#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eob s SER 2 N 0.00 6.63 -1.31 1.61 1.04 -1.26 -4.23 113.70 116.18 2eob s SER 2 Ca 0.00 -1.95 -0.06 0.00 0.48 0.00 0.00 55.95 54.41 2eob s SER 2 Cb 0.00 -2.45 0.01 0.00 0.10 0.00 0.00 66.02 63.67 2eob s SER 2 CO 0.00 -1.17 1.13 -1.20 0.98 0.00 0.00 173.24 172.98 2eob n SER 3 N 7.23 -5.12 0.00 7.02 7.64 -1.26 -4.96 113.62 124.16 2eob n SER 3 Ca 0.28 -0.56 0.00 0.00 1.01 0.00 0.00 58.87 59.60 2eob n SER 3 Cb 0.49 -5.06 0.00 0.00 -1.01 0.00 0.00 64.21 58.63 2eob n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eob n GLY 4 N -1.76 1.94 3.78 0.23 0.00 -1.26 -4.97 105.19 103.14 2eob n GLY 4 Ca -0.08 -0.06 -0.24 0.00 0.00 0.00 0.00 46.02 45.64 2eob n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eob n SER 5 N 0.00 -2.22 -0.13 1.61 7.64 -1.26 -4.83 113.62 114.44 2eob n SER 5 Ca 0.00 -0.82 -0.18 0.00 1.01 0.00 0.00 58.87 58.89 2eob n SER 5 Cb 0.00 -3.94 -0.12 0.00 -1.01 0.00 0.00 64.21 59.13 2eob n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2eob n SER 6 N -2.99 1.90 0.00 6.43 7.64 -1.26 -5.03 113.62 120.31 2eob n SER 6 Ca -0.20 -0.13 0.00 0.00 1.01 0.00 0.00 58.87 59.55 2eob n SER 6 Cb 0.63 -0.34 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 2eob n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eob n GLY 7 N 2.24 -1.65 3.15 0.23 0.00 -1.26 -5.16 105.19 102.74 2eob n GLY 7 Ca -0.45 0.45 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 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 0.77 -0.12 0.87 1.61 1.47 -1.26 -5.17 116.67 114.83 2eob s ASP 8 Ca 0.00 0.09 -0.11 0.00 1.18 0.00 0.00 52.55 53.71 2eob s ASP 8 Cb 0.00 0.33 0.11 0.00 -0.34 0.00 0.00 42.92 43.02 2eob s ASP 8 CO 0.00 -0.31 1.09 -2.16 0.68 0.00 0.00 175.17 174.47 2eob s PRO 9 N -0.91 1.49 0.38 2.11 0.04 -1.26 -5.00 135.00 131.85 2eob s PRO 9 Ca -0.10 0.90 -0.26 0.00 0.04 0.00 0.00 61.00 61.58 2eob s PRO 9 Cb -0.05 -1.83 -0.09 0.00 0.04 0.00 0.00 34.50 32.57 2eob s PRO 9 CO 0.02 -2.10 1.17 0.14 0.04 0.00 0.00 177.00 176.27 2eob s VAL 10 N -2.93 3.16 0.55 -0.36 -7.23 -1.26 -5.01 120.40 107.33 2eob s VAL 10 Ca 0.63 1.02 -0.19 0.00 -1.81 0.00 0.00 61.98 61.63 2eob s VAL 10 Cb -0.18 -3.59 -0.05 0.00 0.56 0.00 0.00 36.38 33.12 2eob s VAL 10 CO 0.57 0.13 1.13 -2.16 -0.31 0.00 0.00 175.10 174.46 2eob s PRO 11 N -2.13 3.32 -0.38 4.82 0.04 -1.26 -5.04 135.00 134.37 2eob s PRO 11 Ca 0.54 1.59 0.01 0.00 0.04 0.00 0.00 61.00 63.19 2eob s PRO 11 Cb -0.32 -2.00 0.12 0.00 0.04 0.00 0.00 34.50 32.34 2eob s PRO 11 CO 0.40 -0.87 0.17 1.21 0.04 0.00 0.00 177.00 177.95 2eob s ASN 12 N -1.83 3.90 0.00 6.66 3.04 -1.26 -4.96 114.94 120.49 2eob s ASN 12 Ca 0.72 -2.23 0.15 0.00 0.04 0.00 0.00 52.86 51.54 2eob s ASN 12 Cb -0.24 -1.04 0.75 0.00 -1.54 0.00 0.00 41.25 39.18 2eob s ASN 12 CO 0.28 -0.33 1.41 -0.81 -3.04 0.00 0.00 177.10 174.60 2eob n PRO 13 N 4.07 0.21 -3.73 0.43 -0.04 -1.26 -4.03 135.00 130.66 2eob n PRO 13 Ca 0.04 0.14 -0.28 0.00 -0.04 0.00 0.00 63.50 63.36 2eob n PRO 13 Cb 0.38 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.22 2eob n PRO 13 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2eob s ASN 14 N -2.56 3.62 -0.02 3.54 2.20 -1.26 -4.97 114.94 115.49 2eob s ASN 14 Ca 0.14 -3.23 -0.26 0.00 -0.94 0.00 0.00 52.86 48.58 2eob s ASN 14 Cb 0.10 -1.17 -0.20 0.00 -2.00 0.00 0.00 41.25 37.98 2eob s ASN 14 CO 0.22 -0.17 1.24 1.55 -2.94 0.00 0.00 177.10 177.00 2eob h PRO 15 N 5.95 -0.04 -0.90 3.55 0.13 -2.03 -3.23 132.00 135.43 2eob h PRO 15 Ca 0.11 0.00 0.23 0.00 -0.87 0.00 0.00 66.00 65.47 2eob h PRO 15 Cb 0.85 0.01 -0.13 0.00 0.13 0.00 0.00 31.00 31.86 2eob h PRO 15 CO 0.56 0.44 0.38 1.12 -0.23 0.00 0.00 178.00 180.27 2eob h HIS 16 N -0.53 0.62 -0.96 1.56 2.07 -1.95 0.63 115.15 116.59 2eob h HIS 16 Ca -0.00 0.04 0.30 0.00 -2.85 0.00 0.00 60.37 57.85 2eob h HIS 16 Cb 0.49 -0.13 -0.17 0.00 2.57 0.00 0.00 27.41 30.17 2eob h HIS 16 CO 0.09 -0.09 0.21 1.49 -3.07 0.00 0.00 177.93 176.56 2eob h GLU 17 N 0.35 0.07 -0.10 5.12 4.81 -1.98 0.27 