0.00 177.00 177.79 2eob s ASN 12 N 3.98 6.43 0.00 6.66 3.84 -1.26 -4.98 114.94 129.61 2eob s ASN 12 Ca 0.70 0.51 0.14 0.00 0.21 0.00 0.00 52.86 54.43 2eob s ASN 12 Cb -0.26 -2.09 0.69 0.00 -0.55 0.00 0.00 41.25 39.05 2eob s ASN 12 CO 0.28 0.39 1.42 -0.81 -2.79 0.00 0.00 177.10 175.59 2eob n PRO 13 N 2.04 0.14 -3.58 0.43 -0.04 -1.26 -4.02 135.00 128.71 2eob n PRO 13 Ca -0.19 0.19 -0.35 0.00 -0.04 0.00 0.00 63.50 63.10 2eob n PRO 13 Cb 0.55 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.44 2eob n PRO 13 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2eob n ASN 14 N -1.36 4.29 0.24 3.54 4.13 -1.26 -4.87 115.26 119.97 2eob n ASN 14 Ca 0.06 -3.19 0.12 0.00 1.68 0.00 0.00 54.58 53.25 2eob n ASN 14 Cb 0.13 -1.02 0.57 0.00 -1.54 0.00 0.00 39.78 37.93 2eob n ASN 14 CO 0.00 0.00 0.00 1.55 0.28 0.00 0.00 177.26 179.09 2eob h PRO 15 N 5.71 0.00 0.32 3.52 0.13 -2.02 -3.22 132.00 136.45 2eob h PRO 15 Ca 0.17 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.28 2eob h PRO 15 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 2eob h PRO 15 CO 0.89 0.15 -0.16 1.12 -0.23 0.00 0.00 178.00 179.78 2eob h HIS 16 N 0.00 -0.40 -1.27 1.56 2.07 -1.95 -2.51 115.15 112.65 2eob h HIS 16 Ca -0.00 -0.01 0.37 0.00 -2.85 0.00 0.00 60.37 57.88 2eob h HIS 16 Cb 0.60 0.13 -0.05 0.00 2.57 0.00 0.00 27.41 30.67 2eob h HIS 16 CO 0.00 -0.08 1.22 0.93 -3.07 0.00 0.00 177.93 176.93 2eob h GLU 17 N -0.75 0.00 0.10 5.12 5.08 -1.98 1.66 114.58 123.81 2eob h GLU 17 Ca -0.04 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.98 2eob h GLU 17 Cb 0.50 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 2eob h GLU 17 CO 0.07 0.00 -1.78 0.66 -1.00 0.00 0.00 179.01 176.96 2eob h SER 18 N 0.00 0.33 -1.11 1.42 4.64 -1.65 -3.48 113.55 113.70 2eob h SER 18 Ca 0.60 -0.62 -0.52 0.00 -0.47 0.00 0.00 61.79 60.78 2eob h SER 18 Cb 3.04 -0.11 0.11 0.00 -0.31 0.00 0.00 62.40 65.13 2eob h SER 18 CO -0.01 1.55 -0.62 0.29 -0.87 0.00 0.00 176.83 177.17 2eob n LYS 19 N -3.38 0.00 -0.03 4.77 4.76 0.57 -4.85 118.16 119.99 2eob n LYS 19 Ca -0.24 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.12 2eob n LYS 19 Cb 1.05 -0.80 0.07 0.00 -1.84 0.00 0.00 35.03 33.51 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 0.50 0.63 0.00 1.97 0.13 -1.93 -2.71 132.00 130.60 2eob h PRO 20 Ca -0.27 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 2eob h PRO 20 Cb 1.16 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2eob h PRO 20 CO 0.41 0.94 0.00 -2.67 -0.23 0.00 0.00 178.00 176.45 2eob n TRP 21 N -4.02 0.00 -3.25 1.56 4.27 -1.26 -4.34 117.44 110.39 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 0.54 0.00 -0.06 0.00 -1.36 0.00 0.00 31.31 30.43 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 3.53 -0.06 -2.67 5.04 -1.02 -3.12 117.35 117.05 2eob s TYR 22 Ca 0.19 0.98 0.04 0.00 -2.44 0.00 0.00 57.07 55.84 2eob s TYR 22 Cb 0.09 -2.61 -0.02 0.00 0.35 0.00 0.00 41.96 39.77 2eob s TYR 22 CO 0.15 0.16 -0.18 0.71 -1.34 0.00 0.00 175.55 175.04 2eob s TYR 23 N 0.62 2.60 -0.03 4.97 2.02 0.76 -4.96 117.35 123.33 2eob s TYR 23 Ca 0.29 -0.43 0.01 0.00 -0.37 0.00 0.00 57.07 56.56 2eob s TYR 23 Cb -0.16 -1.64 -0.02 0.00 -0.40 0.00 0.00 41.96 39.74 2eob s TYR 23 CO 0.12 -0.02 -0.02 -0.40 -1.57 0.00 0.00 175.55 173.67 2eob n ASP 24 N 2.71 3.98 -2.16 2.29 5.75 -1.26 -0.37 116.55 127.49 2eob n ASP 24 Ca -0.17 -0.01 -0.29 0.00 -0.01 0.00 0.00 54.79 54.31 2eob n ASP 24 Cb 0.52 0.13 0.06 0.00 -1.03 0.00 0.00 41.12 40.80 2eob n ASP 24 CO 0.00 0.00 0.00 -2.11 -0.11 0.00 0.00 177.20 174.98 2eob n ARG 25 N -2.44 3.08 -4.22 0.11 1.85 -1.26 -4.63 116.66 109.15 2eob n ARG 25 Ca -0.05 -3.68 -0.27 0.00 -1.00 0.00 0.00 57.85 52.85 2eob n ARG 25 Cb 0.56 -2.27 -0.08 0.00 -1.05 0.00 0.00 32.46 29.61 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 -3.70 3.20 0.04 2.89 2.96 -1.26 -5.14 118.68 117.67 2eob s LEU 26 Ca 0.58 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 54.08 2eob s LEU 26 Cb 0.46 -1.89 -0.03 0.00 0.50 0.00 0.00 46.19 45.23 2eob s LEU 26 CO 0.01 0.11 -0.05 -0.44 -1.32 0.00 0.00 176.35 174.67 2eob s SER 27 N -2.74 0.54 0.25 3.68 0.01 -1.26 -4.79 113.70 109.39 2eob s SER 27 Ca 0.26 -0.62 -0.11 0.00 1.31 0.00 0.00 55.95 56.79 2eob s SER 27 Cb -0.10 0.09 0.37 0.00 0.21 0.00 0.00 66.02 66.59 2eob s SER 27 CO 0.17 -0.32 1.58 -0.09 0.41 0.00 0.00 173.24 174.99 2eob h ARG 28 N 4.28 -0.01 -1.03 12.44 2.43 -2.00 0.49 114.38 130.98 2eob h ARG 28 Ca -0.34 0.00 0.39 0.00 -0.81 0.00 0.00 59.98 59.22 2eob h ARG 28 Cb 1.20 0.00 -0.16 0.00 -0.42 0.00 0.00 29.97 30.58 2eob h ARG 28 CO 0.46 -0.00 0.58 0.78 -1.51 0.00 0.00 179.97 180.28 2eob h GLY 29 N -0.01 2.11 0.22 2.80 0.00 -2.02 -1.06 103.07 105.13 2eob h GLY 29 Ca 0.41 -0.18 -0.31 0.00 0.00 0.00 0.00 47.33 47.25 2eob h GLY 29 CO -0.90 -0.66 -1.69 1.18 0.00 0.00 0.00 176.54 174.48 2eob n GLU 30 N -5.13 0.64 -0.10 4.80 1.02 0.14 -4.20 120.64 117.82 2eob n GLU 30 Ca 0.36 0.42 -0.03 0.00 -0.02 0.00 0.00 57.16 57.89 2eob n GLU 30 Cb 1.19 -1.70 -0.02 0.00 -0.02 0.00 0.00 31.44 30.89 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 -3.33 -0.15 -0.31 0.62 0.00 0.49 -0.45 120.51 117.38 2eob n ALA 31 Ca -0.35 0.19 0.02 0.00 0.00 0.00 0.00 53.44 53.31 2eob n ALA 31 Cb 0.85 0.35 0.09 0.00 0.00 0.00 0.00 19.45 20.73 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 -0.02 0.51 0.00 5.08 -1.62 -0.81 114.58 117.73 2eob h GLU 32 Ca 0.04 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2eob h GLU 32 Cb 0.09 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.33 2eob h GLU 32 CO -0.21 -0.01 -0.49 0.22 -1.00 0.00 0.00 179.01 177.51 2eob h ASP 33 N -0.02 -1.34 -0.98 1.42 3.58 -1.05 -1.99 116.42 116.04 2eob h ASP 33 Ca 0.39 0.11 0.27 0.00 0.42 0.00 0.00 57.03 58.21 2eob h ASP 33 Cb 0.63 0.44 -0.18 0.00 1.72 0.00 0.00 39.33 41.93 2eob h ASP 33 CO -0.90 -0.66 0.02 0.24 -2.88 0.00 0.00 179.24 175.06 2eob h MET 34 N -1.00 0.01 0.32 0.28 2.86 0.66 0.27 114.93 118.33 2eob h MET 34 Ca -0.06 -0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.56 2eob h MET 34 Cb 0.86 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.52 2eob h MET 34 CO -0.05 0.01 -0.16 -0.07 1.06 0.00 0.00 176.91 177.69 2eob h LEU 35 N 0.01 -0.39 -1.93 1.22 -0.00 -0.88 -1.92 115.31 111.42 2eob h LEU 35 Ca 0.59 0.02 0.22 0.00 -0.00 0.00 0.00 57.88 58.71 2eob h LEU 35 Cb 1.21 0.11 -0.03 0.00 -0.00 0.00 0.00 40.66 41.94 2eob h LEU 35 CO -0.92 -0.27 0.63 0.24 -0.00 0.00 0.00 178.44 178.12 2eob h MET 36 N -0.44 0.00 0.00 1.13 2.86 0.22 0.70 114.93 119.40 2eob h MET 36 Ca -0.04 0.00 -0.14 0.00 -2.06 0.00 0.00 59.70 57.46 2eob h MET 36 Cb 0.35 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 31.99 2eob h MET 36 CO 0.06 0.00 -0.67 0.00 1.06 0.00 0.00 176.91 177.36 2eob h ARG 37 N 0.00 0.00 -6.25 1.72 -0.00 -0.52 -3.43 114.38 105.90 2eob h ARG 37 Ca 0.36 0.00 -0.57 0.00 -0.50 0.00 0.00 59.98 59.27 2eob h ARG 37 Cb 1.63 0.00 -0.04 0.00 0.00 0.00 0.00 29.97 31.55 2eob h ARG 37 CO -0.00 0.67 0.95 0.42 0.00 0.00 0.00 179.97 182.01 2eob s ILE 38 N -3.31 4.17 -2.00 2.04 -1.09 0.24 -4.88 121.20 116.37 2eob s ILE 38 Ca -0.00 1.37 0.12 0.00 -2.23 0.00 0.00 60.65 59.91 2eob s ILE 38 Cb 0.11 -4.04 0.34 0.00 -1.58 0.00 0.00 42.46 37.29 2eob s ILE 38 CO 0.76 -0.30 1.14 -0.81 -1.23 0.00 0.00 174.94 174.51 2eob n PRO 39 N 7.00 0.49 -3.60 2.79 -0.04 -1.26 -4.62 135.00 135.76 2eob n PRO 39 Ca 0.15 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.23 2eob n PRO 39 Cb 0.46 -1.38 -0.11 0.00 -0.04 0.00 0.00 33.50 32.42 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 3.88 0.00 0.54 1.81 -1.26 -4.97 118.95 116.94 2eob s ARG 40 Ca 0.18 -0.37 -0.04 0.00 -1.72 0.00 0.00 55.73 53.78 2eob s ARG 40 Cb 0.08 -3.64 -0.19 0.00 -0.45 0.00 0.00 34.95 30.75 2eob s ARG 40 CO 0.14 -0.21 3.06 -0.25 -0.68 0.00 0.00 175.30 177.36 2eob n ASP 41 N 5.05 5.01 -0.40 0.23 9.92 -1.26 -3.10 116.55 132.00 2eob n ASP 41 Ca -0.14 -2.41 -0.01 0.00 -0.53 0.00 0.00 54.79 51.70 2eob n ASP 41 Cb 0.52 -1.28 -0.01 0.00 -0.64 0.00 0.00 41.12 39.71 2eob n ASP 41 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2eob n GLY 42 N 2.26 0.55 3.83 0.44 0.00 -0.94 -4.04 105.19 107.29 2eob n GLY 42 Ca 0.30 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.00 2eob n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eob s ALA 43 N 0.00 3.09 0.09 4.61 0.00 -1.18 -2.85 121.76 125.52 2eob s ALA 43 Ca 0.00 0.29 -0.04 0.00 0.00 0.00 0.00 51.96 52.21 2eob s ALA 43 Cb 0.00 -3.08 -0.02 0.00 0.00 0.00 0.00 23.12 20.01 2eob s ALA 43 CO 0.00 0.07 0.09 -0.59 0.00 0.00 0.00 175.76 175.33 2eob s PHE 44 N -2.26 0.44 -0.05 0.00 -0.12 -0.95 -0.63 117.98 114.41 2eob s PHE 44 Ca 0.60 -0.90 -0.23 0.00 -0.05 0.00 0.00 56.93 56.35 2eob s PHE 44 Cb -0.09 -0.26 0.05 0.00 -0.63 0.00 0.00 43.02 42.09 2eob s PHE 44 CO 0.18 -0.49 0.51 -0.48 -0.05 0.00 0.00 175.22 174.89 2eob s LEU 45 N -2.93 0.03 -0.21 -1.99 0.05 0.25 0.31 118.68 114.19 2eob s LEU 45 Ca 0.10 0.49 0.01 0.00 0.05 0.00 0.00 54.13 54.78 2eob s LEU 45 Cb 0.06 1.94 0.04 0.00 -2.05 0.00 0.00 46.19 46.19 2eob s LEU 45 CO -0.07 -0.50 -0.13 -0.63 -0.55 0.00 0.00 176.35 174.46 2eob s ILE 46 N -1.12 1.86 0.02 1.48 1.01 -1.18 -0.44 121.20 122.83 2eob s ILE 46 Ca -0.11 -1.12 0.08 0.00 0.00 0.00 0.00 60.65 59.49 2eob s ILE 46 Cb -0.03 -1.87 -0.03 0.00 0.01 0.00 0.00 42.46 40.55 2eob s ILE 46 CO 0.07 0.22 -0.22 0.00 0.00 0.00 0.00 174.94 175.01 2eob s ARG 47 N 1.31 2.03 0.05 2.79 1.70 -1.17 -0.17 118.95 125.48 2eob s ARG 47 Ca -0.01 -0.99 -0.23 0.00 -0.47 0.00 0.00 55.73 54.03 2eob s ARG 47 Cb -0.16 -2.11 -0.06 0.00 -0.57 0.00 0.00 34.95 32.05 2eob s ARG 47 CO -0.09 0.54 0.69 0.21 -1.08 0.00 0.00 175.30 175.57 2eob s LYS 48 N -1.15 4.41 -0.12 3.89 2.36 0.50 -3.00 119.74 126.62 2eob s LYS 48 Ca 0.12 0.92 -0.26 0.00 -2.55 0.00 0.00 55.97 54.21 2eob s LYS 48 Cb -0.10 -3.33 -0.02 0.00 -1.05 0.00 0.00 37.83 33.33 2eob s LYS 48 CO 0.03 0.39 0.83 1.03 1.55 0.00 0.00 175.35 179.18 2eob s ARG 49 N -0.36 4.37 0.66 4.03 0.52 -1.10 -4.74 118.95 122.34 2eob s ARG 49 Ca 0.34 1.06 -0.14 0.00 -0.52 0.00 0.00 55.73 56.47 2eob s ARG 49 Cb -0.20 -3.53 0.00 0.00 0.52 0.00 0.00 34.95 31.74 2eob s ARG 49 CO 0.21 -0.21 1.10 -1.83 0.02 0.00 0.00 175.30 174.58 2eob s GLU 50 N 1.72 2.84 -1.46 3.54 -1.05 -1.26 -3.52 118.70 119.51 2eob s GLU 50 Ca 0.40 1.31 -0.09 0.00 -0.15 0.00 0.00 54.97 56.44 2eob s GLU 50 Cb -0.17 -1.96 0.05 0.00 -0.44 0.00 0.00 34.13 31.60 2eob s GLU 50 CO 0.16 -1.21 0.78 0.41 0.95 0.00 0.00 175.26 176.35 2eob n GLY 51 N -0.76 -0.51 3.62 -3.83 0.00 -1.26 -4.94 105.19 97.51 2eob n GLY 51 Ca 0.10 0.16 -0.06 0.00 0.00 0.00 0.00 46.02 46.22 2eob n GLY 51 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2eob s THR 52 N -3.18 0.00 -0.33 2.61 -1.32 -1.23 -5.02 115.64 107.18 2eob s THR 52 Ca 0.48 0.00 0.04 0.00 -1.21 0.00 0.00 61.69 60.99 2eob s THR 52 Cb -0.23 -1.00 0.42 0.00 -1.51 0.00 0.00 72.50 70.18 2eob s THR 52 CO 0.59 0.00 1.49 -0.90 -2.21 0.00 0.00 174.62 173.59 2eob n ASP 53 N 0.86 3.54 -4.64 8.08 5.68 -1.26 -4.69 116.55 124.12 2eob n ASP 53 Ca -0.06 -2.88 -0.27 0.00 -0.50 0.00 0.00 54.79 51.08 2eob n ASP 53 Cb 0.58 -0.69 -0.10 0.00 -1.14 0.00 0.00 41.12 39.77 2eob n ASP 53 