#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 -0.93 -4.66 4.04 9.92 -1.26 -4.87 116.55 118.79 2ete n ASP 2 Ca 0.00 1.14 -0.43 0.00 -0.53 0.00 0.00 54.79 54.97 2ete n ASP 2 Cb 0.00 -0.94 -0.01 0.00 -0.64 0.00 0.00 41.12 39.53 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 1.13 1.87 -1.69 -0.24 -0.02 -1.26 -4.96 135.00 129.83 2ete n PRO 3 Ca 0.19 0.66 -0.35 0.00 -2.02 0.00 0.00 63.50 61.97 2ete n PRO 3 Cb 0.21 -2.17 0.07 0.00 -0.02 0.00 0.00 33.50 31.58 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 -0.40 4.65 0.59 2.55 -0.00 -1.26 -4.80 116.67 118.00 2ete s ASP 4 Ca 0.57 2.36 -0.17 0.00 -0.00 0.00 0.00 52.55 55.31 2ete s ASP 4 Cb -0.61 -2.59 -0.03 0.00 -0.00 0.00 0.00 42.92 39.69 2ete s ASP 4 CO 0.61 -1.96 1.09 -2.16 -0.00 0.00 0.00 175.17 172.76 2ete s PRO 5 N -3.68 3.19 -0.01 8.23 0.04 -1.21 -4.98 135.00 136.58 2ete s PRO 5 Ca 0.76 1.37 0.07 0.00 0.04 0.00 0.00 61.00 63.23 2ete s PRO 5 Cb -0.30 -2.00 0.19 0.00 0.04 0.00 0.00 34.50 32.43 2ete s PRO 5 CO 0.40 -0.93 1.15 1.28 0.04 0.00 0.00 177.00 178.94 2ete n LEU 6 N -1.91 2.57 -3.83 -3.56 4.77 -1.26 -5.02 117.00 108.76 2ete n LEU 6 Ca 0.10 -2.05 -0.05 0.00 -0.03 0.00 0.00 56.01 53.98 2ete n LEU 6 Cb 0.52 -0.15 0.01 0.00 -2.33 0.00 0.00 43.42 41.47 2ete n LEU 6 CO 0.46 0.64 0.69 0.00 -1.33 0.00 0.00 177.39 177.84 2ete s GLN 7 N -1.09 1.56 0.05 3.23 0.00 -1.26 -5.09 119.66 117.07 2ete s GLN 7 Ca 0.15 -0.96 -0.26 0.00 -0.00 0.00 0.00 55.36 54.28 2ete s GLN 7 Cb 0.08 0.47 -0.17 0.00 0.00 0.00 0.00 33.01 33.39 2ete s GLN 7 CO 0.09 -0.73 1.54 -0.44 0.00 0.00 0.00 175.29 175.75 2ete h ASP 8 N 2.00 -0.28 -4.75 12.60 3.45 -2.03 -3.46 116.42 123.95 2ete h ASP 8 Ca -0.27 -0.09 -0.28 0.00 0.43 0.00 0.00 57.03 56.82 2ete h ASP 8 Cb 1.23 0.07 -0.21 0.00 -0.56 0.00 0.00 39.33 39.86 2ete h ASP 8 CO 0.33 -0.08 -0.73 -0.36 -1.57 0.00 0.00 179.24 176.82 2ete s PHE 9 N -5.57 0.69 -0.49 4.55 0.40 -1.26 -5.05 117.98 111.25 2ete s PHE 9 Ca -0.15 -0.51 0.06 0.00 -0.60 0.00 0.00 56.93 55.73 2ete s PHE 9 Cb 0.04 -0.41 0.22 0.00 0.51 0.00 0.00 43.02 43.38 2ete s PHE 9 CO 0.62 -0.08 0.85 0.00 0.70 0.00 0.00 175.22 177.31 2ete s VAL 11 N 0.75 2.86 0.17 0.00 1.01 -1.26 -4.46 120.40 119.46 2ete s VAL 11 Ca 0.31 0.45 -0.33 0.00 0.00 0.00 0.00 61.98 62.41 2ete s VAL 11 Cb 0.14 -3.29 -0.13 0.00 0.00 0.00 0.00 36.38 33.10 2ete s VAL 11 CO -0.17 0.01 1.61 0.00 0.00 0.00 0.00 175.10 176.56 2ete n ALA 12 N 4.99 1.69 -2.74 5.51 0.00 -0.61 -0.11 120.51 129.25 2ete n ALA 12 Ca 0.15 0.43 -0.43 0.00 