114.58 123.13 2eob h GLU 17 Ca 0.57 -0.00 -0.06 0.00 -0.13 0.00 0.00 59.36 59.74 2eob h GLU 17 Cb 1.13 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2eob h GLU 17 CO -0.56 0.04 -0.19 0.66 -0.73 0.00 0.00 179.01 178.23 2eob h SER 18 N 0.07 0.34 -0.99 1.04 4.64 -1.03 -3.46 113.55 114.16 2eob h SER 18 Ca 0.65 -0.55 -0.46 0.00 -0.47 0.00 0.00 61.79 60.95 2eob h SER 18 Cb 1.44 -0.10 0.10 0.00 -0.31 0.00 0.00 62.40 63.53 2eob h SER 18 CO -0.81 0.83 -0.55 0.29 -0.87 0.00 0.00 176.83 175.72 2eob n LYS 19 N -4.54 0.00 0.13 4.77 4.76 0.96 -4.83 118.16 119.41 2eob n LYS 19 Ca -0.07 0.00 -0.01 0.00 -2.87 0.00 0.00 58.31 55.36 2eob n LYS 19 Cb 0.40 -0.71 0.24 0.00 -1.84 0.00 0.00 35.03 33.11 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 0.44 0.11 -0.84 1.97 0.13 -1.89 -2.77 132.00 129.15 2eob h PRO 20 Ca -0.24 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2eob h PRO 20 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2eob h PRO 20 CO 0.37 0.56 0.00 -2.67 -0.23 0.00 0.00 178.00 176.03 2eob n TRP 21 N -3.97 0.32 -4.04 1.56 4.27 -1.26 -4.21 117.44 110.11 2eob n TRP 21 Ca -0.02 -0.11 -0.30 0.00 -3.89 0.00 0.00 57.50 53.18 2eob n TRP 21 Cb 0.51 -0.15 -0.06 0.00 -1.36 0.00 0.00 31.31 30.25 2eob n TRP 21 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 2eob s TYR 22 N -1.35 3.22 -0.03 -2.67 6.14 -1.05 -2.68 117.35 118.94 2eob s TYR 22 Ca 0.09 0.09 -0.05 0.00 0.64 0.00 0.00 57.07 57.84 2eob s TYR 22 Cb 0.06 -1.63 0.01 0.00 0.42 0.00 0.00 41.96 40.82 2eob s TYR 22 CO 0.03 0.53 0.13 0.71 0.64 0.00 0.00 175.55 177.58 2eob s TYR 23 N -1.42 -0.07 -0.03 4.97 2.02 -0.28 -4.98 117.35 117.57 2eob s TYR 23 Ca 0.30 0.16 0.01 0.00 -0.37 0.00 0.00 57.07 57.17 2eob s TYR 23 Cb -0.12 0.01 -0.02 0.00 -0.40 0.00 0.00 41.96 41.42 2eob s TYR 23 CO 0.23 -0.14 -0.01 -3.47 -1.57 0.00 0.00 175.55 170.58 2eob n ASP 24 N 2.46 4.05 -0.09 2.29 2.03 -1.26 -1.45 116.55 124.59 2eob n ASP 24 Ca -0.16 -0.01 -0.11 0.00 0.52 0.00 0.00 54.79 55.03 2eob n ASP 24 Cb 0.58 0.20 -0.15 0.00 -0.72 0.00 0.00 41.12 41.02 2eob n ASP 24 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2eob n ARG 25 N -2.38 0.68 -1.37 -0.67 1.74 -1.26 -4.54 116.66 108.85 2eob n ARG 25 Ca -0.04 0.08 -0.43 0.00 -0.77 0.00 0.00 57.85 56.69 2eob n ARG 25 Cb 0.56 -1.58 -0.00 0.00 -1.02 0.00 0.00 32.46 30.42 2eob n ARG 25 CO 0.00 0.00 0.00 -0.11 -1.52 0.00 0.00 177.63 176.00 2eob n LEU 26 N -2.91 -1.54 -4.04 0.55 7.94 -1.26 -4.99 117.00 110.75 2eob n LEU 26 Ca -0.32 0.90 -0.08 0.00 -1.11 0.00 0.00 56.01 55.40 2eob n LEU 26 Cb 1.11 -0.98 -0.09 0.00 0.53 0.00 0.00 43.42 43.99 2eob n LEU 26 CO 0.41 -3.50 -0.24 -0.44 -1.11 0.00 0.00 177.39 172.51 2eob s SER 27 N -0.97 0.30 0.33 1.96 0.01 -1.26 -4.76 113.70 109.30 2eob s SER 27 Ca 0.61 -0.97 0.10 0.00 1.31 0.00 0.00 55.95 57.00 2eob s SER 27 Cb -0.67 0.29 1.01 0.00 0.21 0.00 0.00 66.02 66.86 2eob s SER 27 CO 0.60 -0.71 1.55 0.54 0.41 0.00 0.00 173.24 175.63 2eob n ARG 28 N -0.03 -0.07 -0.35 12.44 1.74 -1.26 0.06 116.66 129.19 2eob n ARG 28 Ca -0.11 1.42 0.09 0.00 -0.77 0.00 0.00 57.85 58.48 2eob n ARG 28 Cb 0.62 -2.39 0.19 0.00 -1.02 0.00 0.00 32.46 29.87 2eob n ARG 28 CO 0.00 0.00 0.00 0.78 -1.52 0.00 0.00 177.63 176.89 2eob h GLY 29 N 0.00 0.89 0.00 -0.13 0.00 -2.00 -2.27 103.07 99.57 2eob h GLY 29 Ca 0.71 0.27 -0.43 0.00 0.00 0.00 0.00 47.33 47.88 2eob h GLY 29 CO -0.85 -0.42 -2.42 1.18 0.00 0.00 0.00 176.54 174.03 2eob n GLU 30 N -5.58 0.54 -0.25 4.80 1.02 0.83 -4.28 120.64 117.72 2eob n GLU 30 Ca 0.18 0.24 -0.07 0.00 -0.02 0.00 0.00 57.16 57.49 2eob n GLU 30 Cb 0.59 -1.40 -0.06 0.00 -0.02 0.00 0.00 31.44 30.54 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 -4.14 -0.38 -0.19 0.62 0.00 0.11 0.12 120.51 116.65 2eob n ALA 31 Ca -0.50 0.51 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 2eob n ALA 31 Cb 0.85 -0.04 0.09 0.00 0.00 0.00 0.00 19.45 20.36 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 0.41 0.45 0.00 5.08 -1.62 -2.75 114.58 116.15 2eob h GLU 32 Ca 0.10 