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 2eob s SER 54 N -0.40 3.98 0.20 -1.12 1.04 -1.26 -4.74 113.70 111.41 2eob s SER 54 Ca 0.34 -1.28 -0.04 0.00 0.48 0.00 0.00 55.95 55.45 2eob s SER 54 Cb 0.28 -0.42 -0.03 0.00 0.10 0.00 0.00 66.02 65.95 2eob s SER 54 CO 0.07 -0.43 0.20 -0.31 0.98 0.00 0.00 173.24 173.75 2eob s TYR 55 N -2.67 0.95 -0.11 5.02 1.51 -1.17 -2.70 117.35 118.19 2eob s TYR 55 Ca 0.36 -1.22 -0.08 0.00 -1.01 0.00 0.00 57.07 55.12 2eob s TYR 55 Cb 0.08 -0.39 0.04 0.00 -0.11 0.00 0.00 41.96 41.58 2eob s TYR 55 CO 0.19 -0.71 0.27 0.00 -1.11 0.00 0.00 175.55 174.19 2eob s ALA 56 N -4.12 -0.66 -0.05 3.71 0.00 -1.16 -0.90 121.76 118.59 2eob s ALA 56 Ca 0.34 0.90 -0.04 0.00 0.00 0.00 0.00 51.96 53.17 2eob s ALA 56 Cb 0.05 -0.55 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 2eob s ALA 56 CO 0.10 -0.16 0.15 -1.50 0.00 0.00 0.00 175.76 174.35 2eob s ILE 57 N 0.64 5.33 -0.02 0.00 2.07 -1.13 -3.02 121.20 125.07 2eob s ILE 57 Ca -0.04 -0.08 0.05 0.00 -1.41 0.00 0.00 60.65 59.17 2eob s ILE 57 Cb -0.05 -3.42 -0.01 0.00 0.13 0.00 0.00 42.46 39.10 2eob s ILE 57 CO -0.04 0.43 -0.16 -0.89 -1.91 0.00 0.00 174.94 172.37 2eob s THR 58 N -1.20 1.29 0.11 4.00 2.01 0.41 -1.99 115.64 120.27 2eob s THR 58 Ca 0.22 -0.68 -0.08 0.00 0.31 0.00 0.00 61.69 61.46 2eob s THR 58 Cb -0.12 -1.09 -0.01 0.00 0.01 0.00 0.00 72.50 71.30 2eob s THR 58 CO 0.13 0.37 0.20 0.72 -0.69 0.00 0.00 174.62 175.35 2eob s PHE 59 N -0.25 0.25 -0.43 4.92 -0.71 -1.06 0.86 117.98 121.56 2eob s PHE 59 Ca 0.03 -0.67 -0.07 0.00 -1.04 0.00 0.00 56.93 55.19 2eob s PHE 59 Cb -0.08 -0.09 0.10 0.00 -1.21 0.00 0.00 43.02 41.75 2eob s PHE 59 CO 0.00 -0.58 0.26 0.50 -1.34 0.00 0.00 175.22 174.07 2eob s ARG 60 N -3.89 2.34 0.74 1.99 3.52 0.20 -0.67 118.95 123.17 2eob s ARG 60 Ca 0.09 -1.69 -0.12 0.00 -0.13 0.00 0.00 55.73 53.87 2eob s ARG 60 Cb 0.05 -3.74 0.19 0.00 -1.56 0.00 0.00 34.95 29.88 2eob s ARG 60 CO -0.08 -1.07 0.53 0.00 -0.81 0.00 0.00 175.30 173.87 2eob n ALA 61 N 4.79 -2.41 -0.88 6.12 0.00 0.20 -2.22 120.51 126.11 2eob n ALA 61 Ca -0.07 -0.86 -0.15 0.00 0.00 0.00 0.00 53.44 52.36 2eob n ALA 61 Cb 0.42 -0.07 -0.11 0.00 0.00 0.00 0.00 19.45 19.68 2eob n ALA 61 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2eob n ARG 62 N -3.74 1.98 0.00 0.00 5.12 -1.26 -3.94 116.66 114.83 2eob n ARG 62 Ca 0.08 -1.08 0.00 0.00 -1.93 0.00 0.00 57.85 54.92 2eob n ARG 62 Cb 0.32 -2.09 0.00 0.00 -1.16 0.00 0.00 32.46 29.53 2eob n ARG 62 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2eob n GLY 63 N 2.85 -0.21 1.54 -0.13 0.00 -1.26 -5.15 105.19 102.84 2eob n GLY 63 Ca 0.43 0.25 -0.12 0.00 0.00 0.00 0.00 46.02 46.58 2eob n GLY 63 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2eob n LYS 64 N 0.00 0.84 -4.30 1.61 2.85 -1.25 -5.15 118.16 112.76 2eob n LYS 64 Ca 0.00 -1.59 -0.34 0.00 -1.05 0.00 0.00 58.31 55.33 2eob n LYS 64 Cb 0.00 0.82 -0.11 0.00 -0.65 0.00 0.00 35.03 35.09 2eob n LYS 64 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 2eob s VAL 65 N -2.20 4.19 0.52 0.58 1.01 -1.26 0.61 120.40 123.85 2eob s VAL 65 Ca 0.09 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.86 2eob s VAL 65 Cb 0.00 -2.84 0.02 0.00 0.00 0.00 0.00 36.38 33.57 2eob s VAL 65 CO 0.06 0.50 0.34 -0.54 0.00 0.00 0.00 175.10 175.46 2eob s LYS 66 N 0.17 2.26 0.25 2.72 -0.14 0.15 -4.92 119.74 120.23 2eob s LYS 66 Ca 0.00 -2.02 -0.11 0.00 -1.36 0.00 0.00 55.97 52.49 2eob s LYS 66 Cb -0.13 -2.04 -0.01 0.00 -1.68 0.00 0.00 37.83 33.97 2eob s LYS 66 CO 0.02 -0.52 0.45 -1.01 -0.76 0.00 0.00 175.35 173.53 2eob s HIS 67 N -2.75 0.48 0.18 3.18 3.76 -1.26 -2.57 115.29 116.30 2eob s HIS 67 Ca 0.32 -0.82 -0.17 0.00 -0.15 0.00 0.00 55.06 54.24 2eob s HIS 67 Cb -0.01 0.11 0.03 0.00 