#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ete n ASP 2 N 0.00 -0.26 -4.70 4.04 9.92 -1.26 -4.87 116.55 119.42 2ete n ASP 2 Ca 0.00 1.15 -0.43 0.00 -0.53 0.00 0.00 54.79 54.98 2ete n ASP 2 Cb 0.00 -1.08 -0.01 0.00 -0.64 0.00 0.00 41.12 39.39 2ete n ASP 2 CO 0.00 0.00 0.00 -2.65 0.13 0.00 0.00 177.20 174.68 2ete n PRO 3 N 0.90 2.14 -1.61 -0.24 -0.02 -1.26 -4.95 135.00 129.95 2ete n PRO 3 Ca 0.15 0.75 -0.35 0.00 -2.02 0.00 0.00 63.50 62.03 2ete n PRO 3 Cb 0.28 -2.35 0.08 0.00 -0.02 0.00 0.00 33.50 31.48 2ete n PRO 3 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2ete s ASP 4 N -0.21 4.46 0.58 2.55 -0.00 -1.26 -4.79 116.67 118.00 2ete s ASP 4 Ca 0.57 2.45 -0.18 0.00 -0.00 0.00 0.00 52.55 55.39 2ete s ASP 4 Cb -0.58 -2.60 -0.04 0.00 -0.00 0.00 0.00 42.92 39.70 2ete s ASP 4 CO 0.60 -2.09 1.09 -2.16 -0.00 0.00 0.00 175.17 172.62 2ete s PRO 5 N -3.66 3.27 -0.00 8.23 0.04 -1.21 -4.98 135.00 136.69 2ete s PRO 5 Ca 0.77 1.43 0.10 0.00 0.04 0.00 0.00 61.00 63.34 2ete s PRO 5 Cb -0.32 -2.01 0.28 0.00 0.04 0.00 0.00 34.50 32.49 2ete s PRO 5 CO 0.42 -0.88 1.23 1.28 0.04 0.00 0.00 177.00 179.09 2ete n LEU 6 N -1.70 2.86 -3.83 -3.56 4.77 -1.26 -5.02 117.00 109.26 2ete n LEU 6 Ca 0.10 -2.01 -0.05 0.00 -0.03 0.00 0.00 56.01 54.02 2ete n LEU 6 Cb 0.52 -0.22 0.01 0.00 -2.33 0.00 0.00 43.42 41.40 2ete n LEU 6 CO 0.44 0.71 0.70 0.00 -1.33 0.00 0.00 177.39 177.91 2ete s GLN 7 N -1.02 1.53 0.05 3.23 0.00 -1.26 -5.09 119.66 117.10 2ete s GLN 7 Ca 0.21 -0.94 -0.29 0.00 -0.00 0.00 0.00 55.36 54.34 2ete s GLN 7 Cb 0.11 0.46 -0.17 0.00 0.00 0.00 0.00 33.01 33.40 2ete s GLN 7 CO 0.14 -0.71 1.52 -0.44 0.00 0.00 0.00 175.29 175.80 2ete h ASP 8 N 2.00 -0.52 -4.64 12.60 3.45 -2.03 -3.46 116.42 123.82 2ete h ASP 8 Ca -0.27 -0.04 -0.31 0.00 0.43 0.00 0.00 57.03 56.84 2ete h ASP 8 Cb 1.23 0.13 -0.20 0.00 -0.56 0.00 0.00 39.33 39.93 2ete h ASP 8 CO 0.33 -0.29 -0.74 -0.36 -1.57 0.00 0.00 179.24 176.61 2ete s PHE 9 N -5.63 0.86 -0.49 4.55 0.40 -1.26 -5.05 117.98 111.35 2ete s PHE 9 Ca -0.16 -0.54 0.06 0.00 -0.60 0.00 0.00 56.93 55.69 2ete s PHE 9 Cb 0.03 -0.50 0.22 0.00 0.51 0.00 0.00 43.02 43.29 2ete s PHE 9 CO 0.60 -0.05 0.84 0.00 0.70 0.00 0.00 175.22 177.32 2ete s VAL 11 N 0.76 2.87 0.19 0.00 1.01 -1.26 -4.46 120.40 119.51 2ete s VAL 11 Ca 0.31 0.51 -0.33 0.00 0.00 0.00 0.00 61.98 62.47 2ete s VAL 11 Cb 0.14 -3.33 -0.13 0.00 0.00 0.00 0.00 36.38 33.06 2ete s VAL 11 CO -0.16 0.02 1.64 0.00 0.00 0.00 0.00 175.10 176.60 2ete n ALA 12 N 4.70 2.11 -2.79 5.51 0.00 -0.50 -0.19 120.51 129.34 2ete n ALA 12 Ca 0.15 0.42 -0.43 0.00 0.00 0.00 0.00 53.44 53.57 2ete n ALA 12 Cb 0.40 -2.44 -0.05 0.00 0.00 0.00 0.00 19.45 17.36 2ete n ALA 12 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2ete s ASP 13 N 1.00 6.24 -0.02 0.00 3.68 -0.02 -4.61 116.67 122.94 2ete s ASP 13 Ca 0.76 -0.81 0.16 0.00 2.13 0.00 0.00 52.55 54.79 2ete s ASP 13 Cb -0.59 -2.38 0.48 0.00 -1.45 0.00 0.00 42.92 38.98 2ete s ASP 13 CO 0.36 -1.20 1.39 0.18 0.13 0.00 0.00 175.17 176.03 2ete n LEU 14 N 7.09 3.00 -4.73 -1.34 4.77 -1.26 -4.64 117.00 119.88 2ete n LEU 14 Ca -0.03 -1.50 -0.42 0.00 -0.03 0.00 0.00 56.01 54.02 2ete n LEU 14 Cb 0.46 -0.38 -0.02 0.00 -2.33 0.00 0.00 43.42 41.14 2ete n LEU 14 CO 0.61 0.69 1.31 -0.67 -1.33 0.00 0.00 177.39 178.00 2ete n ASP 15 N 0.99 3.90 0.33 -1.43 -0.08 -1.26 -4.87 116.55 114.13 2ete n ASP 15 Ca 0.18 1.10 0.22 0.00 -1.51 0.00 0.00 54.79 54.78 2ete n ASP 15 Cb 0.50 -1.58 1.18 0.00 2.34 0.00 0.00 41.12 43.56 2ete n ASP 15 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 2ete h GLY 16 N 5.94 0.00 -0.57 0.27 0.00 -2.03 -2.01 103.07 104.68 2ete h GLY 16 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.88 2ete h GLY 16 CO 0.89 0.00 -0.29 0.28 0.00 0.00 0.00 176.54 177.41 2ete n LYS 17 N -3.10 1.23 -1.99 4.80 4.76 -1.26 -4.96 118.16 117.64 2ete n LYS 17 Ca -0.03 -0.90 -0.37 0.00 -2.87 0.00 0.00 58.31 54.14 2ete n LYS 17 Cb 0.09 -1.48 0.02 0.00 -1.84 0.00 0.00 35.03 31.82 2ete n LYS 17 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ete s ALA 18 N -2.39 2.77 0.43 7.82 0.00 -0.76 -4.97 121.76 124.67 2ete s ALA 18 Ca 0.24 1.12 -0.26 0.00 0.00 0.00 0.00 51.96 53.05 2ete s ALA 18 Cb 0.19 -3.48 -0.09 0.00 0.00 0.00 0.00 23.12 19.74 2ete s ALA 18 CO 0.50 -1.11 1.46 1.55 0.00 0.00 0.00 175.76 178.16 2ete n VAL 19 N -1.05 2.53 -3.61 0.00 3.14 -1.26 -4.98 118.33 113.09 2ete n VAL 19 Ca 0.11 -0.50 -0.37 0.00 -2.96 0.00 0.00 64.34 60.61 2ete n VAL 19 Cb 0.47 -1.90 -0.06 0.00 -1.06 0.00 0.00 33.84 31.29 2ete n VAL 19 CO 0.00 0.00 0.00 -0.55 -6.46 0.00 0.00 176.83 169.82 2ete s SER 20 N -0.35 6.57 0.25 6.55 0.15 -1.26 -4.54 113.70 121.07 2ete s SER 20 Ca 0.58 0.67 0.01 0.00 0.70 0.00 0.00 55.95 57.92 2ete s SER 20 Cb -0.46 -2.18 -0.03 0.00 -1.71 0.00 0.00 66.02 61.64 2ete s SER 20 CO 0.60 0.26 0.21 0.68 1.20 0.00 0.00 173.24 176.19 2ete s VAL 21 N -0.49 0.00 -0.17 4.45 -7.23 -1.26 -5.05 120.40 110.65 2ete s VAL 21 Ca 0.19 -1.95 -0.33 0.00 -1.81 0.00 0.00 61.98 58.07 2ete s VAL 21 Cb -0.14 -2.49 -0.10 0.00 0.56 0.00 0.00 36.38 34.20 2ete s VAL 21 CO 0.08 0.00 2.03 -3.20 -0.31 0.00 0.00 175.10 173.69 2ete n ASN 22 N -0.78 3.15 0.00 4.85 5.15 -1.26 -4.32 115.26 122.06 2ete n ASN 22 Ca 0.04 0.69 0.00 0.00 -0.60 0.00 0.00 54.58 54.70 2ete n ASN 22 Cb 0.64 -1.39 0.00 0.00 -0.53 0.00 0.00 39.78 38.50 2ete n ASN 22 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2ete n GLY 23 N 5.17 1.28 3.10 8.20 0.00 -1.26 -4.88 105.19 116.80 2ete n GLY 23 Ca 0.28 -0.72 -0.12 0.00 0.00 0.00 0.00 46.02 45.46 2ete n GLY 23 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ete s HIS 24 N 0.00 -0.17 1.04 1.61 3.76 -1.26 -5.07 115.29 115.20 2ete s HIS 24 Ca 0.00 0.39 -0.12 0.00 -0.15 0.00 0.00 55.06 55.18 2ete s HIS 24 Cb 0.00 0.05 0.21 0.00 1.11 0.00 0.00 32.58 33.96 2ete s HIS 24 CO 0.00 -0.16 1.08 0.95 -0.85 0.00 0.00 174.74 175.75 2ete s THR 25 N -0.29 2.14 0.10 1.30 -4.23 -1.26 -4.84 115.64 108.55 2ete s THR 25 Ca -0.04 0.04 0.09 0.00 -1.18 0.00 0.00 61.69 60.61 2ete s THR 25 Cb -0.03 -2.16 -0.04 0.00 1.34 0.00 0.00 72.50 71.61 2ete s THR 25 CO 0.01 -0.06 -0.20 0.00 -0.54 0.00 0.00 174.62 173.82 2ete s LYS 27 N -1.91 4.13 0.50 0.00 -0.14 0.73 -4.70 119.74 118.35 2ete s LYS 27 Ca 0.16 2.10 -0.22 0.00 -1.36 0.00 0.00 55.97 56.65 2ete s LYS 27 Cb -0.10 -2.86 -0.07 0.00 -1.68 0.00 0.00 37.83 33.12 2ete s LYS 27 CO 0.08 -0.34 1.15 -2.30 -0.76 0.00 0.00 175.35 173.18 2ete n PRO 28 N 0.37 1.47 0.06 -1.68 -0.02 -1.26 -4.58 135.00 129.35 2ete n PRO 28 Ca 0.02 0.54 0.11 0.00 -2.02 0.00 0.00 63.50 62.15 2ete n PRO 28 Cb 0.44 -2.30 0.56 0.00 -0.02 0.00 0.00 33.50 32.18 2ete n PRO 28 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 