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 2eob h GLU 32 Cb 0.25 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.38 2eob h GLU 32 CO -0.56 0.27 -0.42 0.22 -1.00 0.00 0.00 179.01 177.52 2eob h ASP 33 N 0.43 -1.14 -0.58 1.42 3.58 0.71 -2.89 116.42 117.95 2eob h ASP 33 Ca 0.28 0.09 0.05 0.00 0.42 0.00 0.00 57.03 57.87 2eob h ASP 33 Cb 0.30 0.38 -0.07 0.00 1.72 0.00 0.00 39.33 41.66 2eob h ASP 33 CO -0.26 -0.58 -0.34 0.23 -2.88 0.00 0.00 179.24 175.40 2eob n MET 34 N -5.52 -0.26 -0.26 0.28 2.81 0.69 0.11 117.12 114.99 2eob n MET 34 Ca -0.11 1.05 0.06 0.00 -1.81 0.00 0.00 57.70 56.90 2eob n MET 34 Cb 0.41 -1.55 0.19 0.00 -0.71 0.00 0.00 33.22 31.56 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 -0.14 -1.41 4.03 -0.00 -1.47 0.44 115.31 116.77 2eob h LEU 35 Ca 0.09 0.17 0.12 0.00 -0.00 0.00 0.00 57.88 58.27 2eob h LEU 35 Cb 0.24 0.27 -0.06 0.00 -0.00 0.00 0.00 40.66 41.11 2eob h LEU 35 CO -0.55 -0.11 0.52 0.24 -0.00 0.00 0.00 178.44 178.54 2eob h MET 36 N 0.19 0.60 -0.03 1.13 2.86 0.11 -2.20 114.93 117.58 2eob h MET 36 Ca 0.43 -0.04 -0.03 0.00 -2.06 0.00 0.00 59.70 58.00 2eob h MET 36 Cb 0.77 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.30 2eob h MET 36 CO -0.59 0.40 -0.10 0.00 1.06 0.00 0.00 176.91 177.68 2eob h ARG 37 N 0.62 0.12 -5.88 1.72 -0.00 0.89 -3.43 114.38 108.42 2eob h ARG 37 Ca 0.38 -0.09 -0.61 0.00 -0.50 0.00 0.00 59.98 59.16 2eob h ARG 37 Cb 0.63 0.02 -0.01 0.00 0.00 0.00 0.00 29.97 30.60 2eob h ARG 37 CO -0.15 0.71 1.49 -0.89 0.00 0.00 0.00 179.97 181.13 2eob n ILE 38 N -4.67 0.18 0.97 2.04 2.08 -0.46 -4.78 119.36 114.73 2eob n ILE 38 Ca -0.08 -0.37 0.02 0.00 0.56 0.00 0.00 62.75 62.87 2eob n ILE 38 Cb 0.37 -1.98 0.12 0.00 -0.75 0.00 0.00 39.64 37.40 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 8.48 0.49 -3.51 0.38 -0.04 -1.26 -4.49 135.00 135.05 2eob n PRO 39 Ca 0.39 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.43 2eob n PRO 39 Cb 0.32 -1.13 -0.08 0.00 -0.04 0.00 0.00 33.50 32.56 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 2.61 0.23 0.54 1.81 -1.26 -5.06 118.95 115.82 2eob s ARG 40 Ca 0.06 -1.69 -0.32 0.00 -1.72 0.00 0.00 55.73 52.07 2eob s ARG 40 Cb 0.03 -3.98 -0.13 0.00 -0.45 0.00 0.00 34.95 30.42 2eob s ARG 40 CO 0.05 -1.17 1.61 -0.40 -0.68 0.00 0.00 175.30 174.70 2eob n ASP 41 N 4.99 3.58 0.00 0.23 5.68 -1.26 -2.47 116.55 127.30 2eob n ASP 41 Ca -0.10 1.10 0.00 0.00 -0.50 0.00 0.00 54.79 55.30 2eob n ASP 41 Cb 0.41 -1.53 0.00 0.00 -1.14 0.00 0.00 41.12 38.87 2eob n ASP 41 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2eob n GLY 42 N 3.09 1.97 2.85 6.12 0.00 -0.97 -4.88 105.19 113.36 2eob n GLY 42 Ca 0.14 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 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 -0.34 -3.72 -2.72 4.61 0.00 -1.03 -4.32 120.51 112.98 2eob n ALA 43 Ca 0.00 -0.24 -0.14 0.00 0.00 0.00 0.00 53.44 53.06 2eob n ALA 43 Cb 0.00 -1.19 -0.06 0.00 0.00 0.00 0.00 19.45 18.20 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 -1.80 1.03 -0.28 0.00 -0.71 -1.08 -1.22 117.98 113.91 2eob s PHE 44 Ca 0.46 -1.24 -0.26 0.00 -1.04 0.00 0.00 56.93 54.85 2eob s PHE 44 Cb -0.35 -0.21 0.15 0.00 -1.21 0.00 0.00 43.02 41.40 2eob s PHE 44 CO 0.65 -0.96 1.19 -0.48 -1.34 0.00 0.00 175.22 174.28 2eob s LEU 45 N -3.19 -0.28 -0.10 -1.99 0.05 0.15 -0.77 118.68 112.55 2eob s LEU 45 Ca 0.32 0.51 0.01 0.00 0.05 0.00 0.00 54.13 55.03 2eob s LEU 45 Cb 0.02 1.56 -0.02 0.00 -2.05 0.00 0.00 46.19 45.70 2eob s LEU 45 CO 0.17 -0.11 -0.14 -0.63 -0.55 0.00 0.00 176.35 175.08 2eob s ILE 46 N -0.02 2.99 -0.02 1.48 1.01 -1.09 -0.83 121.20 124.71 2eob s ILE 46 Ca 0.05 -0.71 -0.07 0.00 0.00 0.00 0.00 60.65 59.92 2eob s ILE 46 Cb -0.04 -2.22 0.01 0.00 0.01 0.00 0.00 42.46 40.22 2eob s ILE 46 CO -0.09 0.55 0.15 0.00 0.00 0.00 0.00 174.94 175.54 2eob s ARG 47 N -0.04 0.38 0.21 2.79 1.70 -1.25 -1.13 118.95 121.61 2eob s ARG 47 Ca -0.03 -0.18 -0.20 0.00 -0.47 0.00 0.00 55.73 54.84 2eob s ARG 47 Cb -0.14 0.16 -0.08 0.00 -0.57 0.00 