0.00 0.00 0.00 53.44 53.59 2ete n ALA 12 Cb 0.40 -2.39 -0.05 0.00 0.00 0.00 0.00 19.45 17.41 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 0.99 6.27 0.00 0.00 3.68 -0.01 -4.61 116.67 123.00 2ete s ASP 13 Ca 0.78 -0.67 0.19 0.00 2.13 0.00 0.00 52.55 54.98 2ete s ASP 13 Cb -0.64 -2.38 0.53 0.00 -1.45 0.00 0.00 42.92 38.99 2ete s ASP 13 CO 0.37 -1.14 1.43 0.18 0.13 0.00 0.00 175.17 176.14 2ete n LEU 14 N 7.00 2.54 -4.67 -1.34 4.77 -1.26 -4.66 117.00 119.39 2ete n LEU 14 Ca -0.02 -1.17 -0.45 0.00 -0.03 0.00 0.00 56.01 54.34 2ete n LEU 14 Cb 0.46 -0.24 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 2ete n LEU 14 CO 0.60 0.58 1.00 -0.67 -1.33 0.00 0.00 177.39 177.57 2ete n ASP 15 N 0.88 2.69 0.32 -1.43 -0.08 -1.26 -4.87 116.55 112.80 2ete n ASP 15 Ca 0.17 1.14 0.21 0.00 -1.51 0.00 0.00 54.79 54.81 2ete n ASP 15 Cb 0.43 -1.42 1.07 0.00 2.34 0.00 0.00 41.12 43.55 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 4.14 0.00 -0.05 0.27 0.00 -2.03 -2.33 103.07 103.07 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 0.75 0.00 -0.61 0.28 0.00 0.00 0.00 176.54 176.96 2ete n LYS 17 N -3.07 0.51 -1.74 4.80 4.76 -1.26 -4.97 118.16 117.19 2ete n LYS 17 Ca -0.02 -0.38 -0.39 0.00 -2.87 0.00 0.00 58.31 54.64 2ete n LYS 17 Cb 0.13 -1.49 0.03 0.00 -1.84 0.00 0.00 35.03 31.87 2ete n LYS 17 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2ete n ALA 18 N -0.91 1.59 -1.69 7.82 0.00 -0.88 -4.94 120.51 121.50 2ete n ALA 18 Ca 0.07 0.17 -0.41 0.00 0.00 0.00 0.00 53.44 53.27 2ete n ALA 18 Cb 0.37 -2.34 0.01 0.00 0.00 0.00 0.00 19.45 17.49 2ete n ALA 18 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 2ete n VAL 19 N -0.76 2.43 -3.68 0.00 3.14 -1.26 -4.98 118.33 113.22 2ete n VAL 19 Ca 0.09 -0.50 -0.37 0.00 -2.96 0.00 0.00 64.34 60.60 2ete n VAL 19 Cb 0.43 -1.53 -0.06 0.00 -1.06 0.00 0.00 33.84 31.62 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 -0.51 6.55 0.28 6.55 0.15 -1.26 -4.52 113.70 120.95 2ete s SER 20 Ca 0.60 0.65 0.02 0.00 0.70 0.00 0.00 55.95 57.92 2ete s SER 20 Cb -0.53 -2.16 -0.03 0.00 -1.71 0.00 0.00 66.02 61.60 2ete s SER 20 CO 0.59 0.32 0.26 0.68 1.20 0.00 0.00 173.24 176.28 2ete s VAL 21 N -0.76 0.00 -0.09 4.45 -7.23 -1.26 -5.04 120.40 110.47 2ete s VAL 21 Ca 0.18 -1.92 -0.32 0.00 -1.81 0.00 0.00 61.98 58.11 2ete s VAL 21 Cb -0.14 -2.50 -0.10 0.00 0.56 0.00 0.00 36.38 34.20 2ete s VAL 21 CO 0.07 0.00 1.99 -3.20 -0.31 0.00 0.00 175.10 173.65 2ete n ASN 22 N -0.99 3.56 0.00 4.85 5.15 -1.26 -4.32 115.26 122.25 