2ete h MET 29 N 1.37 0.23 0.00 -0.52 2.86 -1.97 -0.50 114.93 116.40 2ete h MET 29 Ca -0.48 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.15 2ete h MET 29 Cb 1.32 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.93 2ete h MET 29 CO 0.56 0.15 0.00 0.66 1.06 0.00 0.00 176.91 179.34 2ete h SER 30 N 0.23 0.00 -0.01 1.22 4.64 -1.98 -2.46 113.55 115.19 2ete h SER 30 Ca 0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 2ete h SER 30 Cb 0.34 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.43 2ete h SER 30 CO -0.03 0.00 -0.01 -0.62 -0.87 0.00 0.00 176.83 175.30 2ete n GLU 31 N -2.55 0.66 0.16 4.77 1.02 -0.21 -4.65 120.64 119.84 2ete n GLU 31 Ca -0.01 -1.14 0.04 0.00 -0.02 0.00 0.00 57.16 56.03 2ete n GLU 31 Cb 0.12 -1.21 0.10 0.00 -0.02 0.00 0.00 31.44 30.43 2ete n GLU 31 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ete h ALA 32 N 2.20 0.75 -0.33 0.62 0.00 -1.26 -3.49 119.26 117.75 2ete h ALA 32 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2ete h ALA 32 Cb 0.46 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2ete h ALA 32 CO 0.00 0.55 0.00 0.41 0.00 0.00 0.00 179.25 180.21 2ete n GLY 33 N 1.03 -1.68 0.40 0.00 0.00 -1.26 -4.48 105.19 99.20 2ete n GLY 33 Ca 0.02 -1.32 0.07 0.00 0.00 0.00 0.00 46.02 44.79 2ete n GLY 33 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2ete n ASP 34 N 0.06 1.71 -0.17 1.61 8.00 -1.26 -4.66 116.55 121.84 2ete n ASP 34 Ca 0.00 -1.36 0.02 0.00 0.71 0.00 0.00 54.79 54.16 2ete n ASP 34 Cb 0.00 0.30 0.03 0.00 -0.02 0.00 0.00 41.12 41.43 2ete n ASP 34 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2ete n ASP 35 N 0.17 1.79 0.30 -2.24 8.00 -1.26 -4.75 116.55 118.56 2ete n ASP 35 Ca 0.07 -1.58 0.18 0.00 0.71 0.00 0.00 54.79 54.17 2ete n ASP 35 Cb 0.31 -0.04 0.94 0.00 -0.02 0.00 0.00 41.12 42.31 2ete n ASP 35 CO 0.00 0.00 0.00 2.19 -0.39 0.00 0.00 177.20 179.00 2ete h PHE 36 N 0.64 0.00 -0.11 1.24 -5.15 -1.83 -2.04 116.94 109.70 2ete h PHE 36 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 2ete h PHE 36 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.53 2ete h PHE 36 CO 0.04 0.03 0.00 1.28 -2.00 0.00 0.00 178.31 177.66 2ete n LEU 37 N -3.28 0.75 -4.09 2.10 4.77 -1.26 -4.02 117.00 111.97 2ete n LEU 37 Ca -0.02 -0.34 -0.16 0.00 -0.03 0.00 0.00 56.01 55.46 2ete n LEU 37 Cb 0.18 -0.07 -0.12 0.00 -2.33 0.00 0.00 43.42 41.07 2ete n LEU 37 CO 0.25 0.17 -0.43 -0.36 -1.33 0.00 0.00 177.39 175.70 2ete s PHE 38 N -1.86 0.87 0.03 -1.77 0.40 -0.77 -5.09 117.98 109.79 2ete s PHE 38 Ca 0.21 -0.41 -0.07 0.00 -0.60 0.00 0.00 56.93 56.05 2ete s PHE 38 Cb 0.10 -0.51 -0.00 0.00 0.51 0.00 0.00 43.02 43.12 2ete s PHE 38 CO 0.16 -0.02 0.14 0.45 0.70 0.00 0.00 175.22 176.65 2ete s SER 39 N -1.36 0.08 -0.04 1.36 0.15 -1.26 -5.03 113.70 107.59 2ete s SER 39 Ca -0.05 -0.36 0.06 0.00 0.70 0.00 0.00 55.95 56.30 2ete s SER 39 Cb -0.09 0.24 0.09 0.00 -1.71 0.00 0.00 66.02 64.55 2ete s SER 39 CO 0.01 -0.47 1.00 -1.54 1.20 0.00 0.00 173.24 173.43 2ete n SER 40 N 0.99 1.81 0.17 5.45 3.41 -1.26 -4.84 113.62 119.36 2ete n SER 40 Ca -0.20 -2.22 0.13 0.00 -0.26 0.00 0.00 58.87 56.31 2ete n SER 40 Cb 0.57 -0.14 0.58 0.00 -0.26 0.00 0.00 64.21 64.97 2ete n SER 40 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2ete h LYS 41 N 0.00 0.00 -0.66 4.33 1.57 -1.97 -2.88 116.57 116.96 2ete h LYS 41 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2ete h LYS 41 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.05 2ete h LYS 41 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 2ete n LEU 42 N -2.41 4.02 0.23 2.94 4.77 -1.26 -4.46 117.00 120.82 2ete n LEU 42 Ca 0.01 -2.13 0.11 0.00 -0.03 0.00 0.00 56.01 53.97 2ete n LEU 42 Cb 0.19 -0.48 0.46 0.00 -2.33 0.00 0.00 43.42 41.26 2ete n LEU 42 CO 0.19 0.91 0.82 0.71 -1.33 0.00 0.00 177.39 178.68 2ete h THR 43 N 3.90 0.46 -4.00 -5.08 1.35 -1.90 -3.45 112.91 104.20 2ete h THR 43 Ca 0.00 -1.07 -0.69 0.00 -0.55 0.00 0.00 66.41 64.10 2ete h THR 43 Cb 1.08 1.76 -0.22 0.00 -1.73 0.00 0.00 68.15 69.04 2ete h THR 43 CO 0.06 0.19 -0.79 -0.54 -0.25 0.00 0.00 175.52 174.19 2ete s LYS 44 N -3.61 2.25 0.29 4.72 1.02 -1.26 -5.10 119.74 118.05 2ete s LYS 44 Ca 0.01 -0.87 -0.29 0.00 0.02 0.00 0.00 55.97 54.84 2ete s LYS 44 Cb 0.10 -2.26 -0.10 0.00 -0.52 0.00 0.00 37.83 35.04 2ete s LYS 44 CO 0.63 0.57 1.33 0.00 -0.92 0.00 0.00 175.35 176.96 2ete s ALA 45 N -0.85 3.53 0.66 5.17 0.00 -1.26 -5.02 121.76 123.98 2ete s ALA 45 Ca 0.14 1.25 -0.13 0.00 0.00 0.00 0.00 51.96 53.22 2ete s ALA 45 Cb -0.11 -3.49 -0.01 0.00 0.00 0.00 0.00 23.12 19.51 2ete s ALA 45 CO 0.04 -0.64 1.06 0.20 0.00 0.00 0.00 175.76 176.42 2ete s GLY 46 N -0.19 1.86 -0.32 0.00 0.00 -1.26 -5.00 107.32 102.40 2ete s GLY 46 Ca 0.52 0.22 -0.28 0.00 0.00 0.00 0.00 44.72 45.19 2ete s GLY 46 CO 0.48 0.54 1.03 0.21 0.00 0.00 0.00 173.10 175.36 2ete s ASN 47 N -3.35 6.88 0.00 1.64 3.84 -1.26 -4.87 114.94 117.82 2ete s ASN 47 Ca 0.60 0.96 0.16 0.00 0.21 0.00 0.00 52.86 54.79 2ete s ASN 47 Cb -0.15 -2.52 0.68 0.00 -0.55 0.00 0.00 41.25 38.71 2ete s ASN 47 CO 0.48 -0.85 1.47 0.35 -2.79 0.00 0.00 177.10 175.76 2ete n THR 48 N 5.85 0.17 -1.88 -5.21 -2.24 -1.26 -4.49 114.28 105.22 2ete n THR 48 Ca 0.11 -0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.24 2ete n THR 48 Cb 0.47 0.12 -0.00 0.00 -2.10 0.00 0.00 70.33 68.82 2ete n THR 48 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2ete n SER 49 N -0.05 5.04 -4.28 3.42 7.64 -1.26 -3.86 113.62 120.27 2ete n SER 49 Ca 0.13 -2.91 -0.16 0.00 1.01 0.00 0.00 58.87 56.94 2ete n SER 49 Cb 0.21 -1.57 -0.10 0.00 -1.01 0.00 0.00 64.21 61.74 2ete n SER 49 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 2ete s THR 50 N 1.95 1.35 0.30 0.44 -4.23 -1.26 -5.01 115.64 109.18 2ete s THR 50 Ca 0.48 -2.11 0.05 0.00 -1.18 0.00 0.00 61.69 58.93 2ete s THR 50 Cb 0.13 -1.91 0.29 0.00 1.34 0.00 0.00 72.50 72.35 2ete s THR 50 CO -0.06 -0.70 1.76 -0.65 -0.54 0.00 0.00 174.62 174.43 2ete h PRO 51 N 2.71 0.67 0.00 3.99 0.11 -1.92 0.14 132.00 137.70 2ete h PRO 51 Ca -0.37 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.64 2ete h PRO 51 Cb 1.20 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.15 2ete h PRO 51 CO 0.63 0.44 -0.29 -0.91 -0.21 0.00 0.00 178.00 177.66 2ete h ASN 52 N 0.69 0.00 0.00 -2.05 2.35 -1.92 -3.47 115.58 111.18 2ete h ASN 52 Ca 0.57 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.32 2ete h ASN 52 Cb 0.93 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.30 2ete h ASN 52 CO -0.41 0.29 0.00 0.61 -1.65 0.00 0.00 177.43 176.28 2ete n GLY 53 N -0.60 0.43 3.10 2.83 0.00 0.50 -1.03 105.19 110.43 2ete n GLY 53 Ca -0.02 -1.01 -0.07 0.00 0.00 0.00 0.00 46.02 