0.00 34.95 34.32 2eob s ARG 47 CO 0.04 -0.08 0.72 0.21 -1.08 0.00 0.00 175.30 175.10 2eob s LYS 48 N -0.87 4.27 -0.10 3.89 2.36 -0.53 -3.71 119.74 125.05 2eob s LYS 48 Ca -0.10 0.88 0.01 0.00 -2.55 0.00 0.00 55.97 54.21 2eob s LYS 48 Cb -0.05 -2.93 0.02 0.00 -1.05 0.00 0.00 37.83 33.81 2eob s LYS 48 CO 0.01 0.42 -0.11 1.03 1.55 0.00 0.00 175.35 178.26 2eob s ARG 49 N -1.86 1.73 1.04 4.03 0.52 -1.26 -4.73 118.95 118.42 2eob s ARG 49 Ca 0.41 -0.37 -0.22 0.00 -0.52 0.00 0.00 55.73 55.04 2eob s ARG 49 Cb -0.17 -1.60 -0.05 0.00 0.52 0.00 0.00 34.95 33.64 2eob s ARG 49 CO 0.21 -0.14 -0.68 -0.85 0.02 0.00 0.00 175.30 173.87 2eob n GLU 50 N 4.44 -0.66 0.00 3.54 0.28 -1.26 -4.31 120.64 122.66 2eob n GLU 50 Ca -0.17 -0.18 0.00 0.00 -0.16 0.00 0.00 57.16 56.64 2eob n GLU 50 Cb 0.51 -1.36 0.00 0.00 1.43 0.00 0.00 31.44 32.02 2eob n GLU 50 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2eob n GLY 51 N 2.73 1.80 3.53 -1.84 0.00 -1.26 -5.01 105.19 105.14 2eob n GLY 51 Ca -0.00 -0.73 -0.26 0.00 0.00 0.00 0.00 46.02 45.04 2eob n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eob s THR 52 N 0.00 0.83 0.00 2.61 2.01 -1.26 -5.02 115.64 114.81 2eob s THR 52 Ca 0.00 -2.00 -0.04 0.00 0.31 0.00 0.00 61.69 59.96 2eob s THR 52 Cb 0.00 -2.44 -0.17 0.00 0.01 0.00 0.00 72.50 69.90 2eob s THR 52 CO 0.00 0.00 2.85 -0.90 -0.69 0.00 0.00 174.62 175.88 2eob n ASP 53 N -1.15 4.77 -3.98 3.53 5.75 -1.26 -4.77 116.55 119.45 2eob n ASP 53 Ca -0.07 -2.35 -0.28 0.00 -0.01 0.00 0.00 54.79 52.08 2eob n ASP 53 Cb 0.66 -1.20 -0.17 0.00 -1.03 0.00 0.00 41.12 39.38 2eob n ASP 53 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 2eob s SER 54 N 2.07 2.41 0.54 -1.12 0.01 -1.26 -4.47 113.70 111.87 2eob s SER 54 Ca 0.41 -0.40 0.03 0.00 1.31 0.00 0.00 55.95 57.31 2eob s SER 54 Cb 0.20 -1.02 0.04 0.00 0.21 0.00 0.00 66.02 65.45 2eob s SER 54 CO 0.00 -0.07 0.75 -0.31 0.41 0.00 0.00 173.24 174.02 2eob s TYR 55 N 1.47 2.59 -0.06 2.43 1.51 -1.16 -4.52 117.35 119.60 2eob s TYR 55 Ca 0.02 -0.20 -0.03 0.00 -1.01 0.00 0.00 57.07 55.86 2eob s TYR 55 Cb -0.13 -2.64 0.04 0.00 -0.11 0.00 0.00 41.96 39.12 2eob s TYR 55 CO -0.08 -0.87 0.12 0.00 -1.11 0.00 0.00 175.55 173.61 2eob s ALA 56 N -2.69 -0.03 0.06 3.71 0.00 -1.24 -1.97 121.76 119.60 2eob s ALA 56 Ca 0.58 0.44 -0.19 0.00 0.00 0.00 0.00 51.96 52.78 2eob s ALA 56 Cb -0.09 -0.69 -0.06 0.00 0.00 0.00 0.00 23.12 22.28 2eob s ALA 56 CO 0.38 -0.48 0.57 -1.50 0.00 0.00 0.00 175.76 174.73 2eob s ILE 57 N 2.08 4.77 0.06 0.00 2.07 -1.18 -3.87 121.20 125.13 2eob s ILE 57 Ca 0.02 1.21 0.09 0.00 -1.41 0.00 0.00 60.65 60.56 2eob s ILE 57 Cb -0.12 -3.90 -0.03 0.00 0.13 0.00 0.00 42.46 38.54 2eob s ILE 57 CO -0.05 0.54 -0.25 -0.89 -1.91 0.00 0.00 174.94 172.38 2eob s THR 58 N -0.98 2.07 0.31 4.00 2.01 -0.01 -1.45 115.64 121.59 2eob s THR 58 Ca 0.29 -1.44 -0.13 0.00 0.31 0.00 0.00 61.69 60.72 2eob s THR 58 Cb -0.19 -1.79 0.02 0.00 0.01 0.00 0.00 72.50 70.54 2eob s THR 58 CO 0.19 0.27 0.61 0.72 -0.69 0.00 0.00 174.62 175.71 2eob s PHE 59 N -0.87 0.34 -0.28 4.92 -0.71 -1.20 0.30 117.98 120.48 2eob s PHE 59 Ca 0.11 -0.78 -0.11 0.00 -1.04 0.00 0.00 56.93 55.12 2eob s PHE 59 Cb -0.10 0.40 -0.04 0.00 -1.21 0.00 0.00 43.02 42.07 2eob s PHE 59 CO 0.03 -1.22 0.18 0.50 -1.34 0.00 0.00 175.22 173.36 2eob s ARG 60 N -3.35 3.86 -0.63 1.99 3.52 -0.35 -0.72 118.95 123.26 2eob s ARG 60 Ca 0.20 -0.38 -0.09 0.00 -0.13 0.00 0.00 55.73 55.33 2eob s ARG 60 Cb -0.03 -3.62 0.16 0.00 -1.56 0.00 0.00 34.95 29.90 2eob s ARG 60 CO 0.12 -0.21 0.51 0.00 -0.81 0.00 0.00 175.30 174.91 2eob s ALA 61 N 1.73 3.68 -1.48 6.12 0.00 0.16 -2.30 121.76 129.67 2eob s ALA 61 Ca 0.07 -2.99 -0.13 0.00 0.00 0.00 0.00 51.96 48.90 2eob s ALA 61 Cb -0.16 -3.02 0.10 0.00 0.00 0.00 0.00 23.12 20.05 2eob s ALA 61 CO 0.10 -2.09 0.70 0.54 0.00 0.00 0.00 175.76 175.01 2eob n ARG 62 N 4.22 -3.79 0.00 0.00 3.00 -1.26 -2.25 116.66 116.58 2eob n ARG 62 Ca 0.03 0.47 0.00 0.00 -0.01 0.00 0.00 57.85 58.34 2eob n ARG 62 Cb 0.42 -5.23 0.00 0.00 0.00 