#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 1.07 0.57 1.61 0.01 -1.26 -5.18 113.70 110.51 2eob s SER 2 Ca 0.00 -1.54 0.07 0.00 1.31 0.00 0.00 55.95 55.79 2eob s SER 2 Cb 0.00 0.63 0.06 0.00 0.21 0.00 0.00 66.02 66.92 2eob s SER 2 CO 0.00 -1.23 0.57 -0.94 0.41 0.00 0.00 173.24 172.05 2eob s SER 3 N -3.27 4.80 0.00 2.44 1.04 -1.26 -5.15 113.70 112.31 2eob s SER 3 Ca 0.33 -1.11 0.00 0.00 0.48 0.00 0.00 55.95 55.65 2eob s SER 3 Cb 0.00 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2eob s SER 3 CO 0.22 -1.24 0.00 0.61 0.98 0.00 0.00 173.24 173.81 2eob n GLY 4 N -1.99 2.19 3.84 7.32 0.00 -1.26 -5.16 105.19 110.13 2eob n GLY 4 Ca 0.06 -1.87 -0.06 0.00 0.00 0.00 0.00 46.02 44.15 2eob n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eob s SER 5 N -0.82 -0.02 0.67 1.61 0.01 -1.26 -5.17 113.70 108.71 2eob s SER 5 Ca 0.00 -0.84 -0.09 0.00 1.31 0.00 0.00 55.95 56.32 2eob s SER 5 Cb 0.00 0.66 0.01 0.00 0.21 0.00 0.00 66.02 66.90 2eob s SER 5 CO 0.00 -1.29 1.03 -0.55 0.41 0.00 0.00 173.24 172.84 2eob s SER 6 N -3.21 5.47 0.00 2.44 0.15 -1.26 -4.99 113.70 112.30 2eob s SER 6 Ca 0.18 0.96 0.00 0.00 0.70 0.00 0.00 55.95 57.79 2eob s SER 6 Cb -0.04 -1.82 0.00 0.00 -1.71 0.00 0.00 66.02 62.45 2eob s SER 6 CO 0.08 -1.26 0.00 0.61 1.20 0.00 0.00 173.24 173.87 2eob n GLY 7 N -2.86 0.20 2.86 9.45 0.00 -1.26 -5.10 105.19 108.48 2eob n GLY 7 Ca 0.06 -0.11 -0.52 0.00 0.00 0.00 0.00 46.02 45.45 2eob n GLY 7 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2eob n ASP 8 N -1.45 0.88 -4.69 1.61 5.68 -1.26 -4.88 116.55 112.45 2eob n ASP 8 Ca 0.00 0.86 -0.29 0.00 -0.50 0.00 0.00 54.79 54.86 2eob n ASP 8 Cb 0.00 -0.69 0.16 0.00 -1.14 0.00 0.00 41.12 39.45 2eob n ASP 8 CO 0.00 0.00 0.00 -2.16 -1.33 0.00 0.00 177.20 173.71 2eob s PRO 9 N 2.76 0.70 0.29 0.11 0.04 -1.26 -4.94 135.00 132.71 2eob s PRO 9 Ca 0.84 0.62 -0.27 0.00 0.04 0.00 0.00 61.00 62.23 2eob s PRO 9 Cb -1.17 -1.76 -0.14 0.00 0.04 0.00 0.00 34.50 31.46 2eob s PRO 9 CO 0.62 -2.57 0.83 1.33 0.04 0.00 0.00 177.00 177.25 2eob n VAL 10 N -4.08 1.98 -2.13 -0.36 0.24 -1.26 -4.84 118.33 107.88 2eob n VAL 10 Ca 0.06 -0.50 -0.43 0.00 -2.04 0.00 0.00 64.34 61.43 2eob n VAL 10 Cb 0.56 -0.71 -0.03 0.00 -1.47 0.00 0.00 33.84 32.20 2eob n VAL 10 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2eob s PRO 11 N -1.45 3.99 -0.30 7.34 0.04 -1.26 -4.94 135.00 138.41 2eob s PRO 11 Ca 0.61 1.83 -0.09 0.00 0.04 0.00 0.00 61.00 63.38 2eob s PRO 11 Cb -0.73 -3.98 0.18 0.00 0.04 0.00 0.00 34.50 30.01 2eob s PRO 11 CO 0.59 -1.06 0.95 1.21 0.04 0.00 0.00 177.00 178.73 2eob s ASN 12 N 3.58 -0.66 0.00 6.66 2.47 -1.26 -5.01 114.94 120.72 2eob s ASN 12 Ca 0.69 0.24 0.15 0.00 0.42 0.00 0.00 52.86 54.36 2eob s ASN 12 Cb -0.27 1.49 0.72 0.00 -1.45 0.00 0.00 41.25 41.74 2eob s ASN 12 CO 0.27 -0.12 1.42 -0.81 -3.72 0.00 0.00 177.10 174.13 2eob n PRO 13 N 5.33 0.17 -3.42 0.43 -0.04 -1.26 -3.77 135.00 132.45 2eob n PRO 13 Ca 0.01 0.16 -0.26 0.00 -0.04 0.00 0.00 63.50 63.37 2eob n PRO 13 Cb 0.55 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.42 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 -1.32 1.92 -0.07 3.54 3.02 -1.26 -4.94 115.26 116.15 2eob n ASN 14 Ca 0.06 -3.02 -0.13 0.00 -0.03 0.00 0.00 54.58 51.46 2eob n ASN 14 Cb 0.13 -0.66 -0.06 0.00 -0.61 0.00 0.00 39.78 38.58 2eob n ASN 14 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2eob h PRO 15 N 4.50 0.50 -0.88 3.52 0.13 -1.99 -3.20 132.00 134.58 2eob h PRO 15 Ca 0.16 -0.26 0.18 0.00 -0.87 0.00 0.00 66.00 65.20 2eob h PRO 15 Cb 0.78 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 31.81 2eob h PRO 15 CO 0.64 0.84 0.44 1.12 -0.23 0.00 0.00 178.00 180.81 2eob h HIS 16 N 0.17 0.76 -0.75 1.56 2.07 -1.93 -1.26 115.15 115.77 2eob h HIS 16 Ca 0.03 0.04 0.30 0.00 -2.85 0.00 0.00 60.37 57.89 2eob h HIS 16 Cb 0.75 -0.20 -0.12 0.00 2.57 0.00 0.00 27.41 30.41 2eob h HIS 16 CO 0.08 0.10 0.43 -1.91 -3.07 0.00 0.00 177.93 173.56 2eob n GLU 17 N -4.92 -0.04 0.07 5.12 2.13 -1.21 0.21 120.64 122.00 2eob n GLU 17 Ca 0.20 0.95 -0.22 