44.92 2ete n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ete s SER 54 N -2.92 0.46 -0.05 1.61 1.04 -1.25 -0.89 113.70 111.70 2ete s SER 54 Ca 0.00 -1.02 0.01 0.00 0.48 0.00 0.00 55.95 55.42 2ete s SER 54 Cb 0.00 0.22 0.02 0.00 0.10 0.00 0.00 66.02 66.36 2ete s SER 54 CO 0.00 -0.62 -0.06 0.00 0.98 0.00 0.00 173.24 173.54 2ete s ALA 55 N -3.94 0.77 -0.26 5.32 0.00 -0.43 -4.68 121.76 118.55 2ete s ALA 55 Ca 0.09 -0.12 -0.11 0.00 0.00 0.00 0.00 51.96 51.82 2ete s ALA 55 Cb 0.08 -0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 2ete s ALA 55 CO -0.08 0.02 0.20 0.08 0.00 0.00 0.00 175.76 175.98 2ete s VAL 56 N 0.83 5.31 -0.42 0.00 1.01 -1.26 -1.49 120.40 124.38 2ete s VAL 56 Ca -0.12 0.23 -0.14 0.00 0.00 0.00 0.00 61.98 61.95 2ete s VAL 56 Cb -0.15 -3.54 0.04 0.00 0.00 0.00 0.00 36.38 32.73 2ete s VAL 56 CO 0.01 0.27 0.30 -0.89 0.00 0.00 0.00 175.10 174.80 2ete s THR 57 N 1.53 5.00 0.21 3.92 2.01 0.25 -5.00 115.64 123.56 2ete s THR 57 Ca 0.08 -0.89 -0.27 0.00 0.31 0.00 0.00 61.69 60.92 2ete s THR 57 Cb -0.15 -3.87 -0.09 0.00 0.01 0.00 0.00 72.50 68.41 2ete s THR 57 CO 0.09 -0.39 0.85 -1.61 -0.69 0.00 0.00 174.62 172.86 2ete s GLU 58 N 1.62 4.65 -0.38 4.92 2.02 -1.26 -1.52 118.70 128.75 2ete s GLU 58 Ca 0.04 1.27 0.13 0.00 0.02 0.00 0.00 54.97 56.43 2ete s GLU 58 Cb -0.21 -3.19 0.43 0.00 0.10 0.00 0.00 34.13 31.26 2ete s GLU 58 CO 0.08 0.51 0.98 -0.11 0.02 0.00 0.00 175.26 176.74 2ete n LEU 59 N 1.39 2.60 0.00 1.80 7.94 -0.23 -4.83 117.00 125.67 2ete n LEU 59 Ca -0.03 -4.42 -0.19 0.00 -1.11 0.00 0.00 56.01 50.25 2ete n LEU 59 Cb 0.48 0.12 0.13 0.00 0.53 0.00 0.00 43.42 44.68 2ete n LEU 59 CO 0.47 1.89 0.58 -0.90 -1.11 0.00 0.00 177.39 178.31 2ete n ASP 60 N -0.18 0.16 0.21 1.96 3.85 -1.24 -2.47 116.55 118.84 2ete n ASP 60 Ca 0.21 -1.37 0.10 0.00 -0.71 0.00 0.00 54.79 53.02 2ete n ASP 60 Cb 0.73 -0.66 0.64 0.00 -1.35 0.00 0.00 41.12 40.48 2ete n ASP 60 CO 0.00 0.00 0.00 1.62 -1.01 0.00 0.00 177.20 177.81 2ete h VAL 61 N -1.42 0.96 -0.03 2.12 3.04 -1.44 0.19 116.25 119.67 2ete h VAL 61 Ca -0.29 -0.00 -0.05 0.00 -1.01 0.00 0.00 66.70 65.35 2ete h VAL 61 Cb 0.81 0.95 -0.01 0.00 -2.01 0.00 0.00 31.29 31.03 2ete h VAL 61 CO 0.21 0.00 -0.23 0.00 -1.01 0.00 0.00 177.57 176.54 2ete h ALA 62 N 1.95 1.57 0.00 3.17 0.00 -1.93 -2.56 119.26 121.45 2ete h ALA 62 Ca 0.04 -0.22 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 2ete h ALA 62 Cb 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2ete h ALA 62 CO -0.00 0.32 -2.01 0.39 0.00 0.00 0.00 179.25 177.95 2ete n GLU 63 N -4.25 0.66 -3.49 0.00 -0.58 -0.35 -4.69 120.64 107.95 2ete n GLU 63 Ca -0.02 -0.16 -0.27 0.00 -0.42 0.00 0.00 57.16 56.29 2ete n GLU 63 Cb 0.30 -1.50 -0.10 0.00 -0.57 0.00 0.00 31.44 29.57 2ete n GLU 63 CO 0.00 0.00 0.00 1.87 -0.48 0.00 0.00 177.13 178.52 2ete n TRP 64 N -2.30 0.41 0.33 -0.32 -0.00 0.52 -4.95 117.44 111.12 2ete n TRP 64 Ca -0.08 -3.63 0.21 0.00 -0.00 0.00 0.00 57.50 54.00 2ete n TRP 64 Cb 0.64 -0.08 1.12 0.00 -0.00 0.00 0.00 31.31 32.99 2ete n TRP 64 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 177.69 176.69 2ete h PRO 65 N 5.26 0.00 0.00 5.87 0.13 -1.71 -1.75 132.00 139.80 2ete h PRO 65 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 2ete h PRO 65 Cb 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 2ete h PRO 65 CO 0.49 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 179.05 2ete h GLY 66 N 0.22 0.00 2.00 1.56 0.00 -1.86 -1.15 103.07 103.83 2ete h GLY 66 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2ete h GLY 66 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 176.54 175.24 2ete n THR 67 N -2.49 0.48 -1.61 4.70 -2.24 -0.66 -4.82 114.28 107.63 2ete n THR 67 Ca -0.00 -0.08 -0.50 0.00 -2.27 0.00 0.00 64.05 61.19 2ete n THR 67 Cb 0.13 -0.67 -0.05 0.00 -2.10 0.00 0.00 70.33 67.63 2ete n THR 67 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2ete n ASN 68 N -1.96 2.10 0.00 3.42 5.15 -0.83 -1.15 115.26 121.99 2ete n ASN 68 Ca 0.05 1.11 0.00 0.00 -0.60 0.00 0.00 54.58 55.14 2ete n ASN 68 Cb 0.35 -1.26 0.00 0.00 -0.53 0.00 0.00 39.78 38.34 2ete n ASN 68 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 2ete n THR 69 N 2.81 0.00 1.04 -0.44 -2.24 -1.26 -4.42 114.28 109.76 2ete n THR 69 Ca 0.18 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 62.08 2ete n THR 69 Cb 0.22 -0.01 0.30 0.00 -2.10 0.00 0.00 70.33 68.74 2ete n THR 69 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2ete n LEU 70 N 0.00 0.52 -0.31 3.22 4.77 -0.30 -3.33 117.00 121.57 2ete n LEU 70 Ca 0.00 0.01 -0.04 0.00 -0.03 0.00 0.00 56.01 55.96 2ete n LEU 70 Cb 0.00 -0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 40.82 2ete n LEU 70 CO 0.00 0.12 -0.04 0.61 -1.33 0.00 0.00 177.39 176.75 2ete n GLY 71 N 1.48 0.55 3.17 -0.72 0.00 -1.26 -4.98 105.19 103.42 2ete n GLY 71 Ca 0.07 -0.87 -0.09 0.00 0.00 0.00 0.00 46.02 45.13 2ete n GLY 71 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ete s VAL 72 N -2.14 0.16 0.31 1.61 -7.23 -1.26 -2.68 120.40 109.17 2ete s VAL 72 Ca 0.00 -1.28 -0.19 0.00 -1.81 0.00 0.00 61.98 58.70 2ete s VAL 72 Cb 0.00 -1.30 0.06 0.00 0.56 0.00 0.00 36.38 35.70 2ete s VAL 72 CO 0.00 -0.71 0.85 -0.94 -0.31 0.00 0.00 175.10 173.99 2ete s SER 73 N -2.74 -0.05 0.12 4.85 1.04 -1.00 -3.67 113.70 112.26 2ete s SER 73 Ca 0.04 -0.91 -0.01 0.00 0.48 0.00 0.00 55.95 55.55 2ete s SER 73 Cb 0.04 0.73 -0.04 0.00 0.10 0.00 0.00 66.02 66.85 2ete s SER 73 CO -0.10 -1.43 0.04 -0.04 0.98 0.00 0.00 173.24 172.69 2ete s MET 74 N -2.59 0.87 0.22 4.02 -1.94 -1.03 -1.08 119.30 117.76 2ete s MET 74 Ca 0.16 -1.40 -0.13 0.00 -1.71 0.00 0.00 55.69 52.61 2ete s MET 74 Cb -0.04 0.22 0.00 0.00 2.01 0.00 0.00 34.83 37.01 2ete s MET 74 CO 0.09 -0.23 0.45 0.54 -0.01 0.00 0.00 175.02 175.86 2ete s ASN 75 N -3.03 -0.10 -0.01 3.03 6.03 -0.39 -1.07 114.94 119.40 2ete s ASN 75 Ca 0.21 -0.81 0.06 0.00 -1.03 0.00 0.00 52.86 51.29 2ete s ASN 75 Cb 0.08 0.56 -0.03 0.00 -3.03 0.00 0.00 41.25 38.82 2ete s ASN 75 CO -0.00 -1.07 -0.19 -0.60 -2.03 0.00 0.00 177.10 173.20 2ete s ARG 76 N -3.97 2.22 -0.08 3.55 3.52 -0.57 -1.11 118.95 122.50 2ete s ARG 76 Ca 0.18 -0.87 0.01 0.00 -0.13 0.00 0.00 55.73 54.92 2ete s ARG 76 Cb -0.00 -2.20 0.02 0.00 -1.56 0.00 0.00 34.95 31.21 2ete s ARG 76 CO 0.05 0.57 -0.09 0.08 -0.81 0.00 0.00 175.30 175.10 2ete s VAL 77 N -0.76 1.00 -0.00 7.11 1.01 -0.74 -0.58 120.40 127.43 2ete s VAL 77 Ca 0.12 -0.34 0.01 0.00 0.00 0.00 0.00 61.98 61.78 2ete s VAL 77 Cb -0.10 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.27 2ete s VAL 77 CO 0.02 0.34 0.00 -1.81 0.00 0.00 0.00 175.10 173.65 2ete s ASP 78 N 1.19 5.13 -0.07 3.32 1.01 -0.55 -1.52 116.67 125.18 2ete s ASP 78 