#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eob n SER 2 N 0.00 -2.08 -4.68 1.61 7.64 -1.26 -4.75 113.62 110.10 2eob n SER 2 Ca 0.00 0.86 -0.42 0.00 1.01 0.00 0.00 58.87 60.32 2eob n SER 2 Cb 0.00 -0.84 -0.03 0.00 -1.01 0.00 0.00 64.21 62.33 2eob n SER 2 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2eob s SER 3 N -0.93 6.55 0.00 6.43 0.01 -1.26 -4.23 113.70 120.28 2eob s SER 3 Ca 0.57 2.52 0.00 0.00 1.31 0.00 0.00 55.95 60.34 2eob s SER 3 Cb -0.70 -2.55 0.00 0.00 0.21 0.00 0.00 66.02 62.98 2eob s SER 3 CO 0.56 -0.95 0.00 0.61 0.41 0.00 0.00 173.24 173.87 2eob n GLY 4 N 4.18 0.57 3.03 3.44 0.00 -1.26 -5.16 105.19 109.98 2eob n GLY 4 Ca 0.17 -0.60 -0.16 0.00 0.00 0.00 0.00 46.02 45.43 2eob n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2eob s SER 5 N -0.26 0.94 0.70 1.61 0.15 -1.26 -5.15 113.70 110.43 2eob s SER 5 Ca 0.00 -0.29 -0.11 0.00 0.70 0.00 0.00 55.95 56.25 2eob s SER 5 Cb 0.00 -0.06 0.01 0.00 -1.71 0.00 0.00 66.02 64.26 2eob s SER 5 CO 0.00 -0.00 1.07 -0.94 1.20 0.00 0.00 173.24 174.57 2eob s SER 6 N -0.69 5.46 -0.27 5.45 1.04 -1.26 -4.68 113.70 118.75 2eob s SER 6 Ca -0.01 1.33 -0.02 0.00 0.48 0.00 0.00 55.95 57.73 2eob s SER 6 Cb -0.05 -2.20 0.00 0.00 0.10 0.00 0.00 66.02 63.87 2eob s SER 6 CO 0.00 -1.36 0.07 0.61 0.98 0.00 0.00 173.24 173.54 2eob n GLY 7 N -2.58 -3.66 3.76 7.32 0.00 -1.26 -4.94 105.19 103.83 2eob n GLY 7 Ca 0.07 0.43 -0.38 0.00 0.00 0.00 0.00 46.02 46.13 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 -1.47 5.87 1.03 1.61 1.47 -1.26 -5.01 116.67 118.92 2eob s ASP 8 Ca 0.03 2.62 -0.13 0.00 1.18 0.00 0.00 52.55 56.25 2eob s ASP 8 Cb -0.01 -2.63 0.20 0.00 -0.34 0.00 0.00 42.92 40.15 2eob s ASP 8 CO 0.64 -1.15 1.09 -2.16 0.68 0.00 0.00 175.17 174.28 2eob s PRO 9 N -2.61 0.17 -0.10 2.11 0.04 -1.26 -5.07 135.00 128.28 2eob s PRO 9 Ca 0.64 0.43 -0.00 0.00 0.04 0.00 0.00 61.00 62.11 2eob s PRO 9 Cb -0.37 -1.71 0.02 0.00 0.04 0.00 0.00 34.50 32.48 2eob s PRO 9 CO 0.45 -2.89 -0.06 0.54 0.04 0.00 0.00 177.00 175.09 2eob s VAL 10 N -2.97 0.86 0.48 -0.36 0.11 -1.26 -5.13 120.40 112.13 2eob s VAL 10 Ca 0.66 -0.20 -0.22 0.00 -2.93 0.00 0.00 61.98 59.29 2eob s VAL 10 Cb -0.18 -0.90 -0.07 0.00 -1.53 0.00 0.00 36.38 33.70 2eob s VAL 10 CO 0.58 0.33 1.16 -2.16 -3.33 0.00 0.00 175.10 171.68 2eob s PRO 11 N 1.62 3.66 -0.22 1.54 0.04 -1.26 -5.02 135.00 135.37 2eob s PRO 11 Ca 0.02 1.74 -0.13 0.00 0.04 0.00 0.00 61.00 62.67 2eob s PRO 11 Cb -0.13 -2.32 -0.04 0.00 0.04 0.00 0.00 34.50 32.05 2eob s PRO 11 CO -0.06 -0.62 0.28 1.21 0.04 0.00 0.00 177.00 177.85 2eob s ASN 12 N -1.45 6.29 0.00 6.66 3.84 -1.26 -4.95 114.94 124.06 2eob s ASN 12 Ca 0.66 0.32 0.15 0.00 0.21 0.00 0.00 52.86 54.20 2eob s ASN 12 Cb -0.28 -2.17 0.79 0.00 -0.55 0.00 0.00 41.25 39.04 2eob s ASN 12 CO 0.33 -0.01 1.39 -0.81 -2.79 0.00 0.00 177.10 175.22 2eob n PRO 13 N 4.37 0.27 -3.82 0.43 -0.04 -1.26 -4.39 135.00 130.57 2eob n PRO 13 Ca -0.12 0.11 -0.35 0.00 -0.04 0.00 0.00 63.50 63.10 2eob n PRO 13 Cb 0.52 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.35 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 -2.44 5.16 0.05 3.54 0.01 -1.26 -4.97 114.94 115.04 2eob s ASN 14 Ca 0.16 -1.95 -0.20 0.00 -0.71 0.00 0.00 52.86 50.17 2eob s ASN 14 Cb 0.10 -1.80 -0.14 0.00 0.41 0.00 0.00 41.25 39.83 2eob s ASN 14 CO 0.21 -0.49 1.35 1.55 -1.51 0.00 0.00 177.10 178.22 2eob h PRO 15 N 8.00 0.40 -0.02 -0.60 0.13 -1.99 -2.88 132.00 135.04 2eob h PRO 15 Ca -0.13 -0.21 0.01 0.00 -0.87 0.00 0.00 66.00 64.80 2eob h PRO 15 Cb 1.05 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 2eob h PRO 15 CO 0.66 0.77 0.36 1.12 -0.23 0.00 0.00 178.00 180.69 2eob h HIS 16 N 0.04 0.00 0.00 1.56 2.07 -1.97 0.50 115.15 117.35 2eob h HIS 16 Ca 0.03 0.00 -0.22 0.00 -2.85 0.00 0.00 60.37 57.33 2eob h HIS 16 Cb 0.70 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 30.64 2eob h HIS 16 CO 0.08 0.00 -1.72 -1.91 -3.07 0.00 0.00 177.93 171.31 2eob n GLU 17 N -2.92 0.64 0.00 5.12 2.13 -1.13 -3.95 120.64 120.54 2eob n GLU 17 