0.00 0.66 0.00 0.00 57.16 58.74 2eob n GLU 17 Cb 0.53 -1.74 -0.15 0.00 0.27 0.00 0.00 31.44 30.36 2eob n GLU 17 CO 0.00 0.00 0.00 0.77 -0.41 0.00 0.00 177.13 177.49 2eob h SER 18 N 0.00 0.57 -1.70 4.31 0.02 -1.44 -3.47 113.55 111.84 2eob h SER 18 Ca 0.60 -0.92 -0.67 0.00 -0.84 0.00 0.00 61.79 59.96 2eob h SER 18 Cb 1.66 -0.18 0.08 0.00 0.14 0.00 0.00 62.40 64.09 2eob h SER 18 CO -0.50 1.59 0.10 0.29 -1.14 0.00 0.00 176.83 177.17 2eob n LYS 19 N -3.89 0.83 -0.03 3.45 4.76 0.56 -4.88 118.16 118.96 2eob n LYS 19 Ca -0.19 0.29 -0.09 0.00 -2.87 0.00 0.00 58.31 55.46 2eob n LYS 19 Cb 0.95 -1.70 0.07 0.00 -1.84 0.00 0.00 35.03 32.52 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 2.80 0.65 0.00 1.97 0.13 -1.90 -2.86 132.00 132.79 2eob h PRO 20 Ca -0.41 -0.34 -0.00 0.00 -0.87 0.00 0.00 66.00 64.38 2eob h PRO 20 Cb 1.37 0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.51 2eob h PRO 20 CO 0.66 0.94 -0.00 0.11 -0.23 0.00 0.00 178.00 179.49 2eob h TRP 21 N 0.53 0.00 -2.73 1.56 5.08 -1.84 -3.38 115.95 115.17 2eob h TRP 21 Ca 0.04 0.00 -0.55 0.00 1.08 0.00 0.00 58.89 59.46 2eob h TRP 21 Cb 0.94 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.08 2eob h TRP 21 CO 0.04 0.00 1.00 -0.47 -1.28 0.00 0.00 178.44 177.74 2eob s TYR 22 N -3.77 2.34 -0.16 0.12 5.04 -1.08 -3.84 117.35 116.00 2eob s TYR 22 Ca -0.00 0.51 -0.05 0.00 -2.44 0.00 0.00 57.07 55.09 2eob s TYR 22 Cb 0.10 -3.76 -0.03 0.00 0.35 0.00 0.00 41.96 38.61 2eob s TYR 22 CO 0.51 -3.05 -0.01 0.71 -1.34 0.00 0.00 175.55 172.38 2eob s TYR 23 N 3.68 3.10 -0.10 4.97 2.02 -0.53 -4.96 117.35 125.53 2eob s TYR 23 Ca 0.67 -0.14 0.02 0.00 -0.37 0.00 0.00 57.07 57.24 2eob s TYR 23 Cb -0.30 -1.98 -0.07 0.00 -0.40 0.00 0.00 41.96 39.22 2eob s TYR 23 CO 0.25 0.07 -0.07 -0.40 -1.57 0.00 0.00 175.55 173.82 2eob n ASP 24 N 3.39 3.22 -2.12 2.29 5.68 -1.26 -0.71 116.55 127.04 2eob n ASP 24 Ca -0.17 -0.05 -0.28 0.00 -0.50 0.00 0.00 54.79 53.80 2eob n ASP 24 Cb 0.52 -0.05 0.10 0.00 -1.14 0.00 0.00 41.12 40.55 2eob n ASP 24 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 2eob n ARG 25 N -2.72 2.72 -4.19 0.11 1.85 -1.26 -4.51 116.66 108.65 2eob n ARG 25 Ca -0.17 -3.42 -0.25 0.00 -1.00 0.00 0.00 57.85 53.01 2eob n ARG 25 Cb 0.69 -2.22 -0.07 0.00 -1.05 0.00 0.00 32.46 29.82 2eob n ARG 25 CO 0.00 0.00 0.00 -1.17 -0.01 0.00 0.00 177.63 176.45 2eob s LEU 26 N -3.64 3.44 0.06 2.89 2.96 -1.26 -5.12 118.68 118.02 2eob s LEU 26 Ca 0.59 -0.39 -0.10 0.00 -0.22 0.00 0.00 54.13 54.01 2eob s LEU 26 Cb 0.47 -2.04 0.00 0.00 0.50 0.00 0.00 46.19 45.13 2eob s LEU 26 CO 0.02 0.05 0.21 -0.55 -1.32 0.00 0.00 176.35 174.76 2eob s SER 27 N -3.28 0.04 0.53 3.68 0.15 -1.26 -4.62 113.70 108.95 2eob s SER 27 Ca 0.30 -0.46 0.39 0.00 0.70 0.00 0.00 55.95 56.88 2eob s SER 27 Cb -0.09 0.33 1.57 0.00 -1.71 0.00 0.00 66.02 66.13 2eob s SER 27 CO 0.21 -0.65 1.73 0.08 1.20 0.00 0.00 173.24 175.81 2eob h ARG 28 N 3.09 0.02 -0.78 5.44 -0.00 -1.99 0.50 114.38 120.67 2eob h ARG 28 Ca -0.33 -0.00 0.10 0.00 -0.00 0.00 0.00 59.98 59.75 2eob h ARG 28 Cb 1.20 -0.01 -0.05 0.00 -0.00 0.00 0.00 29.97 31.11 2eob h ARG 28 CO 0.51 0.02 0.51 0.78 -0.00 0.00 0.00 179.97 181.79 2eob h GLY 29 N 0.03 0.98 0.00 0.08 0.00 -2.01 -2.98 103.07 99.17 2eob h GLY 29 Ca 0.68 -0.28 -0.20 0.00 0.00 0.00 0.00 47.33 47.53 2eob h GLY 29 CO -0.04 0.16 -1.55 1.18 0.00 0.00 0.00 176.54 176.28 2eob n GLU 30 N -4.50 0.43 -0.26 4.80 1.02 0.16 -4.43 120.64 117.85 2eob n GLU 30 Ca 0.13 0.18 -0.07 0.00 -0.02 0.00 0.00 57.16 57.39 2eob n GLU 30 Cb 0.35 -1.23 -0.06 0.00 -0.02 0.00 0.00 31.44 30.48 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 -4.08 -0.39 -0.02 0.62 0.00 0.04 -0.26 120.51 116.42 2eob n ALA 31 Ca -0.28 0.52 -0.13 0.00 0.00 0.00 0.00 53.44 53.55 2eob n ALA 31 Cb 0.62 -0.06 -0.09 0.00 0.00 0.00 0.00 19.45 19.92 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 -0.47 -0.30 0.00 5.08 -1.75 -2.12 114.58 115.03 2eob h GLU 32 Ca 0.10 0.03 0.07 0.00 -1.00 0.00 0.00 59.36 58.56 2eob h GLU 32 Cb 0.25 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.53 