Ca -0.05 -0.01 0.02 0.00 0.71 0.00 0.00 52.55 53.22 2ete s ASP 78 Cb -0.14 -1.34 0.01 0.00 1.01 0.00 0.00 42.92 42.46 2ete s ASP 78 CO -0.02 0.28 -0.12 -0.36 0.21 0.00 0.00 175.17 175.16 2ete s PHE 79 N -1.09 1.46 0.74 4.23 0.08 0.83 -1.31 117.98 122.92 2ete s PHE 79 Ca 0.20 -0.56 -0.12 0.00 0.12 0.00 0.00 56.93 56.56 2ete s PHE 79 Cb -0.12 -1.09 0.04 0.00 -0.57 0.00 0.00 43.02 41.29 2ete s PHE 79 CO 0.10 -0.31 1.10 0.00 -0.10 0.00 0.00 175.22 176.02 2ete s ALA 80 N 0.79 2.28 0.16 5.36 0.00 -0.07 -1.70 121.76 128.57 2ete s ALA 80 Ca -0.12 0.40 -0.34 0.00 0.00 0.00 0.00 51.96 51.90 2ete s ALA 80 Cb -0.15 -3.31 -0.14 0.00 0.00 0.00 0.00 23.12 19.52 2ete s ALA 80 CO 0.02 -1.66 1.57 -2.30 0.00 0.00 0.00 175.76 173.39 2ete n PRO 81 N -3.15 2.11 -0.94 0.00 -0.02 -1.26 -0.46 135.00 131.28 2ete n PRO 81 Ca 0.10 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 2ete n PRO 81 Cb 0.52 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.48 2ete n PRO 81 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ete n GLY 82 N 3.38 0.67 3.83 -1.23 0.00 -0.67 -5.01 105.19 106.16 2ete n GLY 82 Ca 0.17 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.87 2ete n GLY 82 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ete s GLY 83 N -2.00 2.11 0.04 -0.02 0.00 0.40 -4.75 107.32 103.10 2ete s GLY 83 Ca 0.00 0.26 0.06 0.00 0.00 0.00 0.00 44.72 45.04 2ete s GLY 83 CO 0.00 0.55 -0.17 -1.08 0.00 0.00 0.00 173.10 172.39 2ete s THR 84 N -2.54 1.39 -0.51 0.90 -1.32 -0.19 -0.92 115.64 112.45 2ete s THR 84 Ca 0.60 -1.10 -0.16 0.00 -1.21 0.00 0.00 61.69 59.83 2ete s THR 84 Cb -0.12 -1.23 0.10 0.00 -1.51 0.00 0.00 72.50 69.75 2ete s THR 84 CO 0.31 0.11 0.45 0.21 -2.21 0.00 0.00 174.62 173.49 2ete s ASN 85 N -1.15 6.17 0.85 8.08 2.47 -0.32 -4.02 114.94 127.02 2ete s ASN 85 Ca 0.05 -1.53 -0.11 0.00 0.42 0.00 0.00 52.86 51.69 2ete s ASN 85 Cb -0.08 -2.20 0.10 0.00 -1.45 0.00 0.00 41.25 37.62 2ete s ASN 85 CO 0.02 -0.76 1.09 -2.16 -3.72 0.00 0.00 177.10 171.57 2ete s PRO 86 N 1.67 1.62 -0.36 0.43 0.04 -1.26 -1.76 135.00 135.38 2ete s PRO 86 Ca 0.04 0.92 -0.45 0.00 0.04 0.00 0.00 61.00 61.55 2ete s PRO 86 Cb -0.27 -1.84 -0.20 0.00 0.04 0.00 0.00 34.50 32.23 2ete s PRO 86 CO 0.05 -2.02 1.48 -2.30 0.04 0.00 0.00 177.00 174.25 2ete n PRO 87 N -3.74 0.07 -3.88 0.56 -0.02 -1.25 -4.69 135.00 122.05 2ete n PRO 87 Ca 0.08 0.03 -0.09 0.00 -2.02 0.00 0.00 63.50 61.49 2ete n PRO 87 Cb 0.55 -1.54 -0.05 0.00 -0.02 0.00 0.00 33.50 32.44 2ete n PRO 87 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 2ete s HIS 88 N 2.27 0.12 0.01 6.00 -3.43 -0.22 -1.32 115.29 118.72 2ete s HIS 88 Ca 1.01 -0.49 0.02 0.00 -0.80 0.00 0.00 55.06 54.81 2ete s HIS 88 Cb -1.42 0.29 -0.01 0.00 -1.43 0.00 0.00 32.58 30.01 2ete s HIS 88 CO 0.75 -0.95 -0.08 0.42 -2.00 0.00 0.00 174.74 172.88 2ete s ILE 89 N -3.94 0.59 -0.40 -5.38 1.01 -0.44 -1.63 121.20 111.02 2ete s ILE 89 Ca 0.15 -0.48 -0.12 0.00 0.00 0.00 0.00 60.65 60.20 2ete s ILE 89 Cb -0.01 -0.53 0.03 0.00 0.01 0.00 0.00 42.46 41.97 2ete s ILE 89 CO 0.03 0.05 0.25 -1.00 0.00 0.00 0.00 174.94 174.27 2ete s HIS 90 N -0.42 3.25 0.51 3.97 3.76 -1.26 -0.71 115.29 124.39 2ete s HIS 90 Ca 0.01 -0.92 0.31 0.00 -0.15 0.00 0.00 55.06 54.30 2ete s HIS 90 Cb -0.04 -2.58 1.72 0.00 1.11 0.00 0.00 32.58 32.79 2ete s HIS 90 CO -0.00 -0.67 2.18 -1.00 -0.85 0.00 0.00 174.74 174.41 2ete h PRO 91 N 8.51 0.00 0.00 8.40 0.13 -1.72 -2.25 132.00 145.06 2ete h PRO 91 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 2ete h PRO 91 Cb 1.11 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.24 2ete h PRO 91 CO 0.71 0.05 -0.19 0.54 -0.23 0.00 0.00 178.00 178.88 2ete n ARG 92 N -3.64 0.85 -3.57 0.86 1.74 -0.93 -4.68 116.66 107.29 2ete n ARG 92 Ca -0.02 -1.82 -0.16 0.00 -0.77 0.00 0.00 57.85 55.08 2ete n ARG 92 Cb 0.16 -1.04 -0.06 0.00 -1.02 0.00 0.00 32.46 30.49 2ete n ARG 92 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ete s ALA 93 N -1.54 -1.75 0.36 7.54 0.00 -1.24 -4.65 121.76 120.47 2ete s ALA 93 Ca 0.16 1.56 -0.17 0.00 0.00 0.00 0.00 51.96 53.51 2ete s ALA 93 Cb 0.14 -0.43 -0.10 0.00 0.00 0.00 0.00 23.12 22.74 2ete s ALA 93 CO 0.02 -0.36 0.80 -0.08 0.00 0.00 0.00 175.76 176.14 2ete s THR 94 N -0.61 4.58 -0.04 0.00 -1.32 -1.26 -3.91 115.64 113.08 2ete s THR 94 Ca -0.07 1.13 0.03 0.00 -1.21 0.00 0.00 61.69 61.57 2ete s THR 94 Cb -0.02 -3.61 -0.03 0.00 -1.51 0.00 0.00 72.50 67.33 2ete s THR 94 CO 0.07 -0.22 -0.12 -0.70 -2.21 0.00 0.00 174.62 171.43 2ete s GLU 95 N -3.03 2.51 -0.05 7.08 2.12 -0.60 -2.63 118.70 124.10 2ete s GLU 95 Ca 0.57 -0.70 -0.00 0.00 0.36 0.00 0.00 54.97 55.19 2ete s GLU 95 Cb -0.10 -2.41 0.03 0.00 0.26 0.00 0.00 34.13 31.90 2ete s GLU 95 CO 0.16 0.62 -0.01 -1.50 -0.54 0.00 0.00 175.26 173.99 2ete s ILE 96 N -0.80 0.34 0.10 -3.70 2.07 -0.01 -0.55 121.20 118.66 2ete s ILE 96 Ca 0.13 0.06 -0.00 0.00 -1.41 0.00 0.00 60.65 59.43 2ete s ILE 96 Cb -0.11 -0.45 -0.04 0.00 0.13 0.00 0.00 42.46 41.99 2ete s ILE 96 CO 0.02 0.22 0.00 -0.83 -1.91 0.00 0.00 174.94 172.44 2ete s GLY 97 N 1.46 0.79 -0.04 1.50 0.00 -0.48 -0.53 107.32 110.01 2ete s GLY 97 Ca -0.03 -1.37 0.02 0.00 0.00 0.00 0.00 44.72 43.34 2ete s GLY 97 CO -0.03 -1.37 -0.08 -0.29 0.00 0.00 0.00 173.10 171.33 2ete s MET 98 N -3.96 1.07 0.03 2.90 1.75 -0.62 -1.71 119.30 118.76 2ete s MET 98 Ca 0.16 -0.24 -0.30 0.00 -1.25 0.00 0.00 55.69 54.06 2ete s MET 98 Cb 0.07 -0.98 -0.05 0.00 2.84 0.00 0.00 34.83 36.71 2ete s MET 98 CO -0.03 0.00 1.15 0.08 -0.65 0.00 0.00 175.02 175.57 2ete s VAL 99 N 0.63 4.26 -0.21 10.11 1.01 -0.81 -1.52 120.40 133.87 2ete s VAL 99 Ca -0.10 1.62 0.10 0.00 0.00 0.00 0.00 61.98 63.60 2ete s VAL 99 Cb -0.13 -4.04 -0.22 0.00 0.00 0.00 0.00 36.38 32.00 2ete s VAL 99 CO 0.01 0.10 -0.01 0.23 0.00 0.00 0.00 175.10 175.44 2ete n MET 100 N 4.15 0.67 -3.76 2.72 2.81 0.00 -0.74 117.12 122.98 2ete n MET 100 Ca 0.09 0.08 -0.13 0.00 -1.81 0.00 0.00 57.70 55.93 2ete n MET 100 Cb 0.47 -1.54 -0.11 0.00 -0.71 0.00 0.00 33.22 31.33 2ete n MET 100 CO 0.00 0.00 0.00 0.21 1.51 0.00 0.00 175.97 177.69 2ete s LYS 101 N -2.51 0.37 0.78 0.03 2.20 -1.08 -4.66 119.74 114.88 2ete s LYS 101 Ca -0.20 0.46 0.00 0.00 -0.36 0.00 0.00 55.97 55.86 2ete s LYS 101 Cb 0.07 0.17 0.00 0.00 -1.51 0.00 0.00 37.83 36.56 2ete s LYS 101 CO 0.73 -0.05 0.00 0.41 -0.36 0.00 0.00 175.35 176.08 2ete n GLY 102 N 2.97 -1.77 2.85 5.54 0.00 -1.26 -1.68 105.19 111.83 2ete n GLY 102 Ca -0.13 -1.71 -0.28 0.00 0.00 0.00 0.00 46.02 43.89 2ete n GLY 102 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ete s GLU 103 N 0.00 1.19 -0.21 1.61 2.02 -1.26 -3.86 118.70 118.18 2ete s GLU 103 Ca 0.00 -0.61 -0.00 0.00 0.02 0.00 0.00 54.97 54.37 2ete s GLU 