0.00 0.00 32.46 27.65 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 -1.36 2.71 3.06 -0.13 0.00 -1.26 -5.07 105.19 103.14 2eob n GLY 63 Ca 0.03 -0.82 -0.27 0.00 0.00 0.00 0.00 46.02 44.96 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 -3.54 -5.23 1.61 2.85 -0.95 -4.68 118.16 108.21 2eob n LYS 64 Ca 0.00 -1.49 -0.32 0.00 -1.05 0.00 0.00 58.31 55.46 2eob n LYS 64 Cb 0.00 -1.56 -0.17 0.00 -0.65 0.00 0.00 35.03 32.65 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 -2.51 2.05 0.53 0.58 1.01 -1.26 0.36 120.40 121.16 2eob s VAL 65 Ca 0.63 -1.04 0.09 0.00 0.00 0.00 0.00 61.98 61.66 2eob s VAL 65 Cb -0.08 -1.75 0.06 0.00 0.00 0.00 0.00 36.38 34.61 2eob s VAL 65 CO 0.50 0.56 0.67 -0.54 0.00 0.00 0.00 175.10 176.29 2eob s LYS 66 N 0.10 2.41 -0.26 2.72 -0.14 0.10 -4.88 119.74 119.78 2eob s LYS 66 Ca -0.12 -1.62 -0.09 0.00 -1.36 0.00 0.00 55.97 52.78 2eob s LYS 66 Cb -0.16 -2.57 0.12 0.00 -1.68 0.00 0.00 37.83 33.54 2eob s LYS 66 CO 0.06 -0.67 0.57 -1.01 -0.76 0.00 0.00 175.35 173.54 2eob s HIS 67 N -2.61 -1.15 0.39 3.18 3.76 -1.26 -3.24 115.29 114.36 2eob s HIS 67 Ca 0.56 2.05 0.08 0.00 -0.15 0.00 0.00 55.06 57.59 2eob s HIS 67 Cb -0.06 0.63 -0.01 0.00 1.11 0.00 0.00 32.58 34.25 2eob s HIS 67 CO 0.34 -0.60 0.42 0.00 -0.85 0.00 0.00 174.74 174.06 2eob s ARG 69 N -4.17 2.86 -0.07 0.00 6.06 -1.26 -3.12 118.95 119.24 2eob s ARG 69 Ca 0.48 -0.50 0.02 0.00 -2.50 0.00 0.00 55.73 53.24 2eob s ARG 69 Cb -0.06 -2.69 0.01 0.00 0.06 0.00 0.00 34.95 32.27 2eob s ARG 69 CO 0.29 0.68 -0.14 0.42 -2.50 0.00 0.00 175.30 174.05 2eob s ILE 70 N -0.89 1.28 0.03 4.11 1.01 -0.83 -4.71 121.20 121.19 2eob s ILE 70 Ca 0.14 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.27 2eob s ILE 70 Cb -0.11 -1.16 -0.02 0.00 0.01 0.00 0.00 42.46 41.18 2eob s ILE 70 CO 0.03 0.39 -0.11 0.20 0.00 0.00 0.00 174.94 175.45 2eob s ASN 71 N 0.66 1.27 -0.06 3.58 0.02 -0.58 -2.99 114.94 116.86 2eob s ASN 71 Ca -0.14 -0.42 -0.07 0.00 -1.02 0.00 0.00 52.86 51.21 2eob s ASN 71 Cb -0.16 -0.06 -0.04 0.00 0.02 0.00 0.00 41.25 41.00 2eob s ASN 71 CO 0.04 -0.02 0.22 -0.13 0.02 0.00 0.00 177.10 177.22 2eob s ARG 72 N -1.07 3.54 -0.63 -0.60 3.00 -1.26 0.15 118.95 122.08 2eob s ARG 72 Ca -0.01 -0.06 0.05 0.00 0.00 0.00 0.00 55.73 55.70 2eob s ARG 72 Cb -0.07 -3.15 0.16 0.00 0.00 0.00 0.00 34.95 31.88 2eob s ARG 72 CO 0.01 0.72 0.43 -0.51 0.00 0.00 0.00 175.30 175.95 2eob s ASP 73 N -1.32 4.27 0.22 0.23 1.11 -0.47 -4.90 116.67 115.81 2eob s ASP 73 Ca 0.21 -3.57 0.00 0.00 0.18 0.00 0.00 52.55 49.37 2eob s ASP 73 Cb -0.13 -1.45 0.00 0.00 1.07 0.00 0.00 42.92 42.41 2eob s ASP 73 CO 0.10 -0.13 0.00 0.61 1.18 0.00 0.00 175.17 176.94 2eob n GLY 74 N 2.32 1.62 2.12 0.21 0.00 -1.26 -3.17 105.19 107.04 2eob n GLY 74 Ca 0.18 0.12 -0.25 0.00 0.00 0.00 0.00 46.02 46.07 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 3.55 -3.83 1.61 1.85 -1.26 -5.03 116.66 113.55 2eob n ARG 75 Ca 0.00 -4.20 -0.08 0.00 -1.00 0.00 0.00 57.85 52.57 2eob n ARG 75 Cb 0.00 -2.27 -0.03 0.00 -1.05 0.00 0.00 32.46 29.11 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 -3.60 -0.13 -0.16 2.89 3.76 -1.19 -4.85 115.29 112.01 2eob s HIS 76 Ca 0.51 -0.28 -0.01 0.00 -0.15 0.00 0.00 55.06 55.14 2eob s HIS 76 Cb 0.41 0.58 -0.01 0.00 1.11 0.00 0.00 32.58 34.68 2eob s HIS 76 CO -0.01 -1.13 -0.13 -0.06 -0.85 0.00 0.00 174.74 172.57 2eob s PHE 77 N -3.91 2.83 -0.12 1.40 0.40 -1.03 -1.37 117.98 116.18 2eob s PHE 77 Ca 0.12 -0.87 -0.02 0.00 -0.60 0.00 0.00 56.93 55.56 2eob s PHE 77 Cb -0.04 -1.91 -0.03 0.00 0.51 0.00 0.00 43.02 41.55 2eob s PHE 77 CO 0.04 -0.38 -0.06 0.08 0.70 0.00 0.00 175.22 175.60 2eob s VAL 78 N 0.74 3.75 -0.10 -0.44 1.01 0.12 -2.98 120.40 122.51 2eob s VAL 78 Ca -0.05 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.40 2eob s VAL 78 Cb -0.15 -2.59 -0.05 0.00 0.00 0.00 0.00 36.38 33.59 2eob s VAL 78 CO 0.01 0.54 -0.21 -0.11 0.00 0.00 0.00 175.10 175.33 2eob n LEU 79 N 2.98 1.48 0.00 3.92 7.94 -1.25 -1.52 117.00 130.56 2eob n LEU 79 Ca -0.18 