2eob h GLU 32 CO -0.58 -0.31 -0.34 0.22 -1.00 0.00 0.00 179.01 177.00 2eob h ASP 33 N -0.49 -1.10 -0.89 1.42 1.82 -0.89 -2.28 116.42 114.01 2eob h ASP 33 Ca 0.03 0.18 0.08 0.00 -0.39 0.00 0.00 57.03 56.93 2eob h ASP 33 Cb 0.58 0.49 -0.11 0.00 0.68 0.00 0.00 39.33 40.98 2eob h ASP 33 CO -0.40 -0.34 -0.55 0.24 -1.61 0.00 0.00 179.24 176.58 2eob h MET 34 N -0.32 -0.03 -0.70 0.28 2.86 -0.04 0.33 114.93 117.30 2eob h MET 34 Ca 0.14 0.00 0.15 0.00 -2.06 0.00 0.00 59.70 57.93 2eob h MET 34 Cb 0.55 0.01 -0.10 0.00 0.06 0.00 0.00 31.60 32.11 2eob h MET 34 CO -0.47 -0.02 0.17 -0.07 1.06 0.00 0.00 176.91 177.57 2eob h LEU 35 N -0.03 0.01 -1.58 1.22 -0.00 -0.88 0.27 115.31 114.32 2eob h LEU 35 Ca 0.14 0.14 0.15 0.00 -0.00 0.00 0.00 57.88 58.31 2eob h LEU 35 Cb 0.40 0.18 -0.05 0.00 -0.00 0.00 0.00 40.66 41.19 2eob h LEU 35 CO -0.85 -0.02 0.50 0.24 -0.00 0.00 0.00 178.44 178.31 2eob h MET 36 N 0.27 0.41 -0.03 1.13 2.86 0.14 -1.88 114.93 117.82 2eob h MET 36 Ca 0.39 -0.02 -0.04 0.00 -2.06 0.00 0.00 59.70 57.96 2eob h MET 36 Cb 0.64 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 32.21 2eob h MET 36 CO -0.48 0.27 -0.13 0.00 1.06 0.00 0.00 176.91 177.63 2eob h ARG 37 N 0.42 0.15 -5.75 1.72 3.08 0.60 -3.43 114.38 111.16 2eob h ARG 37 Ca 0.37 -0.11 -0.61 0.00 0.07 0.00 0.00 59.98 59.70 2eob h ARG 37 Cb 0.84 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.89 2eob h ARG 37 CO -0.12 0.76 1.52 -0.89 -1.07 0.00 0.00 179.97 180.16 2eob n ILE 38 N -4.63 0.10 0.64 2.04 2.08 -0.70 -4.75 119.36 114.13 2eob n ILE 38 Ca -0.09 -0.31 0.00 0.00 0.56 0.00 0.00 62.75 62.91 2eob n ILE 38 Cb 0.39 -1.64 0.00 0.00 -0.75 0.00 0.00 39.64 37.65 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 8.38 0.49 -3.86 0.38 -0.04 -1.26 -4.57 135.00 134.52 2eob n PRO 39 Ca 0.45 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.55 2eob n PRO 39 Cb 0.25 -1.17 -0.13 0.00 -0.04 0.00 0.00 33.50 32.41 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 -1.31 2.58 -0.56 0.54 1.81 -1.26 -5.05 118.95 115.70 2eob s ARG 40 Ca 0.00 -1.17 -0.27 0.00 -1.72 0.00 0.00 55.73 52.57 2eob s ARG 40 Cb 0.00 -3.25 -0.02 0.00 -0.45 0.00 0.00 34.95 31.23 2eob s ARG 40 CO 0.00 -0.59 1.88 0.16 -0.68 0.00 0.00 175.30 176.07 2eob s ASP 41 N 1.32 5.32 0.00 0.23 -4.77 -1.26 -2.54 116.67 114.97 2eob s ASP 41 Ca -0.03 0.53 0.00 0.00 -3.30 0.00 0.00 52.55 49.75 2eob s ASP 41 Cb -0.19 -2.53 0.00 0.00 -1.09 0.00 0.00 42.92 39.11 2eob s ASP 41 CO -0.00 -2.30 0.00 0.61 0.70 0.00 0.00 175.17 174.18 2eob n GLY 42 N 5.67 0.83 3.44 2.12 0.00 -1.23 -4.98 105.19 111.04 2eob n GLY 42 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 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 -1.44 -2.60 4.61 0.00 -1.05 -4.15 120.51 115.87 2eob n ALA 43 Ca 0.00 0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.39 2eob n ALA 43 Cb 0.00 -1.77 -0.08 0.00 0.00 0.00 0.00 19.45 17.60 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 -1.64 0.78 -0.19 0.00 -0.71 -1.09 -1.94 117.98 113.20 2eob s PHE 44 Ca 0.65 -1.08 -0.27 0.00 -1.04 0.00 0.00 56.93 55.19 2eob s PHE 44 Cb -0.52 -0.24 0.08 0.00 -1.21 0.00 0.00 43.02 41.14 2eob s PHE 44 CO 0.57 -0.77 0.77 -0.48 -1.34 0.00 0.00 175.22 173.97 2eob s LEU 45 N -3.08 -0.65 -0.47 -1.99 0.05 -0.42 0.75 118.68 112.87 2eob s LEU 45 Ca 0.30 1.05 -0.00 0.00 0.05 0.00 0.00 54.13 55.53 2eob s LEU 45 Cb 0.04 2.37 0.12 0.00 -2.05 0.00 0.00 46.19 46.67 2eob s LEU 45 CO 0.09 -0.36 0.24 -0.63 -0.55 0.00 0.00 176.35 175.14 2eob s ILE 46 N -0.27 3.05 0.16 1.48 1.01 -1.25 -1.42 121.20 123.97 2eob s ILE 46 Ca -0.03 -2.56 -0.03 0.00 0.00 0.00 0.00 60.65 58.02 2eob s ILE 46 Cb -0.03 -3.10 -0.05 0.00 0.01 0.00 0.00 42.46 39.29 2eob s ILE 46 CO 0.03 -0.74 0.38 0.00 0.00 0.00 0.00 174.94 174.61 2eob s ARG 47 N 0.55 3.58 -0.21 2.79 1.70 -1.06 -1.45 118.95 124.85 2eob s ARG 47 Ca 0.12 -0.18 -0.11 0.00 -0.47 0.00 0.00 55.73 55.10 2eob s ARG 47 Cb -0.22 -2.85 -0.05 0.00 -0.57 0.00 0.00 34.95 31.26 2eob s ARG 47 CO -0.04 0.44 0.16 0.21 -1.08 0.00 0.00 