1.11 0.00 0.00 32.58 33.81 2eob s HIS 67 CO 0.20 -0.98 0.48 0.00 -0.85 0.00 0.00 174.74 173.59 2eob s ARG 69 N -3.86 2.89 -0.03 0.00 6.06 -1.26 -2.85 118.95 119.89 2eob s ARG 69 Ca 0.08 -0.61 0.04 0.00 -2.50 0.00 0.00 55.73 52.74 2eob s ARG 69 Cb -0.00 -2.74 -0.00 0.00 0.06 0.00 0.00 34.95 32.27 2eob s ARG 69 CO -0.05 0.61 -0.14 0.42 -2.50 0.00 0.00 175.30 173.64 2eob s ILE 70 N -1.22 1.19 0.35 4.11 1.01 -0.07 -4.72 121.20 121.83 2eob s ILE 70 Ca 0.24 -0.59 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2eob s ILE 70 Cb -0.12 -1.02 0.00 0.00 0.01 0.00 0.00 42.46 41.33 2eob s ILE 70 CO 0.15 0.35 0.03 -3.20 0.00 0.00 0.00 174.94 172.27 2eob n ASN 71 N 3.10 2.86 -3.71 3.58 2.85 -0.65 -3.03 115.26 120.27 2eob n ASN 71 Ca -0.17 -2.48 -0.17 0.00 -0.11 0.00 0.00 54.58 51.64 2eob n ASN 71 Cb 0.54 0.21 -0.17 0.00 1.24 0.00 0.00 39.78 41.60 2eob n ASN 71 CO 0.00 0.00 0.00 -0.60 -2.11 0.00 0.00 177.26 174.55 2eob s ARG 72 N -3.28 -0.03 -0.82 1.20 3.52 -1.26 -2.00 118.95 116.28 2eob s ARG 72 Ca 0.03 0.36 0.01 0.00 -0.13 0.00 0.00 55.73 56.00 2eob s ARG 72 Cb -0.00 -0.36 0.22 0.00 -1.56 0.00 0.00 34.95 33.24 2eob s ARG 72 CO 0.02 -0.26 0.74 -3.47 -0.81 0.00 0.00 175.30 171.52 2eob n ASP 73 N 4.87 3.94 0.00 -2.12 -0.08 -0.73 -4.97 116.55 117.47 2eob n ASP 73 Ca -0.13 -3.22 0.00 0.00 -1.51 0.00 0.00 54.79 49.93 2eob n ASP 73 Cb 0.50 -0.92 0.00 0.00 2.34 0.00 0.00 41.12 43.04 2eob n ASP 73 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2eob n GLY 74 N 1.91 1.63 0.11 0.27 0.00 -1.26 -3.54 105.19 104.31 2eob n GLY 74 Ca 0.23 -0.36 0.06 0.00 0.00 0.00 0.00 46.02 45.95 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 1.43 -4.42 1.61 1.85 -1.26 -5.04 116.66 110.83 2eob n ARG 75 Ca 0.00 -2.01 -0.24 0.00 -1.00 0.00 0.00 57.85 54.61 2eob n ARG 75 Cb 0.00 -1.20 -0.13 0.00 -1.05 0.00 0.00 32.46 30.08 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 -1.91 1.69 -0.21 2.89 3.76 -1.23 -4.65 115.29 115.64 2eob s HIS 76 Ca 0.19 -0.40 -0.16 0.00 -0.15 0.00 0.00 55.06 54.54 2eob s HIS 76 Cb 0.16 -0.97 -0.04 0.00 1.11 0.00 0.00 32.58 32.85 2eob s HIS 76 CO 0.02 0.13 0.41 -0.06 -0.85 0.00 0.00 174.74 174.39 2eob s PHE 77 N -0.99 3.36 -0.31 1.40 0.08 -0.22 -1.77 117.98 119.52 2eob s PHE 77 Ca 0.06 0.62 -0.11 0.00 0.12 0.00 0.00 56.93 57.61 2eob s PHE 77 Cb -0.09 -2.55 -0.02 0.00 -0.57 0.00 0.00 43.02 39.78 2eob s PHE 77 CO 0.03 -0.04 0.20 0.08 -0.10 0.00 0.00 175.22 175.39 2eob s VAL 78 N 1.43 5.12 -0.02 -0.44 1.01 -0.85 -3.17 120.40 123.48 2eob s VAL 78 Ca 0.19 -0.15 -0.00 0.00 0.00 0.00 0.00 61.98 62.02 2eob s VAL 78 Cb -0.15 -3.56 -0.00 0.00 0.00 0.00 0.00 36.38 32.67 2eob s VAL 78 CO 0.08 0.09 -0.00 0.25 0.00 0.00 0.00 175.10 175.52 2eob h LEU 79 N 8.42 0.00 0.00 3.92 7.12 -1.86 -1.72 115.31 131.20 2eob h LEU 79 Ca -0.33 0.00 0.00 0.00 0.13 0.00 0.00 57.88 57.68 2eob h LEU 79 Cb 1.16 0.00 0.00 0.00 -0.53 0.00 0.00 40.66 41.29 2eob h LEU 79 CO 0.61 0.11 0.00 0.61 -0.13 0.00 0.00 178.44 179.64 2eob n GLY 80 N 1.95 0.41 3.19 3.75 0.00 -1.26 -4.57 105.19 108.66 2eob n GLY 80 Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 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 1.56 -1.47 2.61 2.01 -1.26 -4.74 115.64 114.35 2eob s THR 81 Ca 0.00 -0.83 -0.17 0.00 0.31 0.00 0.00 61.69 61.00 2eob s THR 81 Cb 0.00 -1.31 0.16 0.00 0.01 0.00 0.00 72.50 71.37 2eob s THR 81 CO 0.00 0.44 0.53 -1.20 -0.69 0.00 0.00 174.62 173.70 2eob n SER 82 N 2.73 -2.27 -4.17 3.53 7.64 -1.26 -4.89 113.62 114.93 2eob n SER 82 Ca -0.16 -0.81 -0.36 0.00 1.01 0.00 0.00 58.87 58.55 2eob n SER 82 Cb 0.53 -1.95 -0.13 0.00 -1.01 0.00 0.00 64.21 61.66 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 -3.02 2.99 -0.02 -0.43 0.00 -1.26 -5.09 121.76 