103 Cb 0.00 -2.20 0.02 0.00 0.10 0.00 0.00 34.13 32.05 2ete s GLU 103 CO 0.00 -0.56 -0.14 -0.51 0.02 0.00 0.00 175.26 174.08 2ete s LEU 104 N 1.65 2.57 -0.01 1.80 1.43 -0.63 -1.89 118.68 123.59 2ete s LEU 104 Ca -0.02 -0.70 -0.30 0.00 -1.03 0.00 0.00 54.13 52.08 2ete s LEU 104 Cb -0.17 -1.57 -0.06 0.00 0.03 0.00 0.00 46.19 44.42 2ete s LEU 104 CO -0.07 -0.04 1.52 -0.22 0.23 0.00 0.00 176.35 177.76 2ete s LEU 105 N 1.32 4.32 -0.16 1.79 2.96 0.21 -0.09 118.68 129.03 2ete s LEU 105 Ca 0.03 2.20 0.01 0.00 -0.22 0.00 0.00 54.13 56.15 2ete s LEU 105 Cb -0.14 -3.55 0.01 0.00 0.50 0.00 0.00 46.19 43.00 2ete s LEU 105 CO -0.09 -0.82 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.25 2ete s VAL 106 N 2.98 2.29 -0.06 1.68 1.01 -0.50 -0.72 120.40 127.09 2ete s VAL 106 Ca 0.68 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.82 2ete s VAL 106 Cb -0.33 -1.95 -0.01 0.00 0.00 0.00 0.00 36.38 34.09 2ete s VAL 106 CO 0.28 0.53 -0.23 -0.83 0.00 0.00 0.00 175.10 174.85 2ete s GLY 107 N 0.96 1.20 -0.06 4.51 0.00 -0.58 -2.52 107.32 110.84 2ete s GLY 107 Ca -0.03 -0.94 0.02 0.00 0.00 0.00 0.00 44.72 43.77 2ete s GLY 107 CO -0.04 -0.54 -0.10 -0.42 0.00 0.00 0.00 173.10 172.00 2ete s ILE 108 N -0.06 0.97 -0.18 0.90 1.01 0.62 -1.35 121.20 123.10 2ete s ILE 108 Ca -0.05 -0.38 -0.03 0.00 0.00 0.00 0.00 60.65 60.19 2ete s ILE 108 Cb -0.14 -0.90 -0.01 0.00 0.01 0.00 0.00 42.46 41.42 2ete s ILE 108 CO 0.04 0.32 -0.06 -0.76 0.00 0.00 0.00 174.94 174.47 2ete s LEU 109 N 0.71 2.92 0.88 2.97 1.43 -0.31 -0.76 118.68 126.52 2ete s LEU 109 Ca -0.14 -0.32 -0.11 0.00 -1.03 0.00 0.00 54.13 52.53 2ete s LEU 109 Cb -0.15 -1.71 0.12 0.00 0.03 0.00 0.00 46.19 44.48 2ete s LEU 109 CO 0.03 0.07 1.09 -0.83 0.23 0.00 0.00 176.35 176.94 2ete s GLY 110 N 0.96 1.64 0.43 -3.19 0.00 -0.15 -4.09 107.32 102.91 2ete s GLY 110 Ca -0.01 0.12 -0.07 0.00 0.00 0.00 0.00 44.72 44.76 2ete s GLY 110 CO 0.00 0.58 0.58 -1.14 0.00 0.00 0.00 173.10 173.12 2ete n SER 111 N -3.91 0.03 -0.30 1.64 3.41 -1.26 -4.06 113.62 109.16 2ete n SER 111 Ca 0.08 -1.21 0.03 0.00 -0.26 0.00 0.00 58.87 57.52 2ete n SER 111 Cb 0.54 -0.45 0.18 0.00 -0.26 0.00 0.00 64.21 64.22 2ete n SER 111 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2ete h LEU 112 N 0.00 0.70 -2.07 1.04 5.85 -1.97 -1.06 115.31 117.80 2ete h LEU 112 Ca -0.19 0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.56 2ete h LEU 112 Cb 0.52 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.46 2ete h LEU 112 CO 0.13 0.39 -0.09 0.44 -0.34 0.00 0.00 178.44 178.98 2ete h ASP 113 N 0.81 0.00 -0.48 1.25 5.19 -2.04 -0.65 116.42 120.51 2ete h ASP 113 Ca 0.41 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.82 2ete h ASP 113 Cb 0.38 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.89 2ete h ASP 113 CO -0.25 0.09 0.00 -1.20 -3.12 0.00 0.00 179.24 174.76 2ete n SER 114 N -3.70 3.75 -1.40 6.45 7.64 -0.51 -4.92 113.62 120.93 2ete n SER 114 Ca -0.02 -2.36 -0.15 0.00 1.01 0.00 0.00 58.87 57.34 2ete n SER 114 Cb 0.19 -0.51 -0.04 0.00 -1.01 0.00 0.00 64.21 62.84 2ete n SER 114 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ete n GLY 115 N 0.88 0.80 4.06 0.23 0.00 -0.25 -2.68 105.19 108.23 2ete n GLY 115 Ca 0.19 -0.28 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 2ete n GLY 115 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2ete n ASN 116 N -0.64 -3.18 -4.73 1.61 3.02 -0.58 -4.90 115.26 105.85 2ete n ASN 116 Ca -0.16 -0.93 -0.41 0.00 -0.03 0.00 0.00 54.58 53.04 2ete n ASN 116 Cb 0.56 -3.23 -0.03 0.00 -0.61 0.00 0.00 39.78 36.46 2ete n ASN 116 CO 0.00 0.00 0.00 -0.75 -2.62 0.00 0.00 177.26 173.89 2ete s LYS 117 N -6.72 4.42 -0.29 3.52 2.20 -1.09 -4.67 119.74 117.10 2ete s LYS 117 Ca 0.56 1.97 -0.15 0.00 -0.36 0.00 0.00 55.97 57.98 2ete s LYS 117 Cb -0.29 -3.23 -0.03 0.00 -1.51 0.00 0.00 37.83 32.77 2ete s LYS 117 CO 0.88 -0.22 0.39 -1.17 -0.36 0.00 0.00 175.35 174.88 2ete s LEU 118 N 0.08 4.14 -0.20 5.43 2.96 -1.26 -0.98 118.68 128.85 2ete s LEU 118 Ca 0.56 0.17 -0.09 0.00 -0.22 0.00 0.00 54.13 54.55 2ete s LEU 118 Cb -0.34 -2.44 -0.05 0.00 0.50 0.00 0.00 46.19 43.86 2ete s LEU 118 CO 0.36 -0.25 0.11 -0.31 -1.32 0.00 0.00 176.35 174.94 2ete s TYR 119 N 2.11 3.33 0.04 5.38 1.51 0.06 -4.96 117.35 124.82 2ete s TYR 119 Ca 0.15 0.21 -0.23 0.00 -1.01 0.00 0.00 57.07 56.19 2ete s TYR 119 Cb -0.16 -2.15 0.05 0.00 -0.11 0.00 0.00 41.96 39.59 2ete s TYR 119 CO 0.11 0.19 0.52 -1.54 -1.11 0.00 0.00 175.55 173.72 2ete s SER 120 N 0.50 -0.45 0.15 2.29 1.04 -1.26 -0.28 113.70 115.69 2ete s SER 120 Ca 0.06 0.21 -0.24 0.00 0.48 0.00 0.00 55.95 56.46 2ete s SER 120 Cb -0.12 0.49 0.07 0.00 0.10 0.00 0.00 66.02 66.56 2ete s SER 120 CO -0.00 -0.70 0.72 0.00 0.98 0.00 0.00 173.24 174.24 2ete s ARG 121 N -2.32 1.28 -0.31 4.02 1.70 -1.05 -5.00 118.95 117.27 2ete s ARG 121 Ca -0.06 -0.56 -0.26 0.00 -0.47 0.00 0.00 55.73 54.37 2ete s ARG 121 Cb -0.01 0.53 0.01 0.00 -0.57 0.00 0.00 34.95 34.91 2ete s ARG 121 CO -0.01 -0.57 0.93 0.08 -1.08 0.00 0.00 175.30 174.66 2ete s VAL 122 N -3.60 4.65 -0.20 4.99 1.01 -1.26 -1.40 120.40 124.58 2ete s VAL 122 Ca 0.05 1.47 -0.08 0.00 0.00 0.00 0.00 61.98 63.42 2ete s VAL 122 Cb -0.02 -4.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 2ete s VAL 122 CO -0.06 -0.36 0.09 -0.69 0.00 0.00 0.00 175.10 174.08 2ete s VAL 123 N 3.30 4.95 0.47 2.92 1.01 0.87 -4.90 120.40 129.03 2ete s VAL 123 Ca 0.39 0.03 0.03 0.00 0.00 0.00 0.00 61.98 62.43 2ete s VAL 123 Cb -0.13 -3.26 0.03 0.00 0.00 0.00 0.00 36.38 33.02 2ete s VAL 123 CO 0.14 0.42 0.26 0.54 0.00 0.00 0.00 175.10 176.46 2ete n ARG 124 N 3.81 0.82 -1.65 2.72 1.74 -1.26 -1.61 116.66 121.23 2ete n ARG 124 Ca -0.16 -3.08 -0.50 0.00 -0.77 0.00 0.00 57.85 53.33 2ete n ARG 124 Cb 0.52 0.48 -0.05 0.00 -1.02 0.00 0.00 32.46 32.38 2ete n ARG 124 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ete n ALA 125 N -1.88 0.21 0.00 7.54 0.00 -1.25 -1.20 120.51 123.94 2ete n ALA 125 Ca -0.16 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.71 2ete n ALA 125 Cb 0.55 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.75 2ete n ALA 125 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ete n GLY 126 N 3.37 2.20 3.88 0.00 0.00 0.09 -5.00 105.19 109.72 2ete n GLY 126 Ca 0.20 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 2ete n GLY 126 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ete s GLU 127 N -0.29 3.77 0.24 1.61 2.02 -0.34 -4.90 118.70 120.81 2ete s GLU 127 Ca 0.00 0.39 0.06 0.00 0.02 0.00 0.00 54.97 55.43 2ete s GLU 127 Cb 0.00 -2.46 -0.05 0.00 0.10 0.00 0.00 34.13 31.72 2ete s GLU 127 CO 0.00 0.05 -0.07 0.95 0.02 0.00 0.00 175.26 176.21 2ete s THR 128 N -2.25 1.46 0.06 3.63 -4.23 -1.26 -1.92 115.64 111.13 2ete s THR 128 Ca 0.50 -2.11 -0.10 0.00 -1.18 0.00 0.00 61.69 58.80 2ete s THR 128 Cb -0.10 -2.28 0.00 0.00 1.34 0.00 0.00 72.50 71.46 2ete s THR 128 CO 0.29 -0.41 0.21 0.72 -0.54 0.00 0.00 174.62 174.89 2ete s PHE 129 N -3.14 0.08 -0.02 3.99 -0.12 -0.70 -5.01 117.98 113.07 2ete s PHE 129 Ca 0.26 -0.39 0.03 0.00 -0.05 0.00 0.00 56.93 56.78 2ete s PHE 129 Cb 0.03 -0.03 -0.00 0.00 -0.63 0.00 0.00 43.02 42.39 2ete s PHE 129 CO 0.09 -0.49 -0.09 0.54 -0.05 0.00 0.00 175.22 175.22 2ete s VAL 130 N -3.18 0.74 -0.26 -2.49 0.11 -1.26 -1.38 120.40 112.68 2ete s VAL 130 Ca -0.00 -0.36 0.01 0.00 -2.93 0.00 0.00 61.98 58.70 2ete s VAL 130 Cb 0.02 -0.65 0.07 0.00 -1.53 0.00 0.00 36.38 34.29 2ete s VAL 130 CO -0.07 0.22 -0.04 -0.63 -3.33 0.00 0.00 175.10 171.25 2ete s ILE 131 N 0.04 1.70 0.44 7.04 -1.09 0.29 -5.00 121.20 124.61 2ete s ILE 131 Ca -0.00 -1.46 -0.24 0.00 -2.23 0.00 0.00 60.65 56.71 2ete s ILE 131 Cb -0.06 -1.99 -0.09 0.00 -1.58 0.00 0.00 42.46 38.73 2ete s ILE 131 CO 0.00 -0.19 1.15 -2.65 -1.23 0.00 0.00 174.94 172.02 2ete n PRO 132 N 4.58 1.61 -1.56 2.79 -0.02 -1.26 -1.55 135.00 139.60 2ete n PRO 132 Ca -0.10 0.58 -0.57 0.00 -2.02 0.00 0.00 63.50 61.39 2ete n PRO 132 Cb 0.43 -2.24 -0.07 0.00 -0.02 0.00 0.00 33.50 31.59 2ete n PRO 132 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2ete n ARG 133 N -0.05 0.46 -0.54 -0.52 0.63 -1.25 -2.63 116.66 112.76 2ete n ARG 133 Ca 0.08 0.17 0.00 0.00 -0.92 0.00 0.00 57.85 57.18 2ete n ARG 133 Cb 0.40 -1.73 0.00 0.00 0.45 0.00 0.00 32.46 31.58 2ete n ARG 133 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2ete n GLY 134 N 2.16 1.84 3.84 5.14 0.00 -0.85 -4.95 105.19 112.38 2ete n GLY 134 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.87 2ete n GLY 134 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ete s LEU 135 N 0.00 4.36 0.31 0.99 1.43 -1.08 -4.81 118.68 119.87 2ete s LEU 135 Ca 0.00 1.12 -0.29 0.00 -1.03 0.00 0.00 54.13 53.93 2ete s LEU 135 Cb 0.00 -3.26 -0.10 0.00 0.03 0.00 0.00 46.19 42.86 2ete s LEU 135 CO 0.00 0.11 1.24 -0.32 0.23 0.00 0.00 176.35 177.61 2ete s MET 136 N -1.88 4.45 0.19 1.70 -2.45 -1.26 -4.58 119.30 115.47 2ete s MET 136 Ca 0.37 2.08 -0.21 0.00 -1.25 0.00 0.00 55.69 56.68 2ete s MET 136 Cb -0.16 -3.11 0.05 0.00 1.25 0.00 0.00 34.83 32.86 2ete s MET 136 CO 0.19 -0.06 0.60 -3.38 1.05 0.00 0.00 175.02 173.42 2ete s HIS 137 N -1.08 -0.36 0.20 4.11 -3.43 -0.64 -1.17 115.29 112.91 2ete s HIS 137 Ca 0.48 0.07 -0.14 0.00 -0.80 0.00 0.00 55.06 54.67 2ete s HIS 137 Cb -0.37 0.54 0.01 0.00 -1.43 0.00 0.00 32.58 31.33 2ete s HIS 137 CO 0.48 -0.94 0.43 -0.59 -2.00 0.00 0.00 174.74 172.13 2ete s PHE 138 N -3.81 0.15 0.05 0.38 -0.12 -0.45 -1.05 117.98 113.12 2ete s PHE 138 Ca 0.05 -0.51 0.04 0.00 -0.05 0.00 0.00 56.93 56.45 2ete s PHE 138 Cb -0.02 0.20 -0.03 0.00 -0.63 0.00 0.00 43.02 42.55 2ete s PHE 138 CO -0.07 -0.87 -0.11 -0.65 -0.05 0.00 0.00 175.22 173.48 2ete s GLN 139 N -3.93 0.67 -0.09 1.99 1.11 -0.72 -1.52 119.66 117.16 2ete s GLN 139 Ca 0.14 -0.82 -0.04 0.00 0.01 0.00 0.00 55.36 54.65 2ete s GLN 139 Cb 0.00 -0.56 0.05 0.00 -1.01 0.00 0.00 33.01 31.49 2ete s GLN 139 CO 0.01 0.12 0.20 0.12 0.01 0.00 0.00 175.29 175.74 2ete s PHE 140 N -1.27 -0.26 -0.57 0.91 5.36 0.10 -1.17 117.98 121.08 2ete s PHE 140 Ca -0.06 0.69 -0.28 0.00 -0.96 0.00 0.00 56.93 56.32 2ete s PHE 140 Cb -0.10 -0.07 0.03 0.00 -0.34 0.00 0.00 43.02 42.54 2ete s PHE 140 CO 0.01 -0.24 1.18 1.21 -1.46 0.00 0.00 175.22 175.92 2ete s ASN 141 N 1.63 6.46 0.00 6.13 3.84 -0.09 -0.62 114.94 132.29 2ete s ASN 141 Ca -0.05 0.12 0.26 0.00 0.21 0.00 0.00 52.86 53.40 2ete s ASN 141 Cb -0.11 -2.55 0.65 0.00 -0.55 0.00 0.00 41.25 38.69 2ete s ASN 141 CO -0.07 -1.46 1.50 1.33 -2.79 0.00 0.00 177.10 175.61 2ete n VAL 142 N 6.67 0.00 -2.37 -5.21 0.24 -0.79 -1.66 118.33 115.21 2ete n VAL 142 Ca 0.09 -0.11 -0.26 0.00 -2.04 0.00 0.00 64.34 62.02 2ete n VAL 142 Cb 0.49 0.42 0.13 0.00 -1.47 0.00 0.00 33.84 33.41 2ete n VAL 142 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2ete s GLY 143 N -2.61 1.76 0.01 7.63 0.00 -1.23 -4.94 107.32 107.93 2ete s GLY 143 Ca 0.21 -1.54 0.23 0.00 0.00 0.00 0.00 44.72 43.63 2ete s GLY 143 CO 0.57 -0.91 1.16 0.28 0.00 0.00 0.00 173.10 174.19 2ete n LYS 144 N -3.13 0.06 -4.19 2.90 5.02 -1.26 -4.29 118.16 113.27 2ete n LYS 144 Ca 0.15 -0.00 -0.24 0.00 -2.02 0.00 0.00 58.31 56.20 2ete n LYS 144 Cb 0.60 -1.52 -0.07 0.00 -0.02 0.00 0.00 35.03 34.02 2ete n LYS 144 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2ete s THR 145 N -3.04 2.64 0.28 -0.18 -4.23 -1.26 -4.77 115.64 105.08 2ete s THR 145 Ca 0.08 -1.79 -0.30 0.00 -1.18 0.00 0.00 61.69 58.51 2ete s THR 145 Cb 0.16 -2.93 -0.10 0.00 1.34 0.00 0.00 72.50 70.97 2ete s THR 145 CO 0.78 -0.12 1.45 -0.70 -0.54 0.00 0.00 174.62 175.49 2ete s GLU 146 N -3.82 4.24 0.23 3.99 2.12 -1.26 -4.27 118.70 119.92 2ete s GLU 146 Ca 0.38 2.36 0.11 0.00 0.36 0.00 0.00 54.97 58.18 2ete s GLU 146 Cb 0.01 -3.08 -0.05 0.00 0.26 0.00 0.00 34.13 31.27 2ete s GLU 146 CO 0.22 -0.43 -0.20 0.00 -0.54 0.00 0.00 175.26 174.30 2ete s ALA 147 N -0.26 2.68 0.09 6.30 0.00 -0.69 -4.55 121.76 125.34 2ete s ALA 147 Ca 0.58 -1.71 -0.13 0.00 0.00 0.00 0.00 51.96 50.70 2ete s ALA 147 Cb -0.43 -0.37 0.02 0.00 0.00 0.00 0.00 23.12 22.34 2ete s ALA 147 CO 0.47 0.37 0.32 1.52 0.00 0.00 0.00 175.76 178.44 2ete s TYR 148 N -2.00 -0.08 0.07 0.00 -0.85 -0.68 -0.12 117.35 113.70 2ete s TYR 148 Ca 0.25 -0.23 0.01 0.00 -0.52 0.00 0.00 57.07 56.58 2ete s TYR 148 Cb -0.07 0.12 -0.04 0.00 0.38 0.00 0.00 41.96 42.36 2ete s TYR 148 CO 0.13 -0.61 -0.06 0.00 -1.52 0.00 0.00 175.55 173.49 2ete s MET 149 N -3.50 0.70 -0.09 -3.49 0.23 -0.58 -0.82 119.30 111.76 2ete s MET 149 Ca 0.02 -1.19 0.02 0.00 -1.03 0.00 0.00 55.69 53.51 2ete s MET 149 Cb 0.02 -0.09 0.01 0.00 -1.53 0.00 0.00 34.83 33.24 2ete s MET 149 CO -0.09 -0.03 -0.15 0.08 -2.03 0.00 0.00 175.02 172.79 2ete s VAL 150 N -3.27 1.44 0.16 5.16 1.01 -0.58 -1.78 120.40 122.53 2ete s VAL 150 Ca 0.06 -0.63 0.08 0.00 0.00 0.00 0.00 61.98 61.49 2ete s VAL 150 Cb 0.03 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 35.07 2ete s VAL 150 CO -0.05 0.43 -0.17 0.68 0.00 0.00 0.00 175.10 175.99 2ete s VAL 151 N 0.80 1.68 0.18 2.92 -7.23 -0.26 -1.58 120.40 116.90 2ete s VAL 151 Ca -0.11 -1.90 0.08 0.00 -1.81 0.00 0.00 61.98 58.24 2ete s VAL 151 Cb -0.16 -1.79 -0.04 0.00 0.56 0.00 0.00 36.38 34.95 2ete s VAL 151 CO 0.02 -0.38 -0.16 -0.44 -0.31 0.00 0.00 175.10 173.83 2ete s SER 152 N -2.69 2.60 0.08 4.85 0.01 0.31 -1.26 113.70 117.60 2ete s SER 152 Ca 0.15 -0.93 0.04 0.00 1.31 0.00 0.00 55.95 56.52 2ete s SER 152 Cb -0.05 -0.14 -0.03 0.00 0.21 