Ca -0.01 0.15 0.15 0.00 0.66 0.00 0.00 57.16 58.11 2eob n GLU 17 Cb 0.42 -1.72 0.69 0.00 0.27 0.00 0.00 31.44 31.10 2eob n GLU 17 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2eob n SER 18 N -2.84 0.81 -4.77 4.31 7.64 0.17 -4.86 113.62 114.07 2eob n SER 18 Ca -0.15 -1.19 -0.36 0.00 1.01 0.00 0.00 58.87 58.18 2eob n SER 18 Cb 0.92 -0.01 0.01 0.00 -1.01 0.00 0.00 64.21 64.12 2eob n SER 18 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2eob s LYS 19 N -2.07 3.37 0.27 1.43 -0.14 -0.57 -4.95 119.74 117.09 2eob s LYS 19 Ca 0.40 1.70 0.05 0.00 -1.36 0.00 0.00 55.97 56.76 2eob s LYS 19 Cb 0.21 -2.08 0.38 0.00 -1.68 0.00 0.00 37.83 34.66 2eob s LYS 19 CO 0.37 -0.85 1.65 -1.00 -0.76 0.00 0.00 175.35 174.76 2eob h PRO 20 N 1.33 0.27 -0.01 -1.68 0.13 -1.92 -2.71 132.00 127.41 2eob h PRO 20 Ca -0.50 -0.14 0.00 0.00 -0.87 0.00 0.00 66.00 64.49 2eob h PRO 20 Cb 1.27 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.40 2eob h PRO 20 CO 0.57 0.68 -0.03 -2.67 -0.23 0.00 0.00 178.00 176.33 2eob n TRP 21 N -3.99 0.00 -3.01 1.56 4.27 -1.26 -4.19 117.44 110.83 2eob n TRP 21 Ca -0.02 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.18 2eob n TRP 21 Cb 0.52 -0.02 -0.05 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 -2.07 3.29 -0.01 -2.67 6.14 -1.02 -2.97 117.35 118.05 2eob s TYR 22 Ca 0.39 0.96 0.01 0.00 0.64 0.00 0.00 57.07 59.06 2eob s TYR 22 Cb 0.21 -2.94 -0.04 0.00 0.42 0.00 0.00 41.96 39.62 2eob s TYR 22 CO 0.37 -0.36 0.02 0.71 0.64 0.00 0.00 175.55 176.92 2eob s TYR 23 N 2.66 3.12 0.00 4.97 2.02 0.64 -4.85 117.35 125.91 2eob s TYR 23 Ca 0.30 0.11 0.00 0.00 -0.37 0.00 0.00 57.07 57.11 2eob s TYR 23 Cb -0.15 -1.69 0.00 0.00 -0.40 0.00 0.00 41.96 39.72 2eob s TYR 23 CO 0.08 0.48 0.00 -0.40 -1.57 0.00 0.00 175.55 174.14 2eob n ASP 24 N 1.38 3.51 -2.05 2.29 5.75 -1.26 -2.29 116.55 123.88 2eob n ASP 24 Ca -0.14 0.00 -0.26 0.00 -0.01 0.00 0.00 54.79 54.38 2eob n ASP 24 Cb 0.53 0.14 0.05 0.00 -1.03 0.00 0.00 41.12 40.81 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 -2.10 3.20 -4.09 0.11 1.85 -1.26 -4.69 116.66 109.68 2eob n ARG 25 Ca 0.00 -3.83 -0.25 0.00 -1.00 0.00 0.00 57.85 52.77 2eob n ARG 25 Cb 0.40 -2.25 -0.05 0.00 -1.05 0.00 0.00 32.46 29.51 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 -3.64 3.79 0.30 2.89 2.96 -1.26 -5.13 118.68 118.58 2eob s LEU 26 Ca 0.55 -0.16 0.03 0.00 -0.22 0.00 0.00 54.13 54.32 2eob s LEU 26 Cb 0.44 -2.39 -0.05 0.00 0.50 0.00 0.00 46.19 44.69 2eob s LEU 26 CO 0.02 0.05 0.09 -0.44 -1.32 0.00 0.00 176.35 174.75 2eob s SER 27 N -3.23 1.77 0.33 3.68 0.01 -1.26 -4.94 113.70 110.06 2eob s SER 27 Ca 0.31 -1.43 0.05 0.00 1.31 0.00 0.00 55.95 56.19 2eob s SER 27 Cb -0.10 0.13 0.57 0.00 0.21 0.00 0.00 66.02 66.84 2eob s SER 27 CO 0.24 -0.72 1.83 0.08 0.41 0.00 0.00 173.24 175.07 2eob h ARG 28 N 2.22 0.45 0.00 12.44 0.11 -2.00 0.34 114.38 127.94 2eob h ARG 28 Ca -0.38 -0.12 0.00 0.00 0.10 0.00 0.00 59.98 59.57 2eob h ARG 28 Cb 1.25 -0.05 0.00 0.00 1.11 0.00 0.00 29.97 32.28 2eob h ARG 28 CO 0.63 0.57 0.06 0.41 0.10 0.00 0.00 179.97 181.73 2eob n GLY 29 N -0.70 -0.83 0.00 0.08 0.00 -1.26 -2.60 105.19 99.88 2eob n GLY 29 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.24 2.70 0.00 1.61 -0.58 -0.86 -4.66 120.64 116.62 2eob n GLU 30 Ca -0.01 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.73 2eob n GLU 30 Cb 0.09 -0.96 0.00 0.00 -0.57 0.00 0.00 31.44 30.00 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 -2.01 -0.33 -0.33 0.62 0.00 0.11 -1.01 120.51 117.57 2eob n ALA 31 Ca 0.00 0.00 0.25 0.00 0.00 0.00 0.00 53.44 53.69 2eob n ALA 31 Cb 0.46 0.00 0.48 0.00 0.00 0.00 0.00 19.45 20.39 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 0.12 0.47 0.00 5.08 -1.75 0.19 114.58 118.69 2eob h GLU 32 Ca 0.00 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 2eob h GLU 32 Cb 0.00 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.23 2eob h GLU 32 CO 0.00 0.08 -0.22 0.22 -1.00 0.00 0.00 179.01 178.08 2eob h ASP 33 N 0.12 -0.53 -0.71 1.42 3.58 -1.72 -3.13 116.42 115.45 2eob h ASP 33 Ca 0.75 -0.01 0.06 0.00 0.42 0.00 0.00 57.03 58.25 2eob h ASP 33 Cb 1.82 0.14 -0.09 0.00 1.72 0.00 0.00 39.33 42.93 2eob h ASP 33 CO -0.73 -0.33 -0.42 0.23 -2.88 0.00 0.00 179.24 175.11 2eob n MET 34 N -5.33 -0.31 -0.28 0.28 2.81 0.67 0.87 117.12 115.83 2eob n MET 34 Ca -0.11 1.20 0.09 0.00 -1.81 0.00 0.00 57.70 57.06 2eob n MET 34 Cb 0.28 -1.77 0.22 0.00 -0.71 0.00 0.00 33.22 31.23 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 -0.22 -1.43 4.03 -0.00 -1.52 0.67 115.31 116.84 2eob h LEU 35 Ca 0.11 0.20 0.09 0.00 -0.00 0.00 0.00 57.88 58.29 2eob h LEU 35 Cb 0.29 0.32 -0.05 0.00 -0.00 0.00 0.00 40.66 41.23 2eob h LEU 35 CO -0.67 -0.18 0.48 0.24 -0.00 0.00 0.00 178.44 178.31 2eob h MET 36 N 0.14 0.63 -0.16 1.13 2.86 0.53 -1.99 114.93 118.07 2eob h MET 36 Ca 0.48 -0.04 -0.12 0.00 -2.06 0.00 0.00 59.70 57.96 2eob h MET 36 Cb 0.90 -0.14 0.00 0.00 0.06 0.00 0.00 31.60 32.42 2eob h MET 36 CO -0.68 0.42 -0.37 0.00 1.06 0.00 0.00 176.91 177.34 2eob h ARG 37 N 0.65 0.54 -6.02 1.72 -0.00 0.12 -3.43 114.38 107.95 2eob h ARG 37 Ca 0.33 -0.36 -0.58 0.00 -0.50 0.00 0.00 59.98 58.86 2eob h ARG 37 Cb 0.44 0.05 0.00 0.00 0.00 0.00 0.00 29.97 30.46 2eob h ARG 37 CO -0.12 0.98 1.47 0.42 0.00 0.00 0.00 179.97 182.72 2eob s ILE 38 N -3.98 3.01 -2.00 2.04 -1.09 -0.45 -4.81 121.20 113.92 2eob s ILE 38 Ca -0.13 0.01 0.14 0.00 -2.23 0.00 0.00 60.65 58.44 2eob s ILE 38 Cb 0.06 -3.02 0.39 0.00 -1.58 0.00 0.00 42.46 38.32 2eob s ILE 38 CO 0.81 -0.01 1.24 -0.81 -1.23 0.00 0.00 174.94 174.95 2eob n PRO 39 N 8.66 0.49 -3.59 2.79 -0.04 -1.26 -4.61 135.00 137.44 2eob n PRO 39 Ca 0.29 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.36 2eob n PRO 39 Cb 0.45 -1.44 -0.11 0.00 -0.04 0.00 0.00 33.50 32.36 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 3.66 -0.13 0.54 1.81 -1.26 -5.06 118.95 116.51 2eob s ARG 40 Ca 0.21 -0.52 -0.29 0.00 -1.72 0.00 0.00 55.73 53.40 2eob s ARG 40 Cb 0.09 -3.67 -0.02 0.00 -0.45 0.00 0.00 34.95 30.90 2eob s ARG 40 CO 0.16 -0.32 1.25 0.34 -0.68 0.00 0.00 175.30 176.05 2eob s ASP 41 N 1.71 6.98 0.00 0.23 2.15 -1.26 -3.28 116.67 123.19 2eob s ASP 41 Ca 0.06 1.74 0.00 0.00 0.43 0.00 0.00 52.55 54.78 2eob s ASP 41 Cb -0.17 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 2eob s ASP 41 CO 0.09 -0.70 0.00 0.61 -0.17 0.00 0.00 175.17 175.00 2eob n GLY 42 N 3.54 1.49 3.18 2.66 0.00 -1.22 -4.85 105.19 109.98 2eob n GLY 42 Ca 0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.80 2eob n GLY 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eob n ALA 43 N 0.00 -4.61 -3.82 4.61 0.00 -1.21 -4.04 120.51 111.44 2eob n ALA 43 Ca 0.00 -1.13 -0.08 0.00 0.00 0.00 0.00 53.44 52.24 2eob n ALA 43 Cb 0.00 -1.29 -0.01 0.00 0.00 0.00 0.00 19.45 18.15 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 -2.16 -0.08 -0.28 0.00 -0.71 -1.14 -2.48 117.98 111.14 2eob s PHE 44 Ca 0.48 -0.44 -0.21 0.00 -1.04 0.00 0.00 56.93 55.71 2eob s PHE 44 Cb -0.07 0.73 0.12 0.00 -1.21 0.00 0.00 43.02 42.58 2eob s PHE 44 CO 0.69 -1.33 0.95 -0.48 -1.34 0.00 0.00 175.22 173.70 2eob s LEU 45 N -2.97 -0.55 -0.17 -1.99 0.05 -0.08 0.57 118.68 113.54 2eob s LEU 45 Ca 0.13 0.98 -0.04 0.00 0.05 0.00 0.00 54.13 55.25 2eob s LEU 45 Cb -0.06 1.95 -0.03 0.00 -2.05 0.00 0.00 46.19 46.01 2eob s LEU 45 CO 0.08 -0.16 -0.03 -0.63 -0.55 0.00 0.00 176.35 175.06 2eob s ILE 46 N 0.73 3.88 0.29 1.48 1.01 -1.16 -0.85 121.20 126.58 2eob s ILE 46 Ca -0.02 -0.35 0.02 0.00 0.00 0.00 0.00 60.65 60.30 2eob s ILE 46 Cb -0.05 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.66 2eob s ILE 46 CO -0.10 0.47 0.10 0.00 0.00 0.00 0.00 174.94 175.42 2eob s ARG 47 N 0.59 1.53 -0.02 2.79 1.70 -1.15 -0.26 118.95 124.13 2eob s ARG 47 Ca -0.02 -1.85 0.06 0.00 -0.47 0.00 0.00 55.73 53.45 2eob s ARG 47 Cb -0.14 -0.40 -0.02 0.00 -0.57 0.00 0.00 34.95 33.81 2eob s ARG 47 CO 0.02 -0.31 -0.20 0.21 -1.08 0.00 0.00 175.30 173.94 2eob s LYS 48 N -3.95 2.23 0.09 3.89 2.36 -0.97 -2.46 119.74 120.93 2eob s LYS 48 Ca 0.36 -0.86 0.04 0.00 -2.55 0.00 0.00 55.97 52.96 2eob s LYS 48 Cb 0.07 -2.18 -0.04 0.00 -1.05 0.00 0.00 37.83 34.63 2eob s LYS 48 CO 0.15 0.58 0.04 1.03 1.55 0.00 0.00 175.35 178.70 2eob s ARG 49 N -0.83 2.71 0.41 4.03 3.00 -1.26 -4.85 118.95 122.16 2eob s ARG 49 Ca 0.11 -0.78 -0.14 0.00 0.00 0.00 0.00 55.73 54.92 2eob s ARG 49 Cb -0.10 -2.62 -0.08 0.00 0.00 0.00 0.00 34.95 32.15 2eob s ARG 49 CO 0.01 0.55 0.83 -1.83 0.00 0.00 0.00 175.30 174.85 2eob s GLU 50 N -2.41 3.92 0.05 3.54 -1.05 -1.26 -3.78 118.70 117.71 2eob s GLU 50 Ca 0.28 0.70 0.00 0.00 -0.15 0.00 0.00 54.97 55.80 2eob s GLU 50 Cb -0.12 -2.32 0.00 0.00 -0.44 0.00 0.00 34.13 31.25 2eob s GLU 50 CO 0.20 -0.04 0.00 0.41 0.95 0.00 0.00 175.26 176.78 2eob n GLY 51 N -1.06 1.00 0.42 -3.83 0.00 -1.26 -4.14 105.19 96.33 2eob n GLY 51 Ca 0.04 0.55 0.35 0.00 0.00 0.00 0.00 46.02 46.95 2eob n GLY 51 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2eob n THR 52 N 0.00 -0.14 -1.94 2.61 5.66 -1.26 -4.69 114.28 114.52 2eob n THR 52 Ca 0.00 1.35 -0.18 0.00 -3.05 0.00 0.00 64.05 62.17 2eob n THR 52 Cb 0.00 -2.23 -0.04 0.00 -1.55 0.00 0.00 70.33 66.51 2eob n THR 52 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 175.07 172.49 2eob n ASP 53 N -4.06 -5.26 -3.95 1.09 8.00 -1.25 -4.97 116.55 106.15 2eob n ASP 53 Ca 0.33 0.22 -0.29 0.00 0.71 0.00 0.00 54.79 55.75 2eob n ASP 53 Cb 1.33 -4.35 -0.16 0.00 -0.02 0.00 0.00 41.12 37.92 2eob n ASP 53 CO 0.00 0.00 0.00 -0.44 -0.39 0.00 0.00 177.20 176.37 2eob s SER 54 N -2.49 3.10 0.80 -2.24 0.01 -1.26 -4.90 113.70 106.72 2eob s SER 54 Ca 0.00 -0.77 -0.11 0.00 1.31 0.00 0.00 55.95 56.38 2eob s SER 54 Cb 0.00 -1.08 0.08 0.00 0.21 0.00 0.00 66.02 65.22 2eob s SER 54 CO 0.00 -0.16 1.12 -0.31 0.41 0.00 0.00 173.24 174.30 2eob s TYR 55 N 1.51 2.22 -0.05 2.43 1.51 -1.09 -4.10 117.35 119.79 2eob s TYR 55 Ca -0.00 1.64 -0.01 0.00 -1.01 0.00 0.00 57.07 57.68 2eob s TYR 55 Cb -0.16 -3.20 0.03 0.00 -0.11 0.00 0.00 41.96 38.52 2eob s TYR 55 CO -0.08 -2.19 0.02 0.00 -1.11 0.00 0.00 175.55 172.19 2eob s ALA 56 N -2.67 0.44 -0.24 3.71 0.00 -1.03 0.43 121.76 122.40 2eob s ALA 56 Ca 0.65 0.06 -0.12 0.00 0.00 0.00 0.00 51.96 52.55 2eob s ALA 56 Cb -0.21 -0.59 -0.05 0.00 0.00 0.00 0.00 23.12 22.28 2eob s ALA 56 CO 0.54 -0.37 0.25 -1.50 0.00 0.00 0.00 175.76 174.68 2eob s ILE 57 N 1.79 5.29 0.25 0.00 2.07 -0.85 -2.94 121.20 126.81 2eob s ILE 57 Ca 0.01 0.35 0.06 0.00 -1.41 0.00 0.00 60.65 59.66 2eob s ILE 57 Cb -0.12 -3.58 -0.03 0.00 0.13 0.00 0.00 42.46 38.85 2eob s ILE 57 CO -0.04 0.28 0.29 -0.89 -1.91 0.00 0.00 174.94 172.68 2eob s THR 58 N 1.39 4.79 0.37 4.00 2.01 -0.03 -2.01 115.64 126.17 2eob s THR 58 Ca 0.11 -1.18 -0.11 0.00 0.31 0.00 0.00 61.69 60.81 2eob s THR 58 Cb -0.15 -3.62 0.04 0.00 0.01 0.00 0.00 72.50 68.79 2eob s THR 58 CO 0.07 -0.33 0.69 0.72 -0.69 0.00 0.00 174.62 175.09 2eob s PHE 59 N -2.07 0.43 -0.14 4.92 -0.71 -1.17 -0.90 117.98 118.34 2eob s PHE 59 Ca 0.34 -0.96 -0.01 0.00 -1.04 0.00 0.00 56.93 55.26 2eob s PHE 59 Cb -0.08 0.54 -0.02 0.00 -1.21 0.00 0.00 43.02 42.25 2eob s PHE 59 CO 0.27 -1.44 -0.10 0.50 -1.34 0.00 0.00 175.22 173.12 2eob s ARG 60 N -2.54 3.48 -0.45 1.99 3.52 -1.04 -3.45 118.95 120.46 2eob s ARG 60 Ca 0.20 -0.63 0.02 0.00 -0.13 0.00 0.00 55.73 55.19 2eob s ARG 60 Cb -0.04 -2.72 0.12 0.00 -1.56 0.00 0.00 34.95 30.75 2eob s ARG 60 CO 0.14 0.22 0.20 0.00 -0.81 0.00 0.00 175.30 175.05 2eob s ALA 61 N 0.36 3.17 -1.17 6.12 0.00 0.64 -3.45 121.76 127.43 2eob s ALA 61 Ca -0.09 -2.90 -0.01 0.00 0.00 0.00 0.00 51.96 48.96 2eob s ALA 61 Cb -0.15 -2.19 0.00 0.00 0.00 0.00 0.00 23.12 20.78 2eob s ALA 61 CO 0.05 -1.88 0.02 -2.13 0.00 0.00 0.00 175.76 171.83 2eob n ARG 62 N 3.78 -0.93 0.00 0.00 3.00 -1.26 0.16 116.66 121.42 2eob n ARG 62 Ca 0.04 0.06 0.00 0.00 -0.00 0.00 0.00 57.85 57.95 2eob n ARG 62 Cb 0.38 -2.68 0.00 0.00 0.00 0.00 0.00 32.46 30.16 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 -2.19 3.05 3.18 5.14 0.00 -1.26 -5.06 105.19 108.05 2eob n GLY 63 Ca -0.24 -0.82 -0.27 0.00 0.00 0.00 0.00 46.02 44.68 