175.30 174.99 2eob s LYS 48 N -2.88 4.16 -0.47 3.89 2.20 0.11 -3.05 119.74 123.70 2eob s LYS 48 Ca 0.40 -0.20 -0.21 0.00 -0.36 0.00 0.00 55.97 55.60 2eob s LYS 48 Cb -0.12 -3.46 0.03 0.00 -1.51 0.00 0.00 37.83 32.78 2eob s LYS 48 CO 0.26 0.22 0.69 1.03 -0.36 0.00 0.00 175.35 177.20 2eob s ARG 49 N 0.58 3.26 1.05 4.03 0.52 -1.24 -4.64 118.95 122.52 2eob s ARG 49 Ca 0.09 -0.45 -0.11 0.00 -0.52 0.00 0.00 55.73 54.73 2eob s ARG 49 Cb -0.12 -4.00 0.22 0.00 0.52 0.00 0.00 34.95 31.58 2eob s ARG 49 CO 0.00 -1.13 1.08 -1.83 0.02 0.00 0.00 175.30 173.45 2eob s GLU 50 N 2.97 -0.08 0.00 3.54 -1.05 -1.26 -3.31 118.70 119.50 2eob s GLU 50 Ca 0.23 1.19 0.00 0.00 -0.15 0.00 0.00 54.97 56.24 2eob s GLU 50 Cb -0.15 -1.63 0.00 0.00 -0.44 0.00 0.00 34.13 31.92 2eob s GLU 50 CO 0.18 -3.26 0.00 0.41 0.95 0.00 0.00 175.26 173.53 2eob n GLY 51 N 0.59 1.43 3.91 -3.83 0.00 -1.26 -4.90 105.19 101.13 2eob n GLY 51 Ca 0.07 -0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 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 0.00 5.36 -0.21 2.61 -1.32 -1.21 -4.98 115.64 115.89 2eob s THR 52 Ca 0.00 -0.18 0.01 0.00 -1.21 0.00 0.00 61.69 60.31 2eob s THR 52 Cb 0.00 -3.60 0.17 0.00 -1.51 0.00 0.00 72.50 67.56 2eob s THR 52 CO 0.00 0.21 1.16 0.47 -2.21 0.00 0.00 174.62 174.25 2eob n ASP 53 N 0.56 3.04 -4.69 8.08 9.92 -1.26 -4.74 116.55 127.45 2eob n ASP 53 Ca -0.07 -2.36 -0.30 0.00 -0.53 0.00 0.00 54.79 51.53 2eob n ASP 53 Cb 0.52 -0.58 -0.09 0.00 -0.64 0.00 0.00 41.12 40.33 2eob n ASP 53 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2eob s SER 54 N 0.36 4.03 0.22 -2.24 0.01 -1.26 -4.45 113.70 110.37 2eob s SER 54 Ca 0.14 -1.47 -0.00 0.00 1.31 0.00 0.00 55.95 55.92 2eob s SER 54 Cb 0.11 0.01 -0.04 0.00 0.21 0.00 0.00 66.02 66.31 2eob s SER 54 CO 0.03 -0.64 0.14 -0.31 0.41 0.00 0.00 173.24 172.86 2eob s TYR 55 N -2.78 1.26 -0.02 2.43 1.51 -1.05 -3.62 117.35 115.08 2eob s TYR 55 Ca 0.23 -1.37 -0.05 0.00 -1.01 0.00 0.00 57.07 54.87 2eob s TYR 55 Cb 0.06 -0.62 0.00 0.00 -0.11 0.00 0.00 41.96 41.29 2eob s TYR 55 CO 0.12 -0.61 0.11 0.00 -1.11 0.00 0.00 175.55 174.06 2eob s ALA 56 N -4.05 -0.27 -0.17 3.71 0.00 -1.17 -0.04 121.76 119.78 2eob s ALA 56 Ca 0.39 0.03 0.01 0.00 0.00 0.00 0.00 51.96 52.39 2eob s ALA 56 Cb 0.07 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.18 2eob s ALA 56 CO 0.13 -0.14 -0.18 -1.50 0.00 0.00 0.00 175.76 174.08 2eob s ILE 57 N -0.74 1.86 0.14 0.00 2.07 -0.97 -2.55 121.20 121.01 2eob s ILE 57 Ca -0.08 -0.81 -0.03 0.00 -1.41 0.00 0.00 60.65 58.32 2eob s ILE 57 Cb -0.05 -1.70 -0.05 0.00 0.13 0.00 0.00 42.46 40.79 2eob s ILE 57 CO 0.01 0.51 0.35 -0.89 -1.91 0.00 0.00 174.94 173.00 2eob s THR 58 N 1.35 5.22 0.19 4.00 2.01 -0.51 -2.25 115.64 125.65 2eob s THR 58 Ca 0.04 -0.15 -0.17 0.00 0.31 0.00 0.00 61.69 61.72 2eob s THR 58 Cb -0.13 -3.65 0.03 0.00 0.01 0.00 0.00 72.50 68.75 2eob s THR 58 CO -0.12 0.00 0.50 0.72 -0.69 0.00 0.00 174.62 175.04 2eob s PHE 59 N -1.68 -0.09 -0.32 4.92 -0.71 -0.42 -1.31 117.98 118.37 2eob s PHE 59 Ca 0.39 -0.26 -0.12 0.00 -1.04 0.00 0.00 56.93 55.90 2eob s PHE 59 Cb -0.12 0.36 -0.03 0.00 -1.21 0.00 0.00 43.02 42.02 2eob s PHE 59 CO 0.26 -0.90 0.24 0.50 -1.34 0.00 0.00 175.22 173.98 2eob s ARG 60 N -3.88 3.64 -0.64 1.99 3.52 -0.82 -1.65 118.95 121.12 2eob s ARG 60 Ca 0.10 -0.52 -0.09 0.00 -0.13 0.00 0.00 55.73 55.09 2eob s ARG 60 Cb -0.01 -3.76 0.16 0.00 -1.56 0.00 0.00 34.95 29.79 2eob s ARG 60 CO -0.03 -0.37 0.51 0.00 -0.81 0.00 0.00 175.30 174.60 2eob s ALA 61 N 1.76 3.68 -1.54 6.12 0.00 0.74 -3.49 121.76 129.03 2eob s ALA 61 Ca 0.07 -3.03 -0.11 0.00 0.00 0.00 0.00 51.96 48.88 2eob s ALA 61 Cb -0.17 -2.99 0.08 0.00 0.00 0.00 0.00 23.12 20.05 2eob s ALA 61 CO 0.11 -2.09 0.78 0.54 0.00 0.00 0.00 175.76 175.10 2eob n ARG 62 N 4.13 -4.27 0.00 0.00 3.00 -1.26 -1.42 116.66 116.83 2eob n ARG 62 Ca 0.04 0.49 0.00 0.00 -0.01 0.00 0.00 57.85 58.37 2eob n ARG 62 Cb 0.42 -5.14 0.00 0.00 0.00 0.00 0.00 32.46 27.73 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 -1.64 3.07 3.61 -0.13 