0.00 0.00 66.02 66.01 2ete s SER 152 CO 0.06 -0.10 -0.12 -0.36 0.41 0.00 0.00 173.24 173.12 2ete s PHE 153 N -2.48 1.11 -0.28 2.43 0.40 -0.24 -0.83 117.98 118.09 2ete s PHE 153 Ca 0.19 -0.53 -0.00 0.00 -0.60 0.00 0.00 56.93 55.99 2ete s PHE 153 Cb -0.03 -0.62 0.23 0.00 0.51 0.00 0.00 43.02 43.11 2ete s PHE 153 CO 0.07 0.03 1.85 0.27 0.70 0.00 0.00 175.22 178.14 2ete n ASN 154 N 1.04 5.58 -3.81 1.36 6.94 -1.08 -2.56 115.26 122.72 2ete n ASN 154 Ca -0.19 -2.96 -0.12 0.00 -0.02 0.00 0.00 54.58 51.28 2ete n ASN 154 Cb 0.55 -0.95 -0.09 0.00 -2.36 0.00 0.00 39.78 36.93 2ete n ASN 154 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2ete s SER 155 N 0.16 -0.10 0.45 0.53 0.15 -1.09 -4.37 113.70 109.44 2ete s SER 155 Ca 0.29 -0.01 0.30 0.00 0.70 0.00 0.00 55.95 57.23 2ete s SER 155 Cb 0.23 0.28 1.19 0.00 -1.71 0.00 0.00 66.02 66.01 2ete s SER 155 CO 0.01 -0.38 1.88 0.06 1.20 0.00 0.00 173.24 176.01 2ete h GLN 156 N 4.22 0.00 -1.05 5.44 3.07 -1.78 -2.64 115.11 122.36 2ete h GLN 156 Ca -0.30 0.00 -0.36 0.00 0.09 0.00 0.00 58.65 58.08 2ete h GLN 156 Cb 1.19 0.00 -0.25 0.00 0.08 0.00 0.00 27.48 28.49 2ete h GLN 156 CO 0.40 0.00 -0.75 -1.71 0.09 0.00 0.00 178.83 176.86 2ete n ASN 157 N -2.82 -1.69 0.08 0.06 4.05 -1.26 -1.43 115.26 112.25 2ete n ASN 157 Ca 0.01 -2.95 0.05 0.00 0.45 0.00 0.00 54.58 52.14 2ete n ASN 157 Cb 0.30 0.74 0.47 0.00 1.23 0.00 0.00 39.78 42.52 2ete n ASN 157 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 2ete h PRO 158 N 4.29 0.37 0.00 1.20 0.13 -1.88 -3.45 132.00 132.66 2ete h PRO 158 Ca -0.01 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 65.09 2ete h PRO 158 Cb 0.98 -0.08 0.00 0.00 0.13 0.00 0.00 31.00 32.03 2ete h PRO 158 CO 0.34 0.28 0.00 0.41 -0.23 0.00 0.00 178.00 178.80 2ete n GLY 159 N -1.39 -2.36 2.76 1.56 0.00 -1.26 -2.20 105.19 102.30 2ete n GLY 159 Ca 0.01 -1.42 -0.21 0.00 0.00 0.00 0.00 46.02 44.40 2ete n GLY 159 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2ete s ILE 160 N -3.35 0.23 -0.55 -0.61 2.07 -1.26 -4.29 121.20 113.43 2ete s ILE 160 Ca 0.00 0.18 -0.10 0.00 -1.41 0.00 0.00 60.65 59.32 2ete s ILE 160 Cb 0.00 -0.39 0.14 0.00 0.13 0.00 0.00 42.46 42.34 2ete s ILE 160 CO 0.00 0.22 0.44 -0.69 -1.91 0.00 0.00 174.94 173.00 2ete s VAL 161 N 1.81 4.52 -0.19 4.00 1.01 0.12 -4.98 120.40 126.69 2ete s VAL 161 Ca 0.02 -1.98 -0.29 0.00 0.00 0.00 0.00 61.98 59.73 2ete s VAL 161 Cb -0.12 -3.93 -0.01 0.00 0.00 0.00 0.00 36.38 32.32 2ete s VAL 161 CO -0.04 -0.84 1.21 -0.36 0.00 0.00 0.00 175.10 175.07 2ete s PHE 162 N 1.06 2.96 0.02 5.22 2.99 -1.26 -1.33 117.98 127.63 2ete s PHE 162 Ca 0.08 1.11 -0.26 0.00 0.00 0.00 0.00 56.93 57.87 2ete s PHE 162 Cb -0.24 -3.47 -0.17 0.00 0.00 0.00 0.00 43.02 39.14 2ete s PHE 162 CO -0.02 -1.40 1.34 0.28 -0.00 0.00 0.00 175.22 175.42 2ete h VAL 163 N 5.51 0.78 -0.09 -0.44 2.07 -1.52 -1.27 116.25 121.30 2ete h VAL 163 Ca -0.25 -0.54 0.00 0.00 0.82 0.00 0.00 66.70 66.74 2ete h VAL 163 Cb 1.09 1.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.94 2ete h VAL 163 CO 0.98 0.11 0.06 -0.65 0.02 0.00 0.00 177.57 178.08 2ete h PRO 164 N -0.64 0.12 -0.69 1.57 0.11 -1.93 -0.71 132.00 129.82 2ete h PRO 164 Ca -0.04 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.06 2ete h PRO 164 Cb 0.45 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.51 2ete h PRO 164 CO 0.06 0.09 0.41 1.25 -0.21 0.00 0.00 178.00 179.60 2ete h LEU 165 N 0.11 0.84 -0.31 2.35 5.85 -1.94 -1.18 115.31 121.02 2ete h LEU 165 Ca 0.03 -0.07 -0.20 0.00 0.84 0.00 0.00 57.88 58.49 2ete h LEU 165 Cb 0.00 -0.21 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 2ete h LEU 165 CO -0.01 0.66 -0.83 0.00 -0.34 0.00 0.00 178.44 177.92 2ete h THR 166 N 0.95 1.42 -0.65 1.05 1.03 -1.18 0.21 112.91 115.74 2ete h THR 166 Ca 0.25 -2.38 -0.01 0.00 -0.01 0.00 0.00 66.41 64.27 2ete h THR 166 Cb -0.02 2.31 -0.03 0.00 -1.07 0.00 0.00 68.15 69.34 2ete h THR 166 CO -0.05 0.70 0.38 -0.07 -0.01 0.00 0.00 175.52 176.48 2ete h LEU 167 N 0.20 0.79 0.00 0.00 3.38 -0.92 -3.28 115.31 115.48 2ete h LEU 167 Ca -0.05 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2ete h LEU 167 Cb 1.44 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.99 2ete h LEU 167 CO 0.14 0.63 -1.33 0.49 0.09 0.00 0.00 178.44 178.46 2ete n PHE 168 N -4.57 0.00 -2.37 1.13 3.01 -0.46 -4.55 117.46 109.65 2ete n PHE 168 Ca 0.05 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.51 2ete n PHE 168 Cb 0.07 -0.20 0.06 0.00 -0.01 0.00 0.00 39.48 39.40 2ete n PHE 168 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2ete n GLY 169 N 1.88 2.60 3.64 1.37 0.00 0.72 -4.59 105.19 110.81 2ete n GLY 169 Ca -0.01 -1.20 -0.29 0.00 0.00 0.00 0.00 46.02 44.52 2ete n GLY 169 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ete s SER 170 N -2.89 2.10 -0.40 1.61 1.04 -1.16 -4.68 113.70 109.32 2ete s SER 170 Ca 0.35 1.10 0.04 0.00 0.48 0.00 0.00 55.95 57.92 2ete s SER 170 Cb 0.37 -1.71 0.11 0.00 0.10 0.00 0.00 66.02 64.89 2ete s SER 170 CO -0.09 -3.45 0.13 -0.62 0.98 0.00 0.00 173.24 170.19 2ete s ASP 171 N -3.44 4.58 0.80 7.02 2.15 -1.26 -1.29 116.67 125.22 2ete s ASP 171 Ca 0.67 -2.45 -0.12 0.00 0.43 0.00 0.00 52.55 51.08 2ete s ASP 171 Cb -0.18 -1.61 0.07 0.00 -0.30 0.00 0.00 42.92 40.91 2ete s ASP 171 CO 0.58 -0.33 1.14 -2.16 -0.17 0.00 0.00 175.17 174.23 2ete s PRO 172 N 0.50 2.05 0.67 4.34 0.04 -1.26 -5.12 135.00 136.22 2ete s PRO 172 Ca 0.13 0.30 -0.17 0.00 0.04 0.00 0.00 61.00 61.30 2ete s PRO 172 Cb -0.21 -1.94 0.01 0.00 0.04 0.00 0.00 34.50 32.39 2ete s PRO 172 CO -0.06 -1.57 1.21 -2.14 0.04 0.00 0.00 177.00 174.49 2ete s PRO 173 N -5.42 2.49 0.28 0.56 0.02 -0.41 -4.97 135.00 127.55 2ete s PRO 173 Ca 0.61 1.80 -0.30 0.00 0.02 0.00 0.00 61.00 63.13 2ete s PRO 173 Cb -0.12 -1.87 -0.12 0.00 0.02 0.00 0.00 34.50 32.41 2ete s PRO 173 CO 0.51 -1.57 1.58 -0.89 -0.33 0.00 0.00 177.00 176.30 2ete n ILE 174 N -2.25 0.96 -1.70 2.83 5.41 -1.26 -4.92 119.36 118.44 2ete n ILE 174 Ca 0.14 -0.24 -0.43 0.00 1.00 0.00 0.00 62.75 63.21 2ete n ILE 174 Cb 0.50 -1.91 -0.01 0.00 -0.71 0.00 0.00 39.64 37.50 2ete n ILE 174 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 2ete n PRO 175 N 2.23 2.17 -0.26 0.38 -0.02 -1.26 -4.86 135.00 133.38 2ete n PRO 175 Ca 0.09 0.76 0.05 0.00 -2.02 0.00 0.00 63.50 62.38 2ete n PRO 175 Cb 0.36 -2.40 0.18 0.00 -0.02 0.00 0.00 33.50 31.63 2ete n PRO 175 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 2ete h THR 176 N 2.81 0.72 -0.55 3.45 2.02 -1.99 -1.50 112.91 117.87 2ete h THR 176 Ca -0.46 -0.18 0.11 0.00 0.77 0.00 0.00 66.41 66.65 2ete h THR 176 Cb 1.27 0.