0.24 0.00 0.00 -1.11 0.00 0.00 56.01 54.96 2eob n LEU 79 Cb 0.53 -0.55 0.00 0.00 0.53 0.00 0.00 43.42 43.93 2eob n LEU 79 CO 0.30 -0.22 0.00 0.61 -1.11 0.00 0.00 177.39 176.97 2eob n GLY 80 N 2.18 1.50 3.33 -3.96 0.00 -1.26 -4.74 105.19 102.23 2eob n GLY 80 Ca -0.16 -0.18 -0.32 0.00 0.00 0.00 0.00 46.02 45.36 2eob n GLY 80 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2eob s THR 81 N 0.87 2.55 -1.70 2.61 -1.32 -1.26 -4.69 115.64 112.69 2eob s THR 81 Ca 0.00 -0.87 -0.14 0.00 -1.21 0.00 0.00 61.69 59.47 2eob s THR 81 Cb 0.00 -1.99 0.13 0.00 -1.51 0.00 0.00 72.50 69.13 2eob s THR 81 CO 0.00 0.56 0.49 -1.54 -2.21 0.00 0.00 174.62 171.92 2eob n SER 82 N 3.09 -1.39 -4.10 8.08 3.41 -1.26 -4.89 113.62 116.56 2eob n SER 82 Ca -0.18 -1.16 -0.35 0.00 -0.26 0.00 0.00 58.87 56.92 2eob n SER 82 Cb 0.52 -2.09 -0.12 0.00 -0.26 0.00 0.00 64.21 62.27 2eob n SER 82 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2eob s ALA 83 N -3.62 3.22 -0.08 7.33 0.00 -1.26 -5.08 121.76 122.27 2eob s ALA 83 Ca 0.51 -2.71 0.03 0.00 0.00 0.00 0.00 51.96 49.79 2eob s ALA 83 Cb -0.29 -2.40 -0.02 0.00 0.00 0.00 0.00 23.12 20.41 2eob s ALA 83 CO 0.98 -1.86 -0.15 0.71 0.00 0.00 0.00 175.76 175.44 2eob s TYR 84 N 0.82 2.71 -0.16 0.00 1.51 -1.26 -3.74 117.35 117.23 2eob s TYR 84 Ca 0.11 -0.38 -0.06 0.00 -1.01 0.00 0.00 57.07 55.73 2eob s TYR 84 Cb -0.22 -1.70 0.07 0.00 -0.11 0.00 0.00 41.96 40.00 2eob s TYR 84 CO -0.04 0.01 0.34 -0.06 -1.11 0.00 0.00 175.55 174.69 2eob s PHE 85 N -0.31 -0.57 0.39 2.71 0.08 -1.16 -4.94 117.98 114.18 2eob s PHE 85 Ca 0.02 1.19 0.23 0.00 0.12 0.00 0.00 56.93 58.49 2eob s PHE 85 Cb -0.13 0.14 1.31 0.00 -0.57 0.00 0.00 43.02 43.77 2eob s PHE 85 CO 0.03 -0.38 1.62 1.49 -0.10 0.00 0.00 175.22 177.87 2eob h GLU 86 N 7.93 0.11 -2.13 0.44 4.81 -1.91 -2.73 114.58 121.10 2eob h GLU 86 Ca -0.22 -0.01 -0.06 0.00 -0.13 0.00 0.00 59.36 58.94 2eob h GLU 86 Cb 1.13 -0.03 -0.20 0.00 0.63 0.00 0.00 28.75 30.29 2eob h GLU 86 CO 0.18 0.08 0.12 0.45 -0.73 0.00 0.00 179.01 179.11 2eob s SER 87 N -4.61 -0.62 0.33 1.04 0.15 -1.26 -4.71 113.70 104.02 2eob s SER 87 Ca -0.09 0.81 0.21 0.00 0.70 0.00 0.00 55.95 57.59 2eob s SER 87 Cb 0.31 0.72 1.19 0.00 -1.71 0.00 0.00 66.02 66.53 2eob s SER 87 CO 0.80 -0.50 1.34 0.18 1.20 0.00 0.00 173.24 176.25 2eob n LEU 88 N 1.39 0.26 -0.17 3.45 4.77 -1.26 0.48 117.00 125.91 2eob n LEU 88 Ca -0.18 1.33 -0.05 0.00 -0.03 0.00 0.00 56.01 57.08 2eob n LEU 88 Cb 0.56 -0.65 0.01 0.00 -2.33 0.00 0.00 43.42 41.01 2eob n LEU 88 CO 0.19 -1.48 0.65 0.58 -1.33 0.00 0.00 177.39 176.00 2eob h VAL 89 N 0.00 0.22 0.24 4.08 2.07 -1.95 -1.02 116.25 119.89 2eob h VAL 89 Ca 0.73 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 68.24 2eob h VAL 89 Cb 2.08 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 32.07 2eob h VAL 89 CO -0.57 0.00 -0.11 -0.33 0.02 0.00 0.00 177.57 176.58 2eob h GLU 90 N -0.17 -0.31 -1.00 1.57 4.39 -0.36 -1.53 114.58 117.18 2eob h GLU 90 Ca 0.22 0.02 0.34 0.00 0.34 0.00 0.00 59.36 60.28 2eob h GLU 90 Cb 0.53 0.07 -0.15 0.00 -0.10 0.00 0.00 28.75 29.10 2eob h GLU 90 CO -0.63 -0.12 0.55 1.25 -1.16 0.00 0.00 179.01 178.91 2eob h LEU 91 N -0.43 0.46 -0.04 1.33 6.46 -1.23 0.40 115.31 122.26 2eob h LEU 91 Ca -0.03 0.20 -0.20 0.00 -0.12 0.00 0.00 57.88 57.74 2eob h LEU 91 Cb 0.33 0.17 0.01 0.00 -0.73 0.00 0.00 40.66 40.44 2eob h LEU 91 CO 0.05 -0.19 -0.74 0.58 -0.62 0.00 0.00 178.44 177.52 2eob h VAL 92 N 0.26 1.35 -1.00 1.05 2.07 -0.93 -3.16 116.25 115.89 2eob h VAL 92 Ca 0.75 -2.06 0.11 0.00 0.82 0.00 0.00 66.70 66.32 2eob h VAL 92 Cb 1.76 2.37 -0.08 0.00 -1.52 0.00 0.00 31.29 33.82 2eob h VAL 92 CO -0.64 0.62 0.63 -1.28 0.02 0.00 0.00 177.57 176.93 2eob h SER 93 N 0.18 0.95 0.76 0.57 0.87 0.76 0.18 113.55 117.81 2eob h SER 93 Ca -0.08 0.04 -0.04 0.00 -1.23 0.00 0.00 61.79 60.48 2eob h SER 93 Cb 1.41 -0.15 0.01 0.00 -0.44 0.00 0.00 62.40 63.22 2eob h SER 93 CO 0.15 0.53 -0.36 0.22 -0.53 0.00 0.00 176.83 176.83 2eob h TYR 94 N 1.03 -0.94 -0.85 2.24 5.03 -1.14 -3.14 116.97 119.19 2eob h TYR 94 Ca 0.48 -0.02 0.09 0.00 2.58 0.00 0.00 58.73 61.86 2eob h TYR 94 Cb 0.41 0.31 -0.07 0.00 1.55 0.00 0.00 36.73 38.93 2eob h TYR 94 CO -0.00 -0.59 0.50 1.88 -1.32 0.00 0.00 178.16 178.63 2eob h TYR 95 N -1.11 0.91 -1.61 -3.82 0.05 -1.47 -0.93 116.97 108.99 2eob h TYR 95 Ca -0.10 0.03 0.47 0.00 0.05 0.00 0.00 58.73 59.17 2eob h TYR 95 Cb 0.78 -0.28 -0.06 0.00 1.01 0.00 0.00 36.73 38.17 2eob h TYR 95 CO 0.03 0.38 1.22 0.39 -1.05 0.00 0.00 178.16 179.13 2eob n GLU 96 N -4.71 0.00 -0.06 4.88 1.02 0.61 -0.52 120.64 121.86 2eob n GLU 96 Ca 0.14 0.93 -0.10 0.00 -0.02 0.00 0.00 57.16 58.12 2eob n GLU 96 Cb 0.27 -2.18 -0.05 0.00 -0.02 0.00 0.00 31.44 29.46 2eob n GLU 96 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2eob n LYS 97 N -3.57 0.30 -3.49 3.49 4.76 -0.60 -4.84 118.16 114.21 2eob n LYS 97 Ca 0.36 0.08 -0.37 0.00 -2.87 0.00 0.00 58.31 55.51 2eob n LYS 97 Cb 1.70 -1.20 -0.06 0.00 -1.84 0.00 0.00 35.03 33.64 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 -2.24 3.71 0.22 2.13 3.76 0.32 -5.03 115.29 118.16 2eob s HIS 98 Ca -0.17 0.99 -0.31 0.00 -0.15 0.00 0.00 55.06 55.42 2eob s HIS 98 Cb 0.05 -2.29 -0.14 0.00 1.11 0.00 0.00 32.58 31.30 2eob s HIS 98 CO 0.27 0.61 1.21 0.00 -0.85 0.00 0.00 174.74 175.99 2eob n ALA 99 N 1.62 -0.00 -0.10 -1.40 0.00 -1.26 -4.21 120.51 115.17 2eob n ALA 99 Ca -0.12 0.43 -0.15 0.00 0.00 0.00 0.00 53.44 53.59 2eob n ALA 99 Cb 0.52 -2.11 -0.05 0.00 0.00 0.00 0.00 19.45 17.81 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 1.84 1.83 -4.55 0.00 7.94 -0.63 -4.94 117.00 118.48 2eob n LEU 100 Ca 0.12 0.31 -0.25 0.00 -1.11 0.00 0.00 56.01 55.08 2eob n LEU 100 Cb 0.29 -0.72 -0.10 0.00 0.53 0.00 0.00 43.42 43.42 2eob n LEU 100 CO 0.61 0.00 -0.38 -0.47 -1.11 0.00 0.00 177.39 176.04 2eob s TYR 101 N -2.69 2.42 -0.30 1.96 5.04 0.37 -5.00 117.35 119.16 2eob s TYR 101 Ca -0.30 -0.46 -0.28 0.00 -2.44 0.00 0.00 57.07 53.60 2eob s TYR 101 Cb 0.07 -1.34 -0.12 0.00 0.35 0.00 0.00 41.96 40.92 2eob s TYR 101 CO 0.41 0.59 1.09 -2.13 -1.34 0.00 0.00 175.55 174.16 2eob n ARG 102 N -0.80 0.00 -3.75 4.97 3.00 -1.26 0.13 116.66 118.95 2eob n ARG 102 Ca -0.05 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.56 2eob n ARG 102 Cb 0.63 -0.91 -0.07 0.00 0.00 0.00 0.00 32.46 32.11 2eob n ARG 102 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 2eob n LYS 103 N 3.19 -0.92 -3.53 -0.14 4.76 -1.26 -4.86 118.16 115.39 2eob n LYS 103 Ca 0.24 0.07 -0.17 0.00 -2.87 0.00 0.00 58.31 55.58 2eob n LYS 103 Cb -0.03 -2.71 -0.06 0.00 -1.84 0.00 0.00 35.03 30.39 2eob n LYS 103 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 2eob s MET 104 N -5.92 1.05 0.25 1.97 1.75 0.35 -5.09 119.30 113.66 2eob s MET 104 Ca 0.14 0.12 -0.21 0.00 -1.25 0.00 0.00 55.69 54.49 2eob s MET 104 Cb -0.08 0.49 0.03 0.00 2.84 0.00 0.00 34.83 38.11 2eob s MET 104 CO 0.71 -0.34 0.67 -0.98 -0.65 0.00 0.00 175.02 174.42 2eob s ARG 105 N -1.53 1.64 -0.89 4.11 1.70 -1.26 -0.48 118.95 122.24 2eob s ARG 105 Ca -0.10 -0.88 -0.25 0.00 -0.47 0.00 0.00 55.73 54.03 2eob s ARG 105 Cb -0.01 0.59 -0.06 0.00 -0.57 0.00 0.00 34.95 34.91 2eob s ARG 105 CO 0.07 -0.74 2.01 -0.51 -1.08 0.00 0.00 175.30 175.05 2eob s LEU 106 N -2.89 3.12 -0.20 -1.89 1.43 -1.26 -4.66 118.68 112.33 2eob s LEU 106 Ca 0.09 -0.59 -0.10 0.00 -1.03 0.00 0.00 54.13 52.50 2eob s LEU 106 Cb -0.04 -2.56 -0.20 0.00 0.03 0.00 0.00 46.19 43.42 2eob s LEU 106 CO 0.02 -2.91 0.08 -1.14 0.23 0.00 0.00 176.35 172.63 2eob n ARG 107 N 8.84 0.66 -3.92 1.70 3.00 -1.26 -4.54 116.66 121.14 2eob n ARG 107 Ca 0.41 0.32 -0.31 0.00 -0.00 0.00 0.00 57.85 58.28 2eob n ARG 107 Cb 0.46 -1.64 -0.15 0.00 0.00 0.00 0.00 32.46 31.13 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 -2.49 3.03 -0.71 -0.14 2.02 -1.26 -5.02 117.35 112.77 2eob s TYR 108 Ca -0.30 -2.54 -0.26 0.00 -0.37 0.00 0.00 57.07 53.60 2eob s TYR 108 Cb 0.08 -2.48 -0.03 0.00 -0.40 0.00 0.00 41.96 39.13 2eob s TYR 108 CO 0.64 -0.92 1.89 -1.25 -1.57 0.00 0.00 175.55 174.34 