114.94 2eob s ALA 83 Ca 0.63 -2.07 0.07 0.00 0.00 0.00 0.00 51.96 50.59 2eob s ALA 83 Cb -0.36 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.55 2eob s ALA 83 CO 0.77 -1.50 -0.23 0.71 0.00 0.00 0.00 175.76 175.52 2eob s TYR 84 N 1.23 2.43 -0.23 0.00 1.51 -1.26 -3.67 117.35 117.37 2eob s TYR 84 Ca 0.01 -0.36 -0.11 0.00 -1.01 0.00 0.00 57.07 55.60 2eob s TYR 84 Cb -0.21 -1.52 0.08 0.00 -0.11 0.00 0.00 41.96 40.20 2eob s TYR 84 CO -0.02 0.04 0.53 -0.06 -1.11 0.00 0.00 175.55 174.94 2eob s PHE 85 N -0.67 -0.91 0.31 2.71 0.08 -1.19 -4.95 117.98 113.36 2eob s PHE 85 Ca 0.11 1.77 0.07 0.00 0.12 0.00 0.00 56.93 58.99 2eob s PHE 85 Cb -0.10 0.48 0.85 0.00 -0.57 0.00 0.00 43.02 43.67 2eob s PHE 85 CO -0.00 -0.48 1.66 1.49 -0.10 0.00 0.00 175.22 177.79 2eob h GLU 86 N 7.48 0.28 -3.06 0.44 4.81 -1.91 -0.58 114.58 122.04 2eob h GLU 86 Ca -0.27 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 58.82 2eob h GLU 86 Cb 1.16 -0.06 -0.21 0.00 0.63 0.00 0.00 28.75 30.27 2eob h GLU 86 CO 0.18 0.19 -0.30 -1.12 -0.73 0.00 0.00 179.01 177.23 2eob s SER 87 N -5.04 -0.19 0.36 1.04 0.01 -1.26 -4.58 113.70 104.04 2eob s SER 87 Ca -0.11 0.13 0.19 0.00 1.31 0.00 0.00 55.95 57.47 2eob s SER 87 Cb 0.27 0.34 1.30 0.00 0.21 0.00 0.00 66.02 68.14 2eob s SER 87 CO 0.78 -0.40 1.58 -0.07 0.41 0.00 0.00 173.24 175.54 2eob h LEU 88 N 4.10 0.25 -0.53 2.44 3.38 -1.95 -0.26 115.31 122.74 2eob h LEU 88 Ca -0.29 0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.99 2eob h LEU 88 Cb 1.18 0.29 -0.07 0.00 0.09 0.00 0.00 40.66 42.14 2eob h LEU 88 CO 0.39 -0.43 -0.40 0.58 0.09 0.00 0.00 178.44 178.67 2eob h VAL 89 N 0.01 0.00 -0.39 1.22 2.07 -1.96 -0.51 116.25 116.69 2eob h VAL 89 Ca 0.83 0.00 0.08 0.00 0.82 0.00 0.00 66.70 68.43 2eob h VAL 89 Cb 2.15 0.00 -0.09 0.00 -1.52 0.00 0.00 31.29 31.84 2eob h VAL 89 CO -0.78 0.00 -0.21 -0.33 0.02 0.00 0.00 177.57 176.27 2eob h GLU 90 N -0.11 -0.14 -0.99 1.57 4.39 -1.44 0.32 114.58 118.18 2eob h GLU 90 Ca 0.09 0.01 0.29 0.00 0.34 0.00 0.00 59.36 60.09 2eob h GLU 90 Cb 0.34 0.03 -0.14 0.00 -0.10 0.00 0.00 28.75 28.88 2eob h GLU 90 CO -0.56 -0.09 0.53 1.25 -1.16 0.00 0.00 179.01 178.98 2eob h LEU 91 N -0.15 0.49 -0.49 1.33 6.46 -1.11 0.96 115.31 122.82 2eob h LEU 91 Ca 0.19 0.18 -0.14 0.00 -0.12 0.00 0.00 57.88 57.99 2eob h LEU 91 Cb 0.44 0.13 -0.02 0.00 -0.73 0.00 0.00 40.66 40.48 2eob h LEU 91 CO -0.48 -0.08 -0.65 0.58 -0.62 0.00 0.00 178.44 177.20 2eob h VAL 92 N 0.38 1.30 0.00 1.05 2.07 0.14 -2.25 116.25 118.94 2eob h VAL 92 Ca 0.69 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.86 2eob h VAL 92 Cb 1.49 2.33 0.00 0.00 -1.52 0.00 0.00 31.29 33.58 2eob h VAL 92 CO -0.58 0.63 0.00 -1.28 0.02 0.00 0.00 177.57 176.37 2eob h SER 93 N 0.00 0.00 0.00 0.57 0.87 0.21 -2.80 113.55 112.40 2eob h SER 93 Ca -0.01 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.42 2eob h SER 93 Cb 1.27 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.21 2eob h SER 93 CO 0.08 0.00 -1.00 0.00 -0.53 0.00 0.00 176.83 175.38 2eob n TYR 94 N -2.92 0.88 0.16 2.24 9.36 0.12 -4.22 117.16 122.78 2eob n TYR 94 Ca 0.03 0.38 0.16 0.00 3.32 0.00 0.00 57.90 61.79 2eob n TYR 94 Cb 0.43 -0.93 0.76 0.00 -0.63 0.00 0.00 39.34 38.97 2eob n TYR 94 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 2eob h TYR 95 N -1.00 0.00 -1.03 2.98 -1.99 -1.52 -1.74 116.97 112.67 2eob h TYR 95 Ca -0.21 0.00 0.28 0.00 2.00 0.00 0.00 58.73 60.81 2eob h TYR 95 Cb 0.97 0.00 -0.13 0.00 2.00 0.00 0.00 36.73 39.57 2eob h TYR 95 CO -0.07 0.00 0.62 0.93 -0.00 0.00 0.00 178.16 179.63 2eob h GLU 96 N 0.00 0.43 0.04 4.88 4.39 -1.66 -2.11 114.58 120.54 2eob h GLU 96 Ca 0.11 -0.03 -0.38 0.00 0.34 0.00 0.00 59.36 59.41 2eob h GLU 96 Cb 0.54 -0.10 -0.05 0.00 -0.10 0.00 0.00 28.75 29.04 2eob h GLU 96 CO -0.00 0.29 -2.31 1.63 -1.16 0.00 0.00 179.01 177.45 2eob n LYS 97 N -4.88 0.69 -2.99 2.33 4.76 -0.70 -4.52 118.16 112.85 2eob n LYS 97 Ca 0.29 0.18 -0.41 0.00 -2.87 0.00 0.00 58.31 55.50 2eob n LYS 97 Cb 0.88 -1.58 -0.05 0.00 -1.84 0.00 0.00 35.03 32.44 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 3.37 0.69 2.13 3.76 -0.79 -5.02 115.29 116.90 2eob s HIS 98 Ca -0.29 1.08 -0.18 0.00 -0.15 0.00 0.00 55.06 55.52 2eob s HIS 98 Cb 0.08 -2.93 -0.14 0.00 1.11 0.00 0.00 32.58 30.69 2eob s HIS 98 CO 0.67 -0.26 -0.33 0.00 -0.85 0.00 0.00 174.74 173.97 2eob n ALA 99 N 5.40 -3.84 -0.02 -1.40 0.00 -1.26 -4.46 120.51 114.92 2eob n ALA 99 Ca 0.02 -0.29 -0.06 0.00 0.00 0.00 0.00 53.44 53.12 2eob n ALA 99 Cb 0.49 -1.34 -0.02 0.00 0.00 0.00 0.00 19.45 18.58 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 2.68 1.43 -0.00 0.00 7.94 -1.14 -4.97 117.00 122.94 2eob n LEU 100 Ca 0.05 0.22 -0.00 0.00 -1.11 0.00 0.00 56.01 55.16 2eob n LEU 100 Cb 0.50 -0.51 -0.00 0.00 0.53 0.00 0.00 43.42 43.94 2eob n LEU 100 CO 0.53 -0.42 -0.01 0.00 -1.11 0.00 0.00 177.39 176.38 2eob n TYR 101 N -3.90 0.00 -3.64 1.96 4.19 -1.23 -5.09 117.16 109.44 2eob n TYR 101 Ca -0.09 0.00 -0.04 0.00 3.31 0.00 0.00 57.90 61.08 2eob n TYR 101 Cb 0.30 -0.01 -0.07 0.00 0.49 0.00 0.00 39.34 40.06 2eob n TYR 101 CO 0.00 0.00 0.00 0.50 0.91 0.00 0.00 176.86 178.27 2eob s ARG 102 N -1.04 0.46 0.00 2.98 3.52 -1.26 -4.93 118.95 118.69 2eob s ARG 102 Ca -0.01 0.79 0.00 0.00 -0.13 0.00 0.00 55.73 56.38 2eob s ARG 102 Cb 0.00 0.10 0.00 0.00 -1.56 0.00 0.00 34.95 33.49 2eob s ARG 102 CO 0.01 -0.09 0.00 1.17 -0.81 0.00 0.00 175.30 175.57 2eob n LYS 103 N 3.75 -2.40 -3.66 5.12 3.00 -1.26 -4.80 118.16 117.91 2eob n LYS 103 Ca -0.19 0.00 -0.06 0.00 -0.00 0.00 0.00 58.31 58.06 2eob n LYS 103 Cb 0.58 -3.94 -0.08 0.00 0.00 0.00 0.00 35.03 31.59 2eob n LYS 103 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 177.40 178.81 2eob s MET 104 N -3.93 0.50 0.17 1.64 1.75 -1.26 -5.02 119.30 113.15 2eob s MET 104 Ca 0.00 1.15 0.08 0.00 -1.25 0.00 0.00 55.69 55.67 2eob s MET 104 Cb 0.00 0.37 -0.04 0.00 2.84 0.00 0.00 34.83 38.00 2eob s MET 104 CO 0.00 -0.20 -0.17 -0.98 -0.65 0.00 0.00 175.02 173.02 2eob s ARG 105 N 2.23 1.26 -0.94 4.11 1.70 -1.26 -2.86 118.95 123.19 2eob s ARG 105 Ca -0.06 -1.42 -0.18 0.00 -0.47 0.00 0.00 55.73 53.59 2eob s ARG 105 Cb -0.10 -1.26 -0.26 0.00 -0.57 0.00 0.00 34.95 32.76 2eob s ARG 105 CO -0.16 0.25 2.35 1.28 -1.08 0.00 0.00 175.30 177.94 2eob n LEU 106 N 0.21 -0.31 -0.10 -1.89 4.77 -1.26 -4.67 117.00 113.75 2eob n LEU 106 Ca -0.13 -0.49 -0.23 0.00 -0.03 0.00 0.00 56.01 55.14 2eob n LEU 106 Cb 0.58 -0.86 -0.12 0.00 -2.33 0.00 0.00 43.42 40.69 2eob n LEU 106 CO 0.30 -1.43 -1.14 -1.14 -1.33 0.00 0.00 177.39 172.66 2eob n ARG 107 N 6.97 0.64 -3.90 3.23 3.00 -1.13 -4.64 116.66 120.83 2eob n ARG 107 Ca 0.63 0.27 -0.30 0.00 -0.00 0.00 0.00 57.85 58.44 2eob n ARG 107 Cb 0.18 -1.59 -0.15 0.00 0.00 0.00 0.00 32.46 30.90 2eob n ARG 107 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 2eob s TYR 108 N -2.50 2.62 -0.87 -0.14 2.02 -1.21 -5.05 117.35 112.22 2eob s TYR 108 Ca -0.32 -2.14 -0.25 0.00 -0.37 0.00 0.00 57.07 53.99 2eob s TYR 108 Cb 0.10 -2.04 -0.04 0.00 -0.40 0.00 0.00 41.96 39.57 2eob s TYR 108 CO 0.60 -0.86 1.93 -1.25 -1.57 0.00 0.00 175.55 174.41 2eob s PRO 109 N 1.31 2.57 0.09 -1.71 0.04 -1.26 -2.23 135.00 133.80 2eob s PRO 109 Ca 0.04 -0.18 -0.24 0.00 0.04 0.00 0.00 61.00 60.66 2eob s PRO 109 Cb -0.18 -4.98 -0.13 0.00 0.04 0.00 0.00 34.50 29.24 2eob s PRO 109 CO -0.12 -3.29 0.53 0.28 0.04 0.00 0.00 177.00 174.44 2eob n VAL 110 N 7.79 0.85 -4.12 -0.36 0.31 0.15 -4.78 118.33 118.18 2eob n VAL 