2ete n ASN 22 Ca 0.04 0.79 0.00 0.00 -0.60 0.00 0.00 54.58 54.81 2ete n ASN 22 Cb 0.64 -1.44 0.00 0.00 -0.53 0.00 0.00 39.78 38.44 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 4.83 1.56 3.16 8.20 0.00 -1.26 -4.88 105.19 116.80 2ete n GLY 23 Ca 0.24 -0.62 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.19 1.00 1.61 3.76 -1.26 -5.08 115.29 115.13 2ete s HIS 24 Ca 0.00 0.43 -0.11 0.00 -0.15 0.00 0.00 55.06 55.22 2ete s HIS 24 Cb 0.00 0.07 0.19 0.00 1.11 0.00 0.00 32.58 33.95 2ete s HIS 24 CO 0.00 -0.23 1.09 0.95 -0.85 0.00 0.00 174.74 175.70 2ete s THR 25 N -0.52 2.24 0.09 1.30 -4.23 -1.26 -4.85 115.64 108.41 2ete s THR 25 Ca -0.06 0.08 0.08 0.00 -1.18 0.00 0.00 61.69 60.61 2ete s THR 25 Cb -0.04 -2.25 -0.04 0.00 1.34 0.00 0.00 72.50 71.52 2ete s THR 25 CO 0.02 -0.10 -0.18 0.00 -0.54 0.00 0.00 174.62 173.81 2ete s LYS 27 N -1.86 4.08 0.44 0.00 -0.14 0.85 -4.70 119.74 118.41 2ete s LYS 27 Ca 0.16 2.32 -0.24 0.00 -1.36 0.00 0.00 55.97 56.86 2ete s LYS 27 Cb -0.11 -2.89 -0.09 0.00 -1.68 0.00 0.00 37.83 33.06 2ete s LYS 27 CO 0.08 -0.46 1.18 -2.30 -0.76 0.00 0.00 175.35 173.09 2ete n PRO 28 N 0.37 1.67 0.05 -1.68 -0.02 -1.26 -4.60 135.00 129.53 2ete n PRO 28 Ca 0.02 0.60 0.11 0.00 -2.02 0.00 0.00 63.50 62.21 2ete n PRO 28 Cb 0.42 -2.28 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 1.78 0.23 -0.01 -0.52 2.86 -1.97 -0.51 114.93 116.79 2ete h MET 29 Ca -0.47 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.16 2ete h MET 29 Cb 1.31 -0.05 -0.00 0.00 0.06 0.00 0.00 31.60 32.92 2ete h MET 29 CO 0.58 0.15 0.03 0.66 1.06 0.00 0.00 176.91 179.40 2ete h SER 30 N 0.24 0.00 -0.14 1.22 4.64 -1.98 -2.48 113.55 115.05 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 0.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.42 2ete h SER 30 CO -0.03 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 175.31 2ete n GLU 31 N -3.45 1.45 0.15 4.77 1.02 -0.21 -4.59 120.64 119.77 2ete n GLU 31 Ca -0.03 -1.56 0.03 0.00 -0.02 0.00 0.00 57.16 55.58 2ete n GLU 31 Cb 0.11 -1.28 0.09 0.00 -0.02 0.00 0.00 31.44 30.34 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 2.58 0.72 -0.43 0.62 0.00 -1.30 -3.48 119.26 117.97 2ete h ALA 32 Ca 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2ete h ALA 32 Cb 0.63 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2ete h ALA 32 CO 0.00 0.64 0.00 0.41 0.00 0.00 0.00 179.25 180.30 2ete n GLY 33 N 0.99 -1.67 0.36 0.00 0.00 -1.26 -4.52 105.19 99.09 2ete n GLY 33 Ca 0.01 -1.30 0.06 