0.00 -1.26 -5.05 105.19 103.78 2eob n GLY 63 Ca -0.05 -0.85 -0.29 0.00 0.00 0.00 0.00 46.02 44.82 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 -0.54 -0.18 1.61 1.02 -0.51 -4.85 119.74 116.29 2eob s LYS 64 Ca 0.00 0.30 0.01 0.00 0.02 0.00 0.00 55.97 56.30 2eob s LYS 64 Cb 0.00 -1.64 0.04 0.00 -0.52 0.00 0.00 37.83 35.71 2eob s LYS 64 CO 0.00 -3.33 -0.10 0.08 -0.92 0.00 0.00 175.35 171.08 2eob s VAL 65 N -2.89 1.52 0.30 3.17 1.01 -1.26 -0.18 120.40 122.06 2eob s VAL 65 Ca 0.68 -0.87 0.09 0.00 0.00 0.00 0.00 61.98 61.87 2eob s VAL 65 Cb -0.16 -1.59 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 2eob s VAL 65 CO 0.58 0.20 0.06 -0.54 0.00 0.00 0.00 175.10 175.40 2eob s LYS 66 N 1.46 2.33 0.36 2.72 -0.14 -0.66 -4.96 119.74 120.86 2eob s LYS 66 Ca 0.00 -1.48 0.04 0.00 -1.36 0.00 0.00 55.97 53.18 2eob s LYS 66 Cb -0.16 -2.16 -0.03 0.00 -1.68 0.00 0.00 37.83 33.80 2eob s LYS 66 CO -0.08 0.25 0.17 -1.01 -0.76 0.00 0.00 175.35 173.92 2eob s HIS 67 N -2.37 1.73 -0.27 3.18 3.76 -1.26 -1.31 115.29 118.75 2eob s HIS 67 Ca 0.34 -1.39 -0.08 0.00 -0.15 0.00 0.00 55.06 53.79 2eob s HIS 67 Cb -0.04 -0.98 0.13 0.00 1.11 0.00 0.00 32.58 32.79 2eob s HIS 67 CO 0.21 -0.48 0.58 0.00 -0.85 0.00 0.00 174.74 174.20 2eob s ARG 69 N 2.81 3.20 0.01 0.00 6.06 -1.26 -2.30 118.95 127.48 2eob s ARG 69 Ca -0.00 1.83 0.04 0.00 -2.50 0.00 0.00 55.73 55.10 2eob s ARG 69 Cb -0.13 -2.07 -0.02 0.00 0.06 0.00 0.00 34.95 32.80 2eob s ARG 69 CO -0.18 -1.02 -0.13 0.42 -2.50 0.00 0.00 175.30 171.89 2eob s ILE 70 N -1.58 1.01 0.41 4.11 1.01 0.94 -4.64 121.20 122.45 2eob s ILE 70 Ca 0.73 -0.75 0.08 0.00 0.00 0.00 0.00 60.65 60.71 2eob s ILE 70 Cb -0.30 -0.88 -0.04 0.00 0.01 0.00 0.00 42.46 41.25 2eob s ILE 70 CO 0.34 0.13 0.27 0.21 0.00 0.00 0.00 174.94 175.88 2eob s ASN 71 N -0.71 4.74 -0.06 3.58 2.47 0.14 -2.54 114.94 122.56 2eob s ASN 71 Ca 0.03 -0.89 -0.02 0.00 0.42 0.00 0.00 52.86 52.39 2eob s ASN 71 Cb -0.06 -0.55 0.03 0.00 -1.45 0.00 0.00 41.25 39.22 2eob s ASN 71 CO 0.00 -0.57 0.04 -0.60 -3.72 0.00 0.00 177.10 172.26 2eob s ARG 72 N -4.00 0.16 -0.92 0.43 3.52 -1.26 -0.90 118.95 115.98 2eob s ARG 72 Ca 0.44 0.26 -0.01 0.00 -0.13 0.00 0.00 55.73 56.28 2eob s ARG 72 Cb 0.00 -0.75 0.27 0.00 -1.56 0.00 0.00 34.95 32.90 2eob s ARG 72 CO 0.25 -0.35 1.07 -3.47 -0.81 0.00 0.00 175.30 171.99 2eob n ASP 73 N 5.25 5.04 -2.20 -2.12 2.03 -0.44 -4.89 116.55 119.22 2eob n ASP 73 Ca -0.05 -3.32 -0.03 0.00 0.52 0.00 0.00 54.79 51.91 2eob n ASP 73 Cb 0.50 -1.06 -0.03 0.00 -0.72 0.00 0.00 41.12 39.81 2eob n ASP 73 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2eob n GLY 74 N 1.56 -4.38 3.15 0.27 0.00 -1.26 -3.98 105.19 100.56 2eob n GLY 74 Ca 0.26 0.93 -0.18 0.00 0.00 0.00 0.00 46.02 47.04 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 1.01 -1.83 -3.77 1.61 1.85 -1.26 -4.86 116.66 109.41 2eob n ARG 75 Ca -0.24 0.06 -0.20 0.00 -1.00 0.00 0.00 57.85 56.46 2eob n ARG 75 Cb 0.38 -4.06 -0.17 0.00 -1.05 0.00 0.00 32.46 27.55 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 -2.33 0.35 -0.16 2.89 3.76 -1.26 -4.83 115.29 113.72 2eob s HIS 76 Ca 0.34 0.04 -0.23 0.00 -0.15 0.00 0.00 55.06 55.06 2eob s HIS 76 Cb -0.20 -0.59 -0.02 0.00 1.11 0.00 0.00 32.58 32.88 2eob s HIS 76 CO 0.42 -0.23 0.73 -0.06 -0.85 0.00 0.00 174.74 174.75 2eob s PHE 77 N 1.84 3.43 -0.04 1.40 0.08 -0.63 -1.33 117.98 122.73 2eob s PHE 77 Ca 0.02 1.13 0.02 0.00 0.12 0.00 0.00 56.93 58.21 2eob s PHE 77 Cb -0.12 -2.90 0.02 0.00 -0.57 0.00 0.00 43.02 39.44 2eob s PHE 77 CO -0.04 -0.16 -0.07 0.08 -0.10 0.00 0.00 175.22 174.93 2eob s VAL 78 N 1.85 0.69 0.10 -0.44 1.01 -0.08 -2.28 120.40 121.25 2eob s VAL 78 Ca 0.34 -0.24 -0.23 0.00 0.00 0.00 0.00 61.98 61.85 2eob s VAL 78 Cb -0.16 -0.66 -0.12 0.00 0.00 0.00 0.00 36.38 35.43 2eob s VAL 78 CO 0.12 0.25 1.73 0.25 0.00 0.00 0.00 175.10 177.45 2eob h LEU 79 N 6.89 -0.07 -5.00 3.92 7.12 -1.81 0.39 115.31 126.75 2eob h LEU 79 Ca -0.36 0.02 -0.20 0.00 0.13 0.00 0.00 57.88 57.47 2eob h LEU 79 Cb 1.16 0.04 -0.14 0.00 -0.53 0.00 0.00 40.66 41.19 