2eob s PRO 109 N 1.16 2.60 -0.18 -1.71 0.04 -1.26 -2.64 135.00 133.01 2eob s PRO 109 Ca 0.10 0.30 -0.35 0.00 0.04 0.00 0.00 61.00 61.09 2eob s PRO 109 Cb -0.18 -4.62 -0.16 0.00 0.04 0.00 0.00 34.50 29.57 2eob s PRO 109 CO -0.14 -2.96 1.05 0.28 0.04 0.00 0.00 177.00 175.27 2eob n VAL 110 N 7.44 0.00 -4.28 -0.36 0.31 0.05 -4.78 118.33 116.72 2eob n VAL 110 Ca 0.27 0.00 -0.19 0.00 -0.01 0.00 0.00 64.34 64.41 2eob n VAL 110 Cb 0.50 -0.18 -0.11 0.00 -0.91 0.00 0.00 33.84 33.15 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 1.05 1.52 -1.45 2.52 -4.23 -1.26 -4.10 115.64 109.69 2eob s THR 111 Ca 0.78 -1.88 0.15 0.00 -1.18 0.00 0.00 61.69 59.57 2eob s THR 111 Cb -1.11 -1.72 0.26 0.00 1.34 0.00 0.00 72.50 71.27 2eob s THR 111 CO 0.55 -0.44 1.40 -0.81 -0.54 0.00 0.00 174.62 174.78 2eob n PRO 112 N 0.26 0.22 -0.06 3.99 -0.04 -1.26 -2.28 135.00 135.83 2eob n PRO 112 Ca -0.13 0.14 -0.02 0.00 -0.04 0.00 0.00 63.50 63.45 2eob n PRO 112 Cb 0.58 -1.50 -0.16 0.00 -0.04 0.00 0.00 33.50 32.38 2eob n PRO 112 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2eob n GLU 113 N -1.28 0.68 -0.04 0.54 1.02 -1.26 -4.36 120.64 115.95 2eob n GLU 113 Ca 0.07 -0.08 -0.14 0.00 -0.02 0.00 0.00 57.16 57.00 2eob n GLU 113 Cb 0.12 -1.53 -0.09 0.00 -0.02 0.00 0.00 31.44 29.92 2eob n GLU 113 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 2eob h LEU 114 N 0.00 0.26 -0.64 -4.62 5.85 -1.87 -2.44 115.31 111.85 2eob h LEU 114 Ca -0.33 -0.56 0.13 0.00 0.84 0.00 0.00 57.88 57.96 2eob h LEU 114 Cb 1.75 -0.07 -0.11 0.00 0.37 0.00 0.00 40.66 42.60 2eob h LEU 114 CO 0.02 0.77 -0.01 -0.07 -0.34 0.00 0.00 178.44 178.82 2eob h LEU 115 N -0.25 -0.30 -0.22 2.25 -0.00 -1.77 0.30 115.31 115.32 2eob h LEU 115 Ca 0.00 0.16 -0.03 0.00 -0.00 0.00 0.00 57.88 58.01 2eob h LEU 115 Cb 0.73 0.29 -0.01 0.00 -0.00 0.00 0.00 40.66 41.67 2eob h LEU 115 CO 0.03 -0.13 0.02 -0.33 -0.00 0.00 0.00 178.44 178.04 2eob h GLU 116 N 0.11 0.37 0.00 1.13 5.08 -1.75 -2.70 114.58 116.82 2eob h GLU 116 Ca 0.33 -0.11 -0.00 0.00 -1.00 0.00 0.00 59.36 58.59 2eob h GLU 116 Cb 0.55 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 2eob h GLU 116 CO -0.55 0.53 -0.01 -0.09 -1.00 0.00 0.00 179.01 177.89 2eob h ARG 117 N 0.16 0.00 -0.89 2.33 2.43 -0.71 -0.53 114.38 117.16 2eob h ARG 117 Ca 0.07 0.00 -0.28 0.00 -0.81 0.00 0.00 59.98 58.96 2eob h ARG 117 Cb 0.35 0.00 -0.17 0.00 -0.42 0.00 0.00 29.97 29.73 2eob h ARG 117 CO 0.01 0.01 0.35 0.66 -1.51 0.00 0.00 179.97 179.49 2eob n TYR 118 N -4.27 2.19 -0.01 2.20 4.02 0.93 -4.33 117.16 117.90 2eob n TYR 118 Ca -0.03 -1.25 -0.19 0.00 -0.01 0.00 0.00 57.90 56.42 2eob n TYR 118 Cb 0.09 -0.68 -0.14 0.00 -0.02 0.00 0.00 39.34 38.59 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 1.55 0.28 -4.17 7.72 0.02 -0.99 -3.49 113.55 114.47 2eob h SER 119 Ca 0.34 -0.91 0.18 0.00 -0.84 0.00 0.00 61.79 60.56 2eob h SER 119 Cb 2.23 -0.09 -0.20 0.00 0.14 0.00 0.00 62.40 64.48 2eob h SER 119 CO 0.72 1.33 0.69 -0.83 -1.14 0.00 0.00 176.83 177.60 2eob s GLY 120 N -4.51 -0.28 -1.00 -3.77 0.00 -1.26 -5.04 107.32 91.45 2eob s GLY 120 Ca -0.18 1.72 -0.24 0.00 0.00 0.00 0.00 44.72 46.02 2eob s GLY 120 CO 0.76 0.68 1.94 2.56 0.00 0.00 0.00 173.10 179.04 2eob s PRO 121 N -2.10 2.53 -0.87 2.90 0.04 -1.26 -3.61 135.00 132.63 2eob s PRO 121 Ca 0.06 -0.60 -0.02 0.00 0.04 0.00 0.00 61.00 60.48 2eob s PRO 121 Cb -0.01 -5.13 -0.02 0.00 0.04 0.00 0.00 34.50 29.39 2eob s PRO 121 CO -0.05 -3.61 0.73 0.45 0.04 0.00 0.00 177.00 174.57 2eob n SER 122 N 14.16 -3.26 -4.04 6.66 2.88 -1.26 -4.99 113.62 123.77 2eob n SER 122 Ca 0.42 -0.49 -0.34 0.00 -1.33 0.00 0.00 58.87 57.13 2eob n SER 122 Cb 0.47 -4.02 -0.11 0.00 -0.75 0.00 0.00 64.21 59.79 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 -3.77 4.87 0.00 -3.46 0.01 -1.24 -5.26 113.70 104.86 2eob s SER 123 Ca 0.12 -2.95 0.00 0.00 1.31 0.00 0.00 55.95 54.43 2eob s SER 123 Cb -0.02 -1.77 0.00 0.00 0.21 0.00 0.00 66.02 64.44 2eob s SER 123 CO 0.55 -0.31 0.05 0.61 0.41 0.00 0.00 173.24 174.56