2eob n GLY 63 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2eob n LYS 64 N 0.00 -3.12 -3.39 1.61 5.02 0.12 -4.79 118.16 113.61 2eob n LYS 64 Ca 0.00 -1.58 -0.13 0.00 -2.02 0.00 0.00 58.31 54.58 2eob n LYS 64 Cb 0.00 -1.52 -0.09 0.00 -0.02 0.00 0.00 35.03 33.39 2eob n LYS 64 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2eob s VAL 65 N -2.75 -0.50 0.61 -0.18 1.01 -1.26 -0.26 120.40 117.08 2eob s VAL 65 Ca 0.65 -0.16 0.06 0.00 0.00 0.00 0.00 61.98 62.53 2eob s VAL 65 Cb -0.07 -0.81 0.09 0.00 0.00 0.00 0.00 36.38 35.59 2eob s VAL 65 CO 0.50 -0.20 0.84 -0.54 0.00 0.00 0.00 175.10 175.70 2eob s LYS 66 N 2.46 2.14 0.13 2.72 -0.14 -1.22 -4.94 119.74 120.88 2eob s LYS 66 Ca 0.10 -1.40 0.00 0.00 -1.36 0.00 0.00 55.97 53.32 2eob s LYS 66 Cb -0.15 -2.54 -0.04 0.00 -1.68 0.00 0.00 37.83 33.41 2eob s LYS 66 CO -0.18 -1.01 0.00 -1.01 -0.76 0.00 0.00 175.35 172.39 2eob s HIS 67 N -2.81 0.95 -0.10 3.18 3.76 -1.26 -3.05 115.29 115.95 2eob s HIS 67 Ca 0.63 -1.08 -0.04 0.00 -0.15 0.00 0.00 55.06 54.43 2eob s HIS 67 Cb -0.06 -0.55 0.05 0.00 1.11 0.00 0.00 32.58 33.13 2eob s HIS 67 CO 0.40 -0.32 0.17 0.00 -0.85 0.00 0.00 174.74 174.14 2eob s ARG 69 N 2.30 4.00 0.02 0.00 6.06 -1.26 -2.01 118.95 128.05 2eob s ARG 69 Ca 0.03 2.15 0.06 0.00 -2.50 0.00 0.00 55.73 55.47 2eob s ARG 69 Cb -0.12 -2.78 -0.02 0.00 0.06 0.00 0.00 34.95 32.09 2eob s ARG 69 CO -0.07 -0.47 -0.18 0.42 -2.50 0.00 0.00 175.30 172.51 2eob s ILE 70 N -1.26 1.42 0.31 4.11 1.01 0.17 -4.83 121.20 122.13 2eob s ILE 70 Ca 0.56 -0.98 0.06 0.00 0.00 0.00 0.00 60.65 60.29 2eob s ILE 70 Cb -0.38 -1.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.85 2eob s ILE 70 CO 0.49 0.22 0.21 -3.20 0.00 0.00 0.00 174.94 172.66 2eob n ASN 71 N 2.16 -0.03 -3.99 3.58 2.85 -0.33 -2.68 115.26 116.83 2eob n ASN 71 Ca -0.16 -2.89 -0.09 0.00 -0.11 0.00 0.00 54.58 51.33 2eob n ASN 71 Cb 0.54 1.27 -0.10 0.00 1.24 0.00 0.00 39.78 42.72 2eob n ASN 71 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2eob s ARG 72 N -3.23 0.42 -0.27 1.20 1.70 -1.26 0.39 118.95 117.90 2eob s ARG 72 Ca 0.29 -0.74 -0.00 0.00 -0.47 0.00 0.00 55.73 54.81 2eob s ARG 72 Cb 0.01 0.15 0.15 0.00 -0.57 0.00 0.00 34.95 34.70 2eob s ARG 72 CO 0.21 -0.08 0.41 -0.51 -1.08 0.00 0.00 175.30 174.25 2eob s ASP 73 N -1.84 0.14 -0.26 -2.89 1.01 -0.79 -4.83 116.67 107.22 2eob s ASP 73 Ca -0.10 0.01 -0.04 0.00 0.71 0.00 0.00 52.55 53.13 2eob s ASP 73 Cb -0.05 1.21 0.00 0.00 1.01 0.00 0.00 42.92 45.10 2eob s ASP 73 CO -0.03 -0.32 0.29 0.61 0.21 0.00 0.00 175.17 175.93 2eob n GLY 74 N 5.37 -0.86 2.19 0.21 0.00 -1.26 -3.52 105.19 107.32 2eob n GLY 74 Ca -0.01 0.32 -0.01 0.00 0.00 0.00 0.00 46.02 46.32 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 -0.85 -2.52 -4.41 1.61 1.85 -1.26 -4.85 116.66 106.23 2eob n ARG 75 Ca 0.03 0.06 -0.20 0.00 -1.00 0.00 0.00 57.85 56.74 2eob n ARG 75 Cb 0.35 -4.46 -0.10 0.00 -1.05 0.00 0.00 32.46 27.19 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 -1.85 1.79 -0.17 2.89 3.76 -1.23 -4.81 115.29 115.66 2eob s HIS 76 Ca 0.00 -1.08 0.01 0.00 -0.15 0.00 0.00 55.06 53.84 2eob s HIS 76 Cb 0.00 -1.12 0.01 0.00 1.11 0.00 0.00 32.58 32.58 2eob s HIS 76 CO 0.00 -0.16 -0.18 -0.06 -0.85 0.00 0.00 174.74 173.49 2eob s PHE 77 N -3.46 2.77 -0.17 1.40 0.08 0.77 -1.88 117.98 117.49 2eob s PHE 77 Ca 0.36 -1.38 -0.05 0.00 0.12 0.00 0.00 56.93 55.98 2eob s PHE 77 Cb 0.08 -1.91 -0.03 0.00 -0.57 0.00 0.00 43.02 40.59 2eob s PHE 77 CO 0.15 -0.66 -0.01 0.08 -0.10 0.00 0.00 175.22 174.68 2eob s VAL 78 N 1.09 4.10 -0.05 -0.44 1.01 0.16 -1.67 120.40 124.60 2eob s VAL 78 Ca -0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 61.67 2eob s VAL 78 Cb -0.14 -2.82 -0.01 0.00 0.00 0.00 0.00 36.38 33.40 2eob s VAL 78 CO -0.07 0.47 -0.07 -0.11 0.00 0.00 0.00 175.10 175.33 2eob n LEU 79 N 3.69 0.69 0.00 3.92 -0.00 -1.20 -1.19 117.00 122.92 2eob n LEU 79 Ca -0.17 0.40 0.00 0.00 -0.00 0.00 0.00 56.01 56.23 2eob n LEU 79 Cb 0.52 -0.64 0.00 0.00 -0.00 0.00 0.00 43.42 43.30 2eob n LEU 79 CO 0.33 -0.49 