2eob h LEU 79 CO 0.48 -0.03 -0.34 0.61 -0.13 0.00 0.00 178.44 179.03 2eob n GLY 80 N -1.13 -0.12 3.04 3.75 0.00 -1.26 -3.86 105.19 105.61 2eob n GLY 80 Ca -0.06 0.28 -0.21 0.00 0.00 0.00 0.00 46.02 46.03 2eob n GLY 80 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 2eob n THR 81 N 0.86 -1.37 0.06 2.61 -1.04 -1.26 -4.77 114.28 109.36 2eob n THR 81 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 2eob n THR 81 Cb 0.69 -2.59 0.00 0.00 -1.82 0.00 0.00 70.33 66.61 2eob n THR 81 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 2eob n SER 82 N -2.31 0.07 -4.65 8.00 2.88 -1.26 -5.05 113.62 111.30 2eob n SER 82 Ca -0.09 0.20 -0.43 0.00 -1.33 0.00 0.00 58.87 57.22 2eob n SER 82 Cb 0.59 0.11 -0.02 0.00 -0.75 0.00 0.00 64.21 64.15 2eob n SER 82 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eob s ALA 83 N -2.00 3.58 -0.44 -1.46 0.00 -1.26 -5.00 121.76 115.18 2eob s ALA 83 Ca 0.00 0.07 -0.11 0.00 0.00 0.00 0.00 51.96 51.92 2eob s ALA 83 Cb 0.00 -3.62 0.08 0.00 0.00 0.00 0.00 23.12 19.58 2eob s ALA 83 CO 0.00 -1.29 0.31 0.71 0.00 0.00 0.00 175.76 175.49 2eob s TYR 84 N 3.47 3.32 -0.09 0.00 1.51 -1.26 -3.74 117.35 120.56 2eob s TYR 84 Ca 0.45 -1.43 0.03 0.00 -1.01 0.00 0.00 57.07 55.11 2eob s TYR 84 Cb -0.14 -3.11 0.01 0.00 -0.11 0.00 0.00 41.96 38.61 2eob s TYR 84 CO 0.11 -0.86 -0.17 -0.06 -1.11 0.00 0.00 175.55 173.46 2eob s PHE 85 N 1.47 1.95 0.33 2.71 0.08 -0.96 -5.02 117.98 118.54 2eob s PHE 85 Ca 0.04 -0.82 0.09 0.00 0.12 0.00 0.00 56.93 56.35 2eob s PHE 85 Cb -0.24 -1.38 0.83 0.00 -0.57 0.00 0.00 43.02 41.66 2eob s PHE 85 CO 0.03 -0.39 1.78 1.49 -0.10 0.00 0.00 175.22 178.02 2eob h GLU 86 N 7.06 0.65 -4.22 0.44 4.81 -1.88 -1.67 114.58 119.76 2eob h GLU 86 Ca -0.28 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 58.78 2eob h GLU 86 Cb 1.20 -0.15 -0.16 0.00 0.63 0.00 0.00 28.75 30.27 2eob h GLU 86 CO 0.48 0.43 -0.68 -1.54 -0.73 0.00 0.00 179.01 176.97 2eob s SER 87 N -5.39 0.48 0.33 1.04 1.04 -1.26 -4.27 113.70 105.67 2eob s SER 87 Ca -0.11 -0.94 0.04 0.00 0.48 0.00 0.00 55.95 55.43 2eob s SER 87 Cb 0.25 0.18 0.66 0.00 0.10 0.00 0.00 66.02 67.21 2eob s SER 87 CO 0.80 -0.56 1.91 -0.07 0.98 0.00 0.00 173.24 176.31 2eob h LEU 88 N 3.33 0.78 -0.48 2.42 3.38 -1.91 -2.54 115.31 120.29 2eob h LEU 88 Ca -0.34 0.01 0.09 0.00 0.09 0.00 0.00 57.88 57.74 2eob h LEU 88 Cb 1.15 -0.15 -0.10 0.00 0.09 0.00 0.00 40.66 41.65 2eob h LEU 88 CO 0.63 0.48 -0.33 0.58 0.09 0.00 0.00 178.44 179.88 2eob h VAL 89 N 0.87 0.20 -0.45 1.22 2.07 -1.97 0.37 116.25 118.57 2eob h VAL 89 Ca 0.38 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.97 2eob h VAL 89 Cb 0.34 0.20 -0.06 0.00 -1.52 0.00 0.00 31.29 30.25 2eob h VAL 89 CO -0.15 0.00 0.11 -0.33 0.02 0.00 0.00 177.57 177.21 2eob h GLU 90 N -0.22 0.24 -0.85 1.57 4.39 -1.86 -0.92 114.58 116.94 2eob h GLU 90 Ca 0.20 -0.01 0.07 0.00 0.34 0.00 0.00 59.36 59.95 2eob h GLU 90 Cb 0.54 -0.05 -0.06 0.00 -0.10 0.00 0.00 28.75 29.08 2eob h GLU 90 CO -0.60 0.16 0.55 1.25 -1.16 0.00 0.00 179.01 179.21 2eob h LEU 91 N 0.25 0.81 0.31 1.33 6.46 -1.09 0.12 115.31 123.50 2eob h LEU 91 Ca 0.22 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.97 2eob h LEU 91 Cb 0.26 -0.16 0.00 0.00 -0.73 0.00 0.00 40.66 40.03 2eob h LEU 91 CO -0.27 0.51 -0.15 0.58 -0.62 0.00 0.00 178.44 178.50 2eob h VAL 92 N 0.92 0.69 -0.76 1.05 2.07 0.28 -0.62 116.25 119.88 2eob h VAL 92 Ca 0.37 -0.54 0.02 0.00 0.82 0.00 0.00 66.70 67.36 2eob h VAL 92 Cb 0.25 0.97 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 2eob h VAL 92 CO -0.14 0.11 0.49 0.28 0.02 0.00 0.00 177.57 178.33 2eob h SER 93 N -0.73 0.83 -0.60 0.57 0.02 -0.93 0.14 113.55 112.84 2eob h SER 93 Ca -0.04 -0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 60.86 2eob h SER 93 Cb 0.49 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.81 2eob h SER 93 CO 0.07 0.59 0.24 0.22 -1.14 0.00 0.00 176.83 176.80 2eob h TYR 94 N 0.98 0.92 -0.40 3.45 5.03 -0.76 -2.95 116.97 123.25 2eob h TYR 94 Ca 0.29 -0.07 -0.12 0.00 2.58 0.00 0.00 58.73 61.40 2eob h TYR 