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 -0.07 1.61 -0.31 1.61 8.00 -1.26 -4.65 116.55 121.47 2ete n ASP 34 Ca 0.00 -1.31 0.03 0.00 0.71 0.00 0.00 54.79 54.23 2ete n ASP 34 Cb 0.00 0.32 0.06 0.00 -0.02 0.00 0.00 41.12 41.48 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 0.11 2.11 0.27 -2.24 8.00 -1.26 -4.74 116.55 118.80 2ete n ASP 35 Ca 0.06 -1.70 0.15 0.00 0.71 0.00 0.00 54.79 54.01 2ete n ASP 35 Cb 0.28 -0.08 0.77 0.00 -0.02 0.00 0.00 41.12 42.07 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 1.17 0.00 -0.02 1.24 -5.15 -1.83 -1.94 116.94 110.42 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 0.48 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.65 2ete h PHE 36 CO 0.08 0.09 0.00 1.28 -2.00 0.00 0.00 178.31 177.76 2ete n LEU 37 N -3.47 0.18 -4.12 2.10 4.77 -1.26 -4.01 117.00 111.20 2ete n LEU 37 Ca -0.01 -0.08 -0.17 0.00 -0.03 0.00 0.00 56.01 55.72 2ete n LEU 37 Cb 0.24 -0.01 -0.12 0.00 -2.33 0.00 0.00 43.42 41.19 2ete n LEU 37 CO 0.28 0.04 -0.44 -0.36 -1.33 0.00 0.00 177.39 175.58 2ete s PHE 38 N -1.97 1.00 0.02 -1.77 0.40 -0.73 -5.09 117.98 109.84 2ete s PHE 38 Ca 0.24 -0.42 -0.06 0.00 -0.60 0.00 0.00 56.93 56.10 2ete s PHE 38 Cb 0.11 -0.58 -0.01 0.00 0.51 0.00 0.00 43.02 43.05 2ete s PHE 38 CO 0.19 0.00 0.10 0.45 0.70 0.00 0.00 175.22 176.66 2ete s SER 39 N -1.42 0.13 -0.01 1.36 0.15 -1.26 -5.03 113.70 107.62 2ete s SER 39 Ca -0.03 -0.42 0.02 0.00 0.70 0.00 0.00 55.95 56.22 2ete s SER 39 Cb -0.09 0.20 0.03 0.00 -1.71 0.00 0.00 66.02 64.45 2ete s SER 39 CO 0.01 -0.44 0.99 -1.54 1.20 0.00 0.00 173.24 173.46 2ete n SER 40 N 1.10 1.91 0.28 5.45 3.41 -1.26 -4.83 113.62 119.68 2ete n SER 40 Ca -0.21 -2.05 0.19 0.00 -0.26 0.00 0.00 58.87 56.54 2ete n SER 40 Cb 0.57 -0.04 0.84 0.00 -0.26 0.00 0.00 64.21 65.31 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 -0.68 4.33 1.57 -1.97 -2.82 116.57 117.01 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 0.58 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.89 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 -3.01 3.80 0.25 2.94 4.77 -1.26 -4.38 117.00 120.11 2ete n LEU 42 Ca -0.00 -1.91 0.13 0.00 -0.03 0.00 0.00 56.01 54.20 2ete n LEU 42 Cb 0.22 -0.48 0.56 0.00 -2.33 0.00 0.00 43.42 41.40 2ete n LEU 42 CO 0.24 0.88 0.89 0.71 -1.33 0.00 0.00 177.39 178.78 2ete h THR 43 N 3.95 0.31 -4.13 -5.08 1.35 -1.89 -3.45 112.91 103.98 2ete h THR 43 Ca 0.00 -0.83 -0.69 0.00 -0.55 0.00 0.00 66.41 64.34 2ete h THR 43 Cb 1.00 1.64 -0.24 0.00 -1.73 0.00 0.00 