0.00 0.61 -0.00 0.00 0.00 177.39 177.84 2eob n GLY 80 N 1.70 1.93 0.07 -3.96 0.00 -1.26 -4.67 105.19 98.99 2eob n GLY 80 Ca -0.03 -0.10 -0.11 0.00 0.00 0.00 0.00 46.02 45.78 2eob n GLY 80 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 2eob h THR 81 N 0.00 1.31 -3.18 2.61 2.02 -2.02 -3.41 112.91 110.24 2eob h THR 81 Ca 0.00 -2.00 -0.63 0.00 0.77 0.00 0.00 66.41 64.55 2eob h THR 81 Cb 0.00 2.50 -0.42 0.00 -1.74 0.00 0.00 68.15 68.49 2eob h THR 81 CO 0.00 0.44 -0.59 -0.44 0.37 0.00 0.00 175.52 175.30 2eob s SER 82 N -6.08 4.65 -0.30 4.18 0.01 -1.26 -5.02 113.70 109.88 2eob s SER 82 Ca -0.15 -3.57 -0.07 0.00 1.31 0.00 0.00 55.95 53.47 2eob s SER 82 Cb -0.02 -1.63 0.16 0.00 0.21 0.00 0.00 66.02 64.74 2eob s SER 82 CO 0.52 -0.13 0.69 0.00 0.41 0.00 0.00 173.24 174.72 2eob s ALA 83 N -1.06 -2.30 0.06 1.44 0.00 -1.26 -5.04 121.76 113.61 2eob s ALA 83 Ca 0.22 2.06 0.09 0.00 0.00 0.00 0.00 51.96 54.33 2eob s ALA 83 Cb -0.12 -2.01 -0.03 0.00 0.00 0.00 0.00 23.12 20.96 2eob s ALA 83 CO -0.11 -1.13 -0.24 0.71 0.00 0.00 0.00 175.76 175.00 2eob s TYR 84 N 2.84 2.05 -0.21 0.00 1.51 -1.26 -3.21 117.35 119.07 2eob s TYR 84 Ca 0.05 -0.39 -0.09 0.00 -1.01 0.00 0.00 57.07 55.63 2eob s TYR 84 Cb -0.12 -1.19 0.08 0.00 -0.11 0.00 0.00 41.96 40.61 2eob s TYR 84 CO -0.19 0.15 0.48 -0.06 -1.11 0.00 0.00 175.55 174.82 2eob s PHE 85 N -0.88 -0.83 0.47 2.71 0.40 -0.67 -4.96 117.98 114.22 2eob s PHE 85 Ca 0.10 1.62 0.24 0.00 -0.60 0.00 0.00 56.93 58.28 2eob s PHE 85 Cb -0.10 0.39 1.26 0.00 0.51 0.00 0.00 43.02 45.08 2eob s PHE 85 CO 0.03 -0.46 1.86 1.49 0.70 0.00 0.00 175.22 178.84 2eob h GLU 86 N 7.66 0.22 -2.22 0.44 4.57 -1.87 0.22 114.58 123.60 2eob h GLU 86 Ca -0.25 -0.01 -0.06 0.00 -1.18 0.00 0.00 59.36 57.86 2eob h GLU 86 Cb 1.15 -0.05 -0.22 0.00 -0.16 0.00 0.00 28.75 29.47 2eob h GLU 86 CO 0.18 0.15 0.02 -1.54 -1.18 0.00 0.00 179.01 176.63 2eob s SER 87 N -5.61 -0.66 0.60 1.04 1.04 -1.26 -4.60 113.70 104.25 2eob s SER 87 Ca -0.07 1.27 0.29 0.00 0.48 0.00 0.00 55.95 57.92 2eob s SER 87 Cb 0.22 1.28 1.05 0.00 0.10 0.00 0.00 66.02 68.68 2eob s SER 87 CO 0.78 -0.22 1.40 -0.07 0.98 0.00 0.00 173.24 176.11 2eob h LEU 88 N 5.26 0.00 -0.45 2.42 3.38 -1.95 0.64 115.31 124.60 2eob h LEU 88 Ca -0.29 0.00 0.03 0.00 0.09 0.00 0.00 57.88 57.71 2eob h LEU 88 Cb 1.17 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.89 2eob h LEU 88 CO 0.11 0.00 0.26 0.58 0.09 0.00 0.00 178.44 179.48 2eob h VAL 89 N 0.00 1.02 0.00 1.22 2.07 -1.94 -1.75 116.25 116.87 2eob h VAL 89 Ca 0.49 -0.18 -0.08 0.00 0.82 0.00 0.00 66.70 67.76 2eob h VAL 89 Cb 2.78 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 33.00 2eob h VAL 89 CO -0.01 0.09 -0.36 -0.33 0.02 0.00 0.00 177.57 176.99 2eob h GLU 90 N 0.51 0.00 -0.31 1.57 4.39 -0.11 -2.93 114.58 117.70 2eob h GLU 90 Ca 0.19 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.88 2eob h GLU 90 Cb 0.04 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 2eob h GLU 90 CO -0.10 0.36 0.17 1.25 -1.16 0.00 0.00 179.01 179.53 2eob h LEU 91 N 0.00 0.40 -0.44 1.33 6.46 -1.26 -1.07 115.31 120.73 2eob h LEU 91 Ca -0.00 -0.09 -0.07 0.00 -0.12 0.00 0.00 57.88 57.60 2eob h LEU 91 Cb 0.74 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.56 2eob h LEU 91 CO 0.05 0.37 0.02 0.58 -0.62 0.00 0.00 178.44 178.84 2eob h VAL 92 N 0.39 1.26 0.00 1.05 2.07 -1.37 -1.28 116.25 118.36 2eob h VAL 92 Ca 0.11 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.63 2eob h VAL 92 Cb 0.07 1.04 0.00 0.00 -1.52 0.00 0.00 31.29 30.88 2eob h VAL 92 CO -0.02 0.35 0.00 -1.20 0.02 0.00 0.00 177.57 176.72 2eob n SER 93 N -4.42 0.00 -0.11 0.57 7.64 -1.12 -2.10 113.62 114.09 2eob n SER 93 Ca -0.00 0.28 -0.24 0.00 1.01 0.00 0.00 58.87 59.92 2eob n SER 93 Cb 0.29 -0.39 -0.11 0.00 -1.01 0.00 0.00 64.21 62.98 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 -1.39 0.43 0.48 1.43 9.36 -0.42 -4.26 117.16 122.79 2eob n TYR 94 Ca 0.06 0.15 0.11 0.00 3.32 0.00 0.00 57.90 61.54 2eob n TYR 94 Cb 0.16 -1.05 0.44 0.00 -0.63 0.00 0.00 39.34 38.26 