110 Ca 0.38 -0.21 -0.10 0.00 -0.01 0.00 0.00 64.34 64.39 2eob n VAL 110 Cb 0.48 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.30 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 -0.43 0.53 -1.37 2.52 -4.23 -1.26 -4.32 115.64 107.08 2eob s THR 111 Ca 0.54 -1.64 0.15 0.00 -1.18 0.00 0.00 61.69 59.55 2eob s THR 111 Cb -0.76 -1.30 0.24 0.00 1.34 0.00 0.00 72.50 72.01 2eob s THR 111 CO 0.40 -0.76 1.42 -0.81 -0.54 0.00 0.00 174.62 174.33 2eob n PRO 112 N 0.45 0.18 -0.05 3.99 -0.04 -1.26 -2.35 135.00 135.91 2eob n PRO 112 Ca -0.16 0.16 -0.07 0.00 -0.04 0.00 0.00 63.50 63.40 2eob n PRO 112 Cb 0.59 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.41 2eob n PRO 112 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2eob n GLU 113 N -1.32 0.66 -0.01 0.54 4.07 -1.26 -4.36 120.64 118.96 2eob n GLU 113 Ca 0.06 0.11 -0.13 0.00 -0.06 0.00 0.00 57.16 57.15 2eob n GLU 113 Cb 0.13 -1.65 -0.09 0.00 -0.06 0.00 0.00 31.44 29.77 2eob n GLU 113 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 2eob h LEU 114 N 0.00 0.07 -0.87 4.31 5.85 -1.88 -0.13 115.31 122.66 2eob h LEU 114 Ca -0.38 -0.39 0.22 0.00 0.84 0.00 0.00 57.88 58.17 2eob h LEU 114 Cb 2.01 -0.02 -0.15 0.00 0.37 0.00 0.00 40.66 42.86 2eob h LEU 114 CO 0.05 0.44 0.04 -0.07 -0.34 0.00 0.00 178.44 178.56 2eob h LEU 115 N -0.31 -0.36 0.03 2.25 -0.00 -1.76 0.82 115.31 115.99 2eob h LEU 115 Ca 0.01 0.23 -0.11 0.00 -0.00 0.00 0.00 57.88 58.00 2eob h LEU 115 Cb 0.41 0.39 0.01 0.00 -0.00 0.00 0.00 40.66 41.48 2eob h LEU 115 CO 0.00 -0.24 -0.47 1.05 -0.00 0.00 0.00 178.44 178.78 2eob h GLU 116 N 0.08 0.26 -0.02 1.13 4.11 -1.75 0.31 114.58 118.72 2eob h GLU 116 Ca 0.51 -0.32 0.00 0.00 0.07 0.00 0.00 59.36 59.62 2eob h GLU 116 Cb 0.98 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 2eob h GLU 116 CO -0.77 1.06 0.05 -0.09 0.07 0.00 0.00 179.01 179.32 2eob h ARG 117 N -0.38 0.00 0.00 1.06 2.43 0.64 -0.82 114.38 117.31 2eob h ARG 117 Ca -0.07 0.00 -0.40 0.00 -0.81 0.00 0.00 59.98 58.70 2eob h ARG 117 Cb 1.24 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.73 2eob h ARG 117 CO 0.09 0.00 -2.45 0.66 -1.51 0.00 0.00 179.97 176.76 2eob n TYR 118 N -3.32 0.00 0.41 2.20 4.02 0.27 -4.63 117.16 116.11 2eob n TYR 118 Ca -0.03 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.67 2eob n TYR 118 Cb 0.12 -0.96 -0.09 0.00 -0.02 0.00 0.00 39.34 38.39 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 -0.36 -1.08 -4.16 7.72 0.87 -0.08 -3.43 113.55 113.02 2eob h SER 119 Ca -0.60 0.06 -0.52 0.00 -1.23 0.00 0.00 61.79 59.50 2eob h SER 119 Cb 1.76 0.31 0.11 0.00 -0.44 0.00 0.00 62.40 64.14 2eob h SER 119 CO -0.21 -0.68 0.40 -0.83 -0.53 0.00 0.00 176.83 174.98 2eob s GLY 120 N -2.07 2.35 0.08 5.77 0.00 -0.34 -4.96 107.32 108.16 2eob s GLY 120 Ca -0.19 0.73 -0.31 0.00 0.00 0.00 0.00 44.72 44.96 2eob s GLY 120 CO 0.61 1.10 1.38 2.56 0.00 0.00 0.00 173.10 178.75 2eob s PRO 121 N -3.82 4.32 1.02 2.90 0.04 -1.26 -4.86 135.00 133.33 2eob s PRO 121 Ca 0.71 2.03 -0.22 0.00 0.04 0.00 0.00 61.00 63.56 2eob s PRO 121 Cb -0.24 -3.34 -0.10 0.00 0.04 0.00 0.00 34.50 30.86 2eob s PRO 121 CO 0.39 -0.46 -0.86 0.43 0.04 0.00 0.00 177.00 176.55 2eob n SER 122 N 4.29 -3.59 -3.15 6.66 7.64 -1.26 -5.02 113.62 119.19 2eob n SER 122 Ca 0.12 0.06 0.04 0.00 1.01 0.00 0.00 58.87 60.10 2eob n SER 122 Cb 0.43 -0.73 -0.01 0.00 -1.01 0.00 0.00 64.21 62.89 2eob n SER 122 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2eob s SER 123 N -1.27 -1.34 0.00 6.43 0.01 -1.26 -5.24 113.70 111.03 2eob s SER 123 Ca 0.43 0.71 0.00 0.00 1.31 0.00 0.00 55.95 58.40 2eob s SER 123 Cb -0.04 2.07 0.00 0.00 0.21 0.00 0.00 66.02 68.26 2eob s SER 123 CO 0.71 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.72