68.15 68.82 2ete h THR 43 CO 0.04 0.12 -0.82 -0.54 -0.25 0.00 0.00 175.52 174.07 2ete s LYS 44 N -3.68 2.14 0.34 4.72 1.02 -1.26 -5.11 119.74 117.91 2ete s LYS 44 Ca 0.01 -0.93 -0.28 0.00 0.02 0.00 0.00 55.97 54.79 2ete s LYS 44 Cb 0.10 -2.18 -0.10 0.00 -0.52 0.00 0.00 37.83 35.13 2ete s LYS 44 CO 0.59 0.56 1.26 0.00 -0.92 0.00 0.00 175.35 176.85 2ete s ALA 45 N -0.82 3.43 0.71 5.17 0.00 -1.26 -5.03 121.76 123.96 2ete s ALA 45 Ca 0.13 1.18 -0.11 0.00 0.00 0.00 0.00 51.96 53.16 2ete s ALA 45 Cb -0.10 -3.45 0.02 0.00 0.00 0.00 0.00 23.12 19.59 2ete s ALA 45 CO 0.03 -0.58 1.07 0.20 0.00 0.00 0.00 175.76 176.48 2ete s GLY 46 N -0.63 1.65 -0.48 0.00 0.00 -1.26 -5.00 107.32 101.60 2ete s GLY 46 Ca 0.50 -0.07 -0.29 0.00 0.00 0.00 0.00 44.72 44.86 2ete s GLY 46 CO 0.49 0.28 1.13 0.21 0.00 0.00 0.00 173.10 175.21 2ete s ASN 47 N -3.94 6.62 0.00 1.64 3.84 -1.26 -4.87 114.94 116.98 2ete s ASN 47 Ca 0.58 0.44 0.20 0.00 0.21 0.00 0.00 52.86 54.30 2ete s ASN 47 Cb -0.13 -2.55 0.90 0.00 -0.55 0.00 0.00 41.25 38.92 2ete s ASN 47 CO 0.54 -1.25 1.62 0.35 -2.79 0.00 0.00 177.10 175.57 2ete n THR 48 N 6.84 0.12 -1.97 -5.21 -2.24 -1.26 -4.47 114.28 106.08 2ete n THR 48 Ca 0.12 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.27 2ete n THR 48 Cb 0.49 0.11 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 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 -0.12 4.21 -4.20 3.42 7.64 -1.26 -4.06 113.62 119.25 2ete n SER 49 Ca 0.15 -2.88 -0.12 0.00 1.01 0.00 0.00 58.87 57.03 2ete n SER 49 Cb 0.23 -1.66 -0.10 0.00 -1.01 0.00 0.00 64.21 61.67 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 3.12 0.77 0.27 0.44 -4.23 -1.26 -5.01 115.64 109.74 2ete s THR 50 Ca 0.48 -1.97 -0.00 0.00 -1.18 0.00 0.00 61.69 59.02 2ete s THR 50 Cb 0.11 -1.80 0.26 0.00 1.34 0.00 0.00 72.50 72.41 2ete s THR 50 CO -0.05 -0.77 1.72 -0.65 -0.54 0.00 0.00 174.62 174.33 2ete h PRO 51 N 2.88 0.43 -0.15 3.99 0.11 -1.93 -0.81 132.00 136.52 2ete h PRO 51 Ca -0.36 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.64 2ete h PRO 51 Cb 1.18 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 2ete h PRO 51 CO 0.64 0.28 -0.28 -0.91 -0.21 0.00 0.00 178.00 177.53 2ete h ASN 52 N 0.44 0.28 0.00 -2.05 2.35 -1.93 -3.47 115.58 111.20 2ete h ASN 52 Ca 0.49 -0.09 0.00 0.00 -0.55 0.00 0.00 56.30 56.15 2ete h ASN 52 Cb 0.83 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.13 2ete h ASN 52 CO -0.46 0.56 0.00 0.61 -1.65 0.00 0.00 177.43 176.48 2ete n GLY 53 N -0.48 0.44 3.14 2.83 0.00 -0.31 -1.11 105.19 109.71 2ete n GLY 53 Ca -0.01 -0.99 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.90 0.34 -0.03 1.61 1.04 -1.26 -0.93 113.70 111.58 2ete s SER 54 Ca 0.00 -1.13 0.00 0.00 0.48 0.00 0.00 55.95 55.31 2ete s SER 54 Cb 0.00 0.28 0.03 0.00 0.10 0.00 0.00 66.02 66.42 2ete s SER 54 CO 0.00 -0.70 0.01 0.00 0.98 0.00 0.00 173.24 173.53 2ete s ALA 55 N -4.01 0.27 -0.26 5.32 0.00 -0.44 -4.74 121.76 117.90 2ete s ALA 55 Ca 0.19 0.19 -0.11 0.00 0.00 0.00 0.00 51.96 52.23 2ete s ALA 55 Cb 0.07 -0.33 -0.05 0.00 0.00 0.00 0.00 23.12 22.82 2ete s ALA 55 CO -0.02 -0.11 0.17 0.08 0.00 0.00 0.00 175.76 175.88 2ete s VAL 56 N 1.11 5.29 -0.40 0.00 1.01 -1.26 -1.60 120.40 124.54 2ete s VAL 56 Ca -0.09 0.16 -0.11 0.00 0.00 0.00 0.00 61.98 61.94 2ete s VAL 56 Cb -0.13 -3.49 0.05 0.00 0.00 0.00 0.00 36.38 32.80 2ete s VAL 56 CO -0.02 0.30 0.24 -0.89 0.00 0.00 0.00 175.10 174.73 2ete s THR 57 N 1.43 4.55 0.19 3.92 2.01 0.23 -5.00 115.64 122.97 2ete s THR 57 Ca 0.07 -1.02 -0.25 0.00 0.31 0.00 0.00 61.69 60.80 2ete s THR 57 Cb -0.15 -3.63 -0.08 0.00 0.01 0.00 0.00 72.50 68.65 2ete s THR 57 CO 0.08 -0.34 0.79 -1.61 -0.69 0.00 0.00 174.62 172.84 2ete s GLU 58 N 1.53 4.53 -0.39 4.92 2.02 -1.26 -1.67 118.70 128.39 2ete s GLU 58 Ca 0.02 1.14 0.12 0.00 0.02 0.00 0.00 54.97 56.27 2ete s GLU 58 Cb -0.21 -3.16 0.43 0.00 0.10 0.00 0.00 34.13 31.29 2ete s GLU 58 CO 0.06 0.52 0.99 -0.11 0.02 0.00 0.00 175.26 176.73 2ete n LEU 59 N 1.36 2.78 0.00 1.80 7.94 0.01 -4.82 117.00 126.07 2ete n LEU 59 Ca -0.04 -4.52 -0.24 0.00 -1.11 0.00 0.00 56.01 50.10 2ete n LEU 59 Cb 0.49 0.07 0.16 0.00 0.53 0.00 0.00 43.42 44.67 2ete n LEU 59 CO 0.46 1.93 0.70 -0.90 -1.11 0.00 0.00 177.39 178.46 2ete n ASP 60 N -0.19 0.22 0.08 1.96 3.85 -1.24 -2.39 116.55 118.83 2ete n ASP 60 Ca 0.23 -1.47 0.12 0.00 -0.71 0.00 0.00 54.79 52.96 2ete n ASP 60 Cb 0.72 -0.80 0.60 0.00 -1.35 0.00 0.00 41.12 40.28 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 -1.50 0.91 -0.11 2.12 3.04 -1.45 0.15 116.25 119.41 2ete h VAL 61 Ca -0.35 -0.05 -0.04 0.00 -1.01 0.00 0.00 66.70 65.26 2ete h VAL 61 Cb 0.99 0.75 -0.01 0.00 -2.01 0.00 0.00 31.29 31.00 2ete h VAL 61 CO 0.26 0.03 -0.10 0.00 -1.01 0.00 0.00 177.57 176.74 2ete h ALA 62 N 1.83 1.63 0.00 3.17 0.00 -1.93 -2.43 119.26 121.52 2ete h ALA 62 Ca 0.15 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ete h ALA 62 Cb 0.42 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.14 2ete h ALA 62 CO -0.02 0.28 -1.99 0.39 0.00 0.00 0.00 179.25 