2eob n TYR 94 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2eob n TYR 95 N -4.00 0.59 0.26 2.98 4.01 -0.54 -2.86 117.16 117.60 2eob n TYR 95 Ca -0.44 0.22 0.16 0.00 -0.16 0.00 0.00 57.90 57.67 2eob n TYR 95 Cb 0.88 -0.86 0.84 0.00 -0.31 0.00 0.00 39.34 39.89 2eob n TYR 95 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 2eob h GLU 96 N 0.00 0.00 0.00 -0.72 4.39 -1.60 -1.39 114.58 115.25 2eob h GLU 96 Ca 0.00 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.52 2eob h GLU 96 Cb 0.39 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.00 2eob h GLU 96 CO 0.00 0.00 -1.77 1.63 -1.16 0.00 0.00 179.01 177.71 2eob n LYS 97 N -2.66 1.83 -4.48 2.33 4.76 -1.14 -4.78 118.16 114.03 2eob n LYS 97 Ca -0.02 -0.02 -0.33 0.00 -2.87 0.00 0.00 58.31 55.07 2eob n LYS 97 Cb 0.16 -1.30 -0.15 0.00 -1.84 0.00 0.00 35.03 31.90 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 -2.37 2.78 0.38 2.13 3.76 -0.52 -5.09 115.29 116.36 2eob s HIS 98 Ca -0.06 -1.09 -0.23 0.00 -0.15 0.00 0.00 55.06 53.53 2eob s HIS 98 Cb 0.04 -1.90 -0.14 0.00 1.11 0.00 0.00 32.58 31.69 2eob s HIS 98 CO 0.49 -0.51 0.42 0.00 -0.85 0.00 0.00 174.74 174.29 2eob n ALA 99 N 4.13 -2.10 -0.04 -1.40 0.00 -1.26 -4.52 120.51 115.33 2eob n ALA 99 Ca -0.19 0.19 -0.22 0.00 0.00 0.00 0.00 53.44 53.22 2eob n ALA 99 Cb 0.52 -1.67 -0.13 0.00 0.00 0.00 0.00 19.45 18.17 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 0.72 0.23 0.00 0.00 5.85 -1.75 -3.46 115.31 116.91 2eob h LEU 100 Ca -0.38 -0.75 0.00 0.00 0.84 0.00 0.00 57.88 57.60 2eob h LEU 100 Cb 1.42 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.37 2eob h LEU 100 CO 0.51 1.67 0.00 0.00 -0.34 0.00 0.00 178.44 180.28 2eob n TYR 101 N -3.95 0.00 -3.64 1.25 9.36 -1.26 -5.11 117.16 113.80 2eob n TYR 101 Ca -0.31 0.00 -0.04 0.00 3.32 0.00 0.00 57.90 60.87 2eob n TYR 101 Cb 0.87 0.00 -0.07 0.00 -0.63 0.00 0.00 39.34 39.52 2eob n TYR 101 CO 0.00 0.00 0.00 0.50 0.22 0.00 0.00 176.86 177.58 2eob s ARG 102 N -0.75 0.47 -1.57 2.98 6.06 -1.26 -4.97 118.95 119.91 2eob s ARG 102 Ca 0.00 0.80 -0.06 0.00 -2.50 0.00 0.00 55.73 53.97 2eob s ARG 102 Cb 0.00 0.10 0.05 0.00 0.06 0.00 0.00 34.95 35.16 2eob s ARG 102 CO 0.00 -0.10 0.33 1.63 -2.50 0.00 0.00 175.30 174.66 2eob n LYS 103 N 3.79 -2.00 -3.60 5.12 4.76 -1.26 -4.91 118.16 120.07 2eob n LYS 103 Ca -0.19 0.24 -0.10 0.00 -2.87 0.00 0.00 58.31 55.40 2eob n LYS 103 Cb 0.58 -4.26 -0.06 0.00 -1.84 0.00 0.00 35.03 29.46 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 -7.04 0.53 0.04 1.97 0.23 -1.26 -4.99 119.30 108.79 2eob s MET 104 Ca 0.22 0.27 -0.03 0.00 -1.03 0.00 0.00 55.69 55.12 2eob s MET 104 Cb -0.12 0.25 -0.02 0.00 -1.53 0.00 0.00 34.83 33.40 2eob s MET 104 CO 0.96 -0.14 0.02 1.03 -2.03 0.00 0.00 175.02 174.86 2eob s ARG 105 N -0.68 0.55 -0.65 3.16 0.52 -1.26 -2.47 118.95 118.12 2eob s ARG 105 Ca 0.00 -0.92 -0.28 0.00 -0.52 0.00 0.00 55.73 54.01 2eob s ARG 105 Cb -0.02 0.20 -0.27 0.00 0.52 0.00 0.00 34.95 35.39 2eob s ARG 105 CO -0.02 -0.12 1.87 1.28 0.02 0.00 0.00 175.30 178.34 2eob n LEU 106 N 0.63 1.69 0.02 2.53 4.77 -1.26 -4.55 117.00 120.84 2eob n LEU 106 Ca -0.18 -2.23 -0.21 0.00 -0.03 0.00 0.00 56.01 53.36 2eob n LEU 106 Cb 0.59 -1.20 -0.14 0.00 -2.33 0.00 0.00 43.42 40.34 2eob n LEU 106 CO 0.24 -2.48 -0.30 -0.09 -1.33 0.00 0.00 177.39 173.43 2eob h ARG 107 N 10.42 0.27 -4.19 3.23 2.43 -1.92 -3.44 114.38 121.17 2eob h ARG 107 Ca 0.17 -0.46 -0.62 0.00 -0.81 0.00 0.00 59.98 58.26 2eob h ARG 107 Cb 0.84 0.17 -0.40 0.00 -0.42 0.00 0.00 29.97 30.17 2eob h ARG 107 CO 1.53 1.22 -0.74 0.71 -1.51 0.00 0.00 179.97 181.18 2eob s TYR 108 N -2.47 2.75 -0.40 2.20 2.02 -1.26 -5.04 117.35 115.15 2eob s TYR 108 Ca -0.18 -2.32 -0.28 0.00 -0.37 0.00 0.00 57.07 53.92 2eob s TYR 108 Cb 0.03 -2.25 -0.01 0.00 -0.40 0.00 0.00 41.96 39.33 2eob s TYR 108 CO 0.79 -0.90 1.74 -1.25 -1.57 0.00 0.00 175.55 174.36 2eob s PRO 109 N 1.26 3.24 -0.20 -1.71 0.04 -1.26 -2.86 135.00 133.50 2eob s PRO 109 Ca 0.08 1.17 -0.41 0.00 0.04 0.00 0.00 61.00 61.88 2eob s PRO 