94 Cb -0.05 -0.28 -0.01 0.00 1.55 0.00 0.00 36.73 37.94 2eob h TYR 94 CO -0.03 0.74 -0.24 1.88 -1.32 0.00 0.00 178.16 179.19 2eob h TYR 95 N 0.84 1.01 -0.77 -3.82 -1.99 -0.63 -3.17 116.97 108.44 2eob h TYR 95 Ca 0.20 -0.26 0.25 0.00 2.00 0.00 0.00 58.73 60.92 2eob h TYR 95 Cb 0.21 -0.23 -0.14 0.00 2.00 0.00 0.00 36.73 38.57 2eob h TYR 95 CO 0.01 1.05 0.17 0.39 -0.00 0.00 0.00 178.16 179.77 2eob n GLU 96 N -4.19 -0.06 -0.03 4.88 1.02 0.45 0.96 120.64 123.68 2eob n GLU 96 Ca -0.02 1.12 -0.13 0.00 -0.02 0.00 0.00 57.16 58.11 2eob n GLU 96 Cb 0.46 -1.87 -0.11 0.00 -0.02 0.00 0.00 31.44 29.91 2eob n GLU 96 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2eob h LYS 97 N 0.00 -0.00 -7.70 3.49 1.79 -1.64 -3.39 116.57 109.12 2eob h LYS 97 Ca 0.54 0.00 -0.44 0.00 -2.18 0.00 0.00 60.65 58.57 2eob h LYS 97 Cb 1.25 0.00 0.16 0.00 -1.58 0.00 0.00 32.23 32.07 2eob h LYS 97 CO -0.68 0.60 0.35 -1.01 -1.08 0.00 0.00 179.45 177.63 2eob s HIS 98 N -3.78 1.50 -0.22 -1.35 3.76 0.27 -5.05 115.29 110.43 2eob s HIS 98 Ca -0.17 0.42 -0.05 0.00 -0.15 0.00 0.00 55.06 55.12 2eob s HIS 98 Cb 0.01 -3.88 -0.02 0.00 1.11 0.00 0.00 32.58 29.80 2eob s HIS 98 CO 0.67 -2.84 -0.01 0.00 -0.85 0.00 0.00 174.74 171.71 2eob s ALA 99 N -3.63 2.93 -0.06 -1.40 0.00 -1.26 -4.64 121.76 113.70 2eob s ALA 99 Ca 0.72 -1.12 -0.24 0.00 0.00 0.00 0.00 51.96 51.33 2eob s ALA 99 Cb -0.06 -1.79 -0.27 0.00 0.00 0.00 0.00 23.12 21.00 2eob s ALA 99 CO 0.53 -0.37 0.95 1.25 0.00 0.00 0.00 175.76 178.12 2eob h LEU 100 N 7.98 0.31 -9.96 0.00 5.85 -1.74 -3.48 115.31 114.27 2eob h LEU 100 Ca -0.39 -0.88 -0.64 0.00 0.84 0.00 0.00 57.88 56.81 2eob h LEU 100 Cb 1.17 -0.10 -0.11 0.00 0.37 0.00 0.00 40.66 41.99 2eob h LEU 100 CO 0.60 1.16 -0.51 -0.47 -0.34 0.00 0.00 178.44 178.88 2eob s TYR 101 N -2.74 2.10 -0.48 1.25 5.04 -1.16 -5.00 117.35 116.37 2eob s TYR 101 Ca -0.15 -0.82 -0.44 0.00 -2.44 0.00 0.00 57.07 53.22 2eob s TYR 101 Cb 0.01 -1.74 -0.19 0.00 0.35 0.00 0.00 41.96 40.39 2eob s TYR 101 CO 0.78 0.19 2.01 -2.13 -1.34 0.00 0.00 175.55 175.05 2eob n ARG 102 N -1.25 0.11 -3.67 4.97 0.63 -1.26 -0.41 116.66 115.77 2eob n ARG 102 Ca -0.11 0.03 -0.25 0.00 -0.92 0.00 0.00 57.85 56.60 2eob n ARG 102 Cb 0.66 -1.58 -0.06 0.00 0.45 0.00 0.00 32.46 31.93 2eob n ARG 102 CO 0.00 0.00 0.00 1.63 -2.51 0.00 0.00 177.63 176.75 2eob n LYS 103 N 6.68 -0.89 -4.03 -0.14 5.02 -1.26 -4.87 118.16 118.67 2eob n LYS 103 Ca 0.48 0.08 -0.25 0.00 -2.02 0.00 0.00 58.31 56.60 2eob n LYS 103 Cb -0.02 -2.81 -0.17 0.00 -0.02 0.00 0.00 35.03 32.01 2eob n LYS 103 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 2eob s MET 104 N -5.67 1.30 0.22 1.97 1.75 0.45 -5.07 119.30 114.24 2eob s MET 104 Ca 0.27 -0.20 0.11 0.00 -1.25 0.00 0.00 55.69 54.62 2eob s MET 104 Cb -0.16 -1.35 -0.05 0.00 2.84 0.00 0.00 34.83 36.12 2eob s MET 104 CO 0.69 -0.20 -0.21 1.03 -0.65 0.00 0.00 175.02 175.68 2eob s ARG 105 N 1.47 1.52 -0.19 4.11 0.52 -1.26 -2.20 118.95 122.92 2eob s ARG 105 Ca -0.00 -1.58 -0.29 0.00 -0.52 0.00 0.00 55.73 53.33 2eob s ARG 105 Cb -0.13 -1.70 -0.02 0.00 0.52 0.00 0.00 34.95 33.62 2eob s ARG 105 CO -0.05 0.34 1.40 -0.51 0.02 0.00 0.00 175.30 176.51 2eob s LEU 106 N -2.96 4.09 -0.05 2.53 1.43 -1.26 -4.81 118.68 117.64 2eob s LEU 106 Ca 0.23 1.67 -0.02 0.00 -1.03 0.00 0.00 54.13 54.98 2eob s LEU 106 Cb -0.06 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.59 2eob s LEU 106 CO 0.11 -0.95 -0.06 0.54 0.23 0.00 0.00 176.35 176.22 2eob n ARG 107 N 7.04 0.12 -3.89 1.70 1.74 -1.26 -4.77 116.66 117.34 2eob n ARG 107 Ca 0.16 0.05 -0.30 0.00 -0.77 0.00 0.00 57.85 56.98 2eob n ARG 107 Cb 0.45 -0.81 -0.15 0.00 -1.02 0.00 0.00 32.46 30.92 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 -2.10 2.30 -0.77 -1.55 2.02 -1.26 -5.06 117.35 110.92 2eob s TYR 108 Ca -0.08 -1.82 -0.25 0.00 -0.37 0.00 0.00 57.07 54.55 2eob s TYR 108 Cb 0.03 -1.72 -0.04 0.00 -0.40 0.00 0.00 41.96 39.83 2eob s TYR 108 CO 0.10 -0.80 1.91 -1.25 -1.57 0.00 0.00 175.55 173.95 2eob s PRO 109 N 1.42 2.58 0.07 -1.71 0.04 -1.26 -2.66 135.00 