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.81 2ete h THR 176 CO 0.69 0.09 0.38 -0.65 0.37 0.00 0.00 175.52 176.40 2ete h PRO 177 N 0.52 0.27 -0.28 6.66 0.11 -2.00 0.14 132.00 137.42 2ete h PRO 177 Ca 0.41 -0.02 -0.05 0.00 0.11 0.00 0.00 66.00 66.45 2ete h PRO 177 Cb 0.57 -0.06 -0.01 0.00 0.11 0.00 0.00 31.00 31.61 2ete h PRO 177 CO -0.36 0.18 -0.00 0.28 -0.21 0.00 0.00 178.00 177.88 2ete h VAL 178 N 0.28 1.26 -0.10 3.15 2.07 -1.64 -2.93 116.25 118.32 2ete h VAL 178 Ca 0.26 -0.94 -0.18 0.00 0.82 0.00 0.00 66.70 66.67 2ete h VAL 178 Cb 0.66 1.31 -0.01 0.00 -1.52 0.00 0.00 31.29 31.73 2ete h VAL 178 CO -0.06 0.30 -0.68 -0.07 0.02 0.00 0.00 177.57 177.09 2ete h LEU 179 N 0.29 0.51 -0.60 2.57 3.38 -1.03 -1.47 115.31 118.96 2ete h LEU 179 Ca 0.08 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 2ete h LEU 179 Cb 0.43 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 2ete h LEU 179 CO 0.02 1.04 0.26 0.71 0.09 0.00 0.00 178.44 180.56 2ete h THR 180 N 0.31 1.22 -0.37 0.22 1.35 -0.83 0.52 112.91 115.34 2ete h THR 180 Ca -0.02 -0.65 -0.04 0.00 -0.55 0.00 0.00 66.41 65.15 2ete h THR 180 Cb 1.24 0.54 -0.01 0.00 -1.73 0.00 0.00 68.15 68.18 2ete h THR 180 CO 0.12 0.26 0.07 0.50 -0.25 0.00 0.00 175.52 176.22 2ete h LYS 181 N 0.82 0.60 -0.34 4.72 1.63 -1.42 -1.29 116.57 121.30 2ete h LYS 181 Ca 0.20 -0.15 -0.16 0.00 -0.85 0.00 0.00 60.65 59.69 2ete h LYS 181 Cb 0.16 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.71 2ete h LYS 181 CO -0.02 0.65 -0.41 0.00 -3.45 0.00 0.00 179.45 176.22 2ete h ALA 182 N 0.92 0.63 0.00 5.00 0.00 -1.13 -3.28 119.26 121.39 2ete h ALA 182 Ca 0.11 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.56 2ete h ALA 182 Cb 0.34 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.01 2ete h ALA 182 CO 0.00 0.67 -0.81 1.28 0.00 0.00 0.00 179.25 180.40 2ete n LEU 183 N -4.04 0.71 -1.55 0.00 4.77 0.16 -4.98 117.00 112.07 2ete n LEU 183 Ca -0.02 -0.19 -0.14 0.00 -0.03 0.00 0.00 56.01 55.62 2ete n LEU 183 Cb 0.55 -0.12 -0.01 0.00 -2.33 0.00 0.00 43.42 41.51 2ete n LEU 183 CO 0.48 0.16 -0.17 0.54 -1.33 0.00 0.00 177.39 177.06 2ete n ARG 184 N -1.60 -1.09 -4.35 3.23 1.74 -0.49 -5.01 116.66 109.09 2ete n ARG 184 Ca 0.04 0.68 -0.18 0.00 -0.77 0.00 0.00 57.85 57.62 2ete n ARG 184 Cb 0.36 -4.94 -0.10 0.00 -1.02 0.00 0.00 32.46 26.75 2ete n ARG 184 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2ete s VAL 185 N -2.68 1.10 0.79 1.55 -7.23 -1.22 -5.08 120.40 107.61 2ete s VAL 185 Ca 0.00 -2.04 -0.11 0.00 -1.81 0.00 0.00 61.98 58.03 2ete s VAL 185 Cb 0.00 -2.41 0.06 0.00 0.56 0.00 0.00 36.38 34.59 2ete s VAL 185 CO 0.00 -0.28 1.09 -1.61 -0.31 0.00 0.00 175.10 173.99 2ete s GLU 186 N -3.86 2.15 0.37 4.82 2.02 -1.26 -4.60 118.70 118.34 2ete s GLU 186 Ca 0.30 1.12 0.11 0.00 0.02 0.00 0.00 54.97 56.51 2ete s GLU 186 Cb 0.06 -1.89 0.87 0.00 0.10 0.00 0.00 34.13 33.27 2ete s GLU 186 CO 0.10 -1.70 1.86 0.00 0.02 0.00 0.00 175.26 175.53 2ete h ALA 187 N -1.17 1.90 -0.99 5.21 0.00 -1.96 -2.04 119.26 120.21 2ete h ALA 187 Ca -0.44 0.02 0.04 0.00 0.00 0.00 0.00 54.91 54.53 2ete h ALA 187 Cb 1.24 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 18.87 2ete h ALA 187 CO 0.52 -0.16 0.65 0.78 0.00 0.00 0.00 179.25 181.04 2ete h GLY 188 N 0.63 1.46 0.83 0.00 0.00 -1.99 0.11 103.07 104.11 2ete h GLY 188 Ca 0.46 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 47.22 2ete h GLY 188 CO -0.21 0.41 -0.19 -2.08 0.00 0.00 0.00 176.54 174.46 2ete h VAL 189 N 1.24 1.33 -0.47 4.60 2.07 -1.74 -1.54 116.25 121.74 2ete h VAL 189 Ca 0.40 -1.36 0.02 0.00 0.82 0.00 0.00 66.70 66.58 2ete h VAL 189 Cb 0.03 1.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 2ete h VAL 189 CO -0.13 0.41 0.28 0.58 0.02 0.00 0.00 177.57 178.73 2ete h VAL 190 N 0.15 1.06 -0.60 2.57 2.07 -1.24 -1.88 116.25 118.39 2ete h VAL 190 Ca 0.03 -0.19 -0.05 0.00 0.82 0.00 0.00 66.70 67.30 2ete h VAL 190 Cb 0.74 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 2ete h VAL 190 CO 0.05 0.10 0.15 -0.33 0.02 0.00 0.00 177.57 177.57 2ete h GLU 191 N 0.56 0.92 -0.39 1.57 4.39 -0.76 -0.35 114.58 120.53 2ete h GLU 191 Ca 0.18 -0.19 0.01 0.00 0.34 0.00 0.00 59.36 59.71 2ete h GLU 191 Cb 0.00 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.49 2ete h GLU 191 CO -0.08 0.82 0.23 1.25 -1.16 0.00 0.00 179.01 180.07 2ete h LEU 192 N 0.88 0.38 -0.40 1.33 5.85 -0.94 -0.55 115.31 121.86 2ete h LEU 192 Ca 0.19 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.90 2ete h LEU 192 Cb 0.30 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.23 2ete h LEU 192 CO -0.00 0.28 0.21 -0.07 -0.34 0.00 0.00 178.44 178.52 2ete h LEU 193 N 0.48 0.52 -0.91 2.25 3.38 -1.03 -2.68 115.31 117.31 2ete h LEU 193 Ca 0.15 -0.10 0.11 0.00 0.09 0.00 0.00 57.88 58.12 2ete h LEU 193 Cb -0.01 -0.13 -0.08 0.00 0.09 0.00 0.00 40.66 40.53 2ete h LEU 193 CO -0.06 0.47 0.55 0.11 0.09 0.00 0.00 178.44 179.60 2ete h LYS 194 N 0.52 0.87 -0.03 1.13 1.57 -0.82 -2.42 116.57 117.39 2ete h LYS 194 Ca 0.14 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.88 2ete h LYS 194 Cb 0.08 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.19 2ete h LYS 194 CO -0.02 0.57 0.03 0.66 -0.57 0.00 0.00 179.45 180.12 2ete h SER 195 N 0.89 0.00 1.62 0.86 4.64 -0.75 -1.63 113.55 119.19 2ete h SER 195 Ca 0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.76 2ete h SER 195 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2ete h SER 195 CO -0.25 0.00 0.00 0.11 -0.87 0.00 0.00 176.83 175.82 2ete h LYS 196 N 0.00 0.00 -0.03 4.77 1.79 -1.38 -3.29 116.57 118.42 2ete h LYS 196 Ca 0.02 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2ete h LYS 196 Cb 0.07 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 2ete h LYS 196 CO -0.00 0.00 0.00 1.19 -1.08 0.00 0.00 179.45 179.56 2ete n PHE 197 N -2.80 0.08 0.27 -1.35 3.01 -0.64 -4.79 117.46 111.24 2ete n PHE 197 Ca 0.04 -0.79 0.14 0.00 1.01 0.00 0.00 57.45 57.85 2ete n PHE 197 Cb 0.45 -0.12 0.76 0.00 -0.01 0.00 0.00 39.48 40.56 2ete n PHE 197 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ete h ALA 198 N 0.20 1.19 -0.00 4.37 0.00 -1.56 -2.89 119.26 120.56 2ete h ALA 198 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.82 2ete h ALA 198 Cb 0.84 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.61 2ete h ALA 198 CO 0.01 0.12 -0.04 0.41 0.00 0.00 0.00 179.25 179.76 2ete n GLY 199 N -0.56 -1.23 1.19 0.00 0.00 -1.26 -4.91 105.19 98.41 2ete n GLY 199 Ca -0.01 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.83 2ete n GLY 199 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ete n GLY 200 N 1.31 0.73 0.00 -0.02 0.00 -1.09 -5.22 105.19 100.89 2ete n GLY 200 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2ete n GLY 200 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18