109 Cb -0.18 -4.20 -0.18 0.00 0.04 0.00 0.00 34.50 29.97 2eob s PRO 109 CO -0.15 -1.97 1.47 0.28 0.04 0.00 0.00 177.00 176.67 2eob n VAL 110 N 7.31 0.09 -4.30 -0.36 0.31 0.19 -4.85 118.33 116.72 2eob n VAL 110 Ca 0.21 -0.02 -0.19 0.00 -0.01 0.00 0.00 64.34 64.33 2eob n VAL 110 Cb 0.48 -0.66 -0.11 0.00 -0.91 0.00 0.00 33.84 32.64 2eob n VAL 110 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2eob s THR 111 N 1.95 1.60 -0.36 2.52 -4.23 -1.26 -4.21 115.64 111.65 2eob s THR 111 Ca 0.96 -1.90 0.26 0.00 -1.18 0.00 0.00 61.69 59.82 2eob s THR 111 Cb -1.21 -1.76 0.28 0.00 1.34 0.00 0.00 72.50 71.14 2eob s THR 111 CO 0.64 -0.42 1.77 1.55 -0.54 0.00 0.00 174.62 177.62 2eob h PRO 112 N 3.21 0.00 0.00 3.99 0.13 -1.93 -2.74 132.00 134.65 2eob h PRO 112 Ca -0.40 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.50 2eob h PRO 112 Cb 1.20 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.30 2eob h PRO 112 CO 0.53 0.00 -1.51 1.49 -0.23 0.00 0.00 178.00 178.28 2eob h GLU 113 N 0.00 0.00 -0.04 0.86 4.81 -1.96 -3.37 114.58 114.88 2eob h GLU 113 Ca 0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2eob h GLU 113 Cb 0.38 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.76 2eob h GLU 113 CO 0.00 0.40 -0.01 1.25 -0.73 0.00 0.00 179.01 179.92 2eob h LEU 114 N 0.00 0.09 -0.71 1.64 5.85 -1.90 0.12 115.31 120.40 2eob h LEU 114 Ca -0.21 -0.39 0.14 0.00 0.84 0.00 0.00 57.88 58.26 2eob h LEU 114 Cb 1.78 -0.02 -0.13 0.00 0.37 0.00 0.00 40.66 42.65 2eob h LEU 114 CO 0.06 0.46 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.38 2eob h LEU 115 N -0.28 -0.65 -0.03 2.25 -0.00 -1.72 0.40 115.31 115.28 2eob h LEU 115 Ca 0.01 0.21 -0.12 0.00 -0.00 0.00 0.00 57.88 57.99 2eob h LEU 115 Cb 0.42 0.44 0.01 0.00 -0.00 0.00 0.00 40.66 41.53 2eob h LEU 115 CO 0.01 -0.23 -0.43 1.05 -0.00 0.00 0.00 178.44 178.83 2eob h GLU 116 N 0.00 0.35 -0.11 1.13 4.11 -1.72 0.19 114.58 118.53 2eob h GLU 116 Ca 0.34 -0.33 0.03 0.00 0.07 0.00 0.00 59.36 59.47 2eob h GLU 116 Cb 0.52 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.85 2eob h GLU 116 CO -0.73 1.00 0.22 -0.09 0.07 0.00 0.00 179.01 179.48 2eob h ARG 117 N -0.18 0.00 0.00 1.06 2.43 0.34 -2.24 114.38 115.79 2eob h ARG 117 Ca -0.05 0.00 -0.42 0.00 -0.81 0.00 0.00 59.98 58.71 2eob h ARG 117 Cb 1.13 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 30.61 2eob h ARG 117 CO 0.09 0.00 -2.51 0.66 -1.51 0.00 0.00 179.97 176.70 2eob n TYR 118 N -3.39 0.00 -0.11 2.20 4.02 0.13 -4.56 117.16 115.45 2eob n TYR 118 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.80 2eob n TYR 118 Cb 0.32 -1.00 -0.03 0.00 -0.02 0.00 0.00 39.34 38.60 2eob n TYR 118 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 2eob h SER 119 N -0.38 -1.24 -4.51 7.72 0.02 -0.13 -3.42 113.55 111.60 2eob h SER 119 Ca -0.63 0.20 -0.26 0.00 -0.84 0.00 0.00 61.79 60.26 2eob h SER 119 Cb 1.79 0.56 -0.23 0.00 0.14 0.00 0.00 62.40 64.66 2eob h SER 119 CO -0.22 -0.35 -0.73 -0.83 -1.14 0.00 0.00 176.83 173.56 2eob s GLY 120 N -2.79 0.35 -0.55 -3.77 0.00 -0.89 -5.08 107.32 94.59 2eob s GLY 120 Ca -0.15 -0.54 -0.27 0.00 0.00 0.00 0.00 44.72 43.77 2eob s GLY 120 CO 0.66 -0.57 1.82 2.56 0.00 0.00 0.00 173.10 177.58 2eob s PRO 121 N -1.07 2.81 1.19 2.90 0.04 -1.26 -4.54 135.00 135.07 2eob s PRO 121 Ca -0.07 0.78 -0.17 0.00 0.04 0.00 0.00 61.00 61.58 2eob s PRO 121 Cb -0.07 -4.33 0.23 0.00 0.04 0.00 0.00 34.50 30.36 2eob s PRO 121 CO -0.00 -2.50 0.53 0.43 0.04 0.00 0.00 177.00 175.50 2eob n SER 122 N 12.07 -2.45 -3.60 6.66 7.64 -1.26 -5.06 113.62 127.63 2eob n SER 122 Ca 0.21 -0.28 -0.02 0.00 1.01 0.00 0.00 58.87 59.79 2eob n SER 122 Cb 0.51 -1.06 -0.06 0.00 -1.01 0.00 0.00 64.21 62.59 2eob n SER 122 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2eob s SER 123 N -2.21 -0.56 0.00 6.43 0.15 -1.26 -5.22 113.70 111.04 2eob s SER 123 Ca 0.61 0.86 0.00 0.00 0.70 0.00 0.00 55.95 58.12 2eob s SER 123 Cb -0.17 1.33 0.00 0.00 -1.71 0.00 0.00 66.02 65.47 2eob s SER 123 CO 0.63 -0.13 0.00 0.61 1.20 0.00 0.00 173.24 175.54