133.48 2eob s PRO 109 Ca -0.00 0.13 -0.25 0.00 0.04 0.00 0.00 61.00 60.92 2eob s PRO 109 Cb -0.18 -4.75 -0.14 0.00 0.04 0.00 0.00 34.50 29.47 2eob s PRO 109 CO -0.10 -3.09 0.59 0.28 0.04 0.00 0.00 177.00 174.73 2eob n VAL 110 N 7.58 0.66 -4.28 -0.36 0.31 0.23 -4.71 118.33 117.76 2eob n VAL 110 Ca 0.31 -0.17 -0.16 0.00 -0.01 0.00 0.00 64.34 64.31 2eob n VAL 110 Cb 0.49 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.32 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 -0.33 1.39 0.15 2.52 -4.23 -1.26 -4.31 115.64 109.57 2eob s THR 111 Ca 0.57 -2.02 0.31 0.00 -1.18 0.00 0.00 61.69 59.38 2eob s THR 111 Cb -0.81 -1.82 0.35 0.00 1.34 0.00 0.00 72.50 71.56 2eob s THR 111 CO 0.41 -0.61 1.97 1.55 -0.54 0.00 0.00 174.62 177.39 2eob h PRO 112 N 2.91 0.00 0.00 3.99 0.13 -1.93 -2.86 132.00 134.24 2eob h PRO 112 Ca -0.38 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.52 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 0.60 0.06 -1.20 0.93 -0.23 0.00 0.00 178.00 178.15 2eob h GLU 113 N 0.00 0.00 0.40 0.86 5.08 -1.96 -3.36 114.58 115.60 2eob h GLU 113 Ca -0.00 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 2eob h GLU 113 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2eob h GLU 113 CO 0.01 0.86 -0.19 1.25 -1.00 0.00 0.00 179.01 179.93 2eob h LEU 114 N 0.00 -0.45 -0.98 1.33 5.85 -1.92 -1.75 115.31 117.39 2eob h LEU 114 Ca -0.09 -0.09 0.34 0.00 0.84 0.00 0.00 57.88 58.88 2eob h LEU 114 Cb 1.84 0.12 -0.16 0.00 0.37 0.00 0.00 40.66 42.82 2eob h LEU 114 CO 0.12 -0.17 0.45 -0.07 -0.34 0.00 0.00 178.44 178.42 2eob h LEU 115 N -0.74 0.26 -0.17 2.25 -0.00 -1.70 0.69 115.31 115.90 2eob h LEU 115 Ca -0.05 0.23 -0.19 0.00 -0.00 0.00 0.00 57.88 57.86 2eob h LEU 115 Cb 0.51 0.24 0.01 0.00 -0.00 0.00 0.00 40.66 41.42 2eob h LEU 115 CO 0.09 -0.27 -0.63 -0.33 -0.00 0.00 0.00 178.44 177.30 2eob h GLU 116 N 0.16 0.73 -0.45 1.13 4.39 -1.66 0.22 114.58 119.09 2eob h GLU 116 Ca 0.73 -0.55 -0.01 0.00 0.34 0.00 0.00 59.36 59.87 2eob h GLU 116 Cb 1.74 0.10 -0.02 0.00 -0.10 0.00 0.00 28.75 30.47 2eob h GLU 116 CO -0.71 1.17 0.24 -0.09 -1.16 0.00 0.00 179.01 178.47 2eob h ARG 117 N 0.43 0.63 0.01 2.33 2.43 0.11 0.13 114.38 120.46 2eob h ARG 117 Ca -0.03 -0.08 -0.04 0.00 -0.81 0.00 0.00 59.98 59.02 2eob h ARG 117 Cb 1.25 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.68 2eob h ARG 117 CO 0.13 0.50 -0.17 1.88 -1.51 0.00 0.00 179.97 180.81 2eob h TYR 118 N 0.59 0.15 0.42 2.20 -1.99 -0.59 -3.37 116.97 114.37 2eob h TYR 118 Ca 0.16 -0.09 -0.02 0.00 2.00 0.00 0.00 58.73 60.78 2eob h TYR 118 Cb 0.06 -0.01 0.00 0.00 2.00 0.00 0.00 36.73 38.78 2eob h TYR 118 CO -0.02 0.93 -0.24 1.03 -0.00 0.00 0.00 178.16 179.86 2eob h SER 119 N -0.67 -0.59 -4.90 3.88 0.87 -0.55 -3.50 113.55 108.09 2eob h SER 119 Ca -0.02 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2eob h SER 119 Cb 0.98 0.17 0.00 0.00 -0.44 0.00 0.00 62.40 63.11 2eob h SER 119 CO 0.03 -0.38 0.00 0.61 -0.53 0.00 0.00 176.83 176.57 2eob n GLY 120 N -1.31 0.57 3.74 5.77 0.00 0.46 -5.06 105.19 109.37 2eob n GLY 120 Ca -0.07 -2.28 -0.30 0.00 0.00 0.00 0.00 46.02 43.36 2eob n GLY 120 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eob s PRO 121 N -0.57 1.78 -0.18 1.61 0.04 -1.26 -4.89 135.00 131.54 2eob s PRO 121 Ca 0.00 1.01 -0.17 0.00 0.04 0.00 0.00 61.00 61.88 2eob s PRO 121 Cb 0.00 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 32.63 2eob s PRO 121 CO 0.00 -1.93 -0.32 0.45 0.04 0.00 0.00 177.00 175.24 2eob n SER 122 N -3.69 1.92 -4.39 6.66 2.88 -1.26 -5.05 113.62 110.69 2eob n SER 122 Ca 0.08 0.37 -0.20 0.00 -1.33 0.00 0.00 58.87 57.79 2eob n SER 122 Cb 0.54 -0.76 -0.10 0.00 -0.75 0.00 0.00 64.21 63.14 2eob n SER 122 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2eob s SER 123 N -5.95 2.63 0.00 -3.46 0.01 -1.26 -5.34 113.70 100.33 2eob s SER 123 Ca -0.28 -1.12 0.00 0.00 1.31 0.00 0.00 55.95 55.87 2eob s SER 123 Cb 0.04 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.13 2eob s SER 123 CO 0.41 -0.27 0.00 0.61 0.41 0.00 0.00 173.24 174.39