177.90 2ete n GLU 63 N -4.33 0.65 -3.40 0.00 -0.58 -0.27 -4.69 120.64 108.02 2ete n GLU 63 Ca -0.01 -0.20 -0.26 0.00 -0.42 0.00 0.00 57.16 56.27 2ete n GLU 63 Cb 0.23 -1.51 -0.09 0.00 -0.57 0.00 0.00 31.44 29.49 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 -2.25 -0.11 0.32 -0.32 -0.00 0.35 -4.95 117.44 110.48 2ete n TRP 64 Ca -0.04 -3.52 0.21 0.00 -0.00 0.00 0.00 57.50 54.15 2ete n TRP 64 Cb 0.57 -0.03 1.11 0.00 -0.00 0.00 0.00 31.31 32.97 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 5.12 0.00 0.00 5.87 0.13 -1.69 -1.72 132.00 139.71 2ete h PRO 65 Ca 0.20 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.33 2ete h PRO 65 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 2ete h PRO 65 CO 0.45 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 179.00 2ete h GLY 66 N 0.23 0.00 2.00 1.56 0.00 -1.86 -1.46 103.07 103.54 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 -2.79 0.39 -1.64 4.70 -2.24 -0.65 -4.82 114.28 107.24 2ete n THR 67 Ca -0.01 0.01 -0.49 0.00 -2.27 0.00 0.00 64.05 61.29 2ete n THR 67 Cb 0.14 -0.67 -0.05 0.00 -2.10 0.00 0.00 70.33 67.65 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 -1.72 2.48 0.00 3.42 5.15 -0.82 -1.00 115.26 122.78 2ete n ASN 68 Ca 0.06 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 55.13 2ete n ASN 68 Cb 0.31 -1.33 0.00 0.00 -0.53 0.00 0.00 39.78 38.24 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 3.05 0.00 0.82 -0.44 -2.24 -1.26 -4.40 114.28 109.81 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 0.25 -0.01 0.25 0.00 -2.10 0.00 0.00 70.33 68.72 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 0.54 0.00 3.22 4.77 -0.17 -3.34 117.00 122.02 2ete n LEU 70 Ca 0.00 0.14 0.00 0.00 -0.03 0.00 0.00 56.01 56.12 2ete n LEU 70 Cb 0.00 -0.25 0.00 0.00 -2.33 0.00 0.00 43.42 40.84 2ete n LEU 70 CO 0.00 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.71 2ete n GLY 71 N 1.43 0.42 3.16 -0.72 0.00 -1.26 -4.98 105.19 103.24 2ete n GLY 71 Ca 0.05 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.00 0.15 0.29 1.61 -7.23 -1.26 -2.63 120.40 109.33 2ete s VAL 72 Ca 0.00 -1.24 -0.20 0.00 -1.81 0.00 0.00 61.98 58.74 2ete s VAL 72 Cb 0.00 -1.21 0.05 0.00 0.56 0.00 0.00 36.38 35.77 2ete s VAL 72 CO 0.00 -0.68 0.83 -0.94 -0.31 0.00 0.00 175.10 173.99 2ete s SER 73 N -2.60 -0.10 0.09 4.85 1.04 -1.02 -3.70 113.70 112.27 2ete s SER 73 Ca 0.02 -0.81 -0.01 0.00 0.48 0.00 0.00 55.95 55.63 2ete s SER 73 Cb 0.03 0.72 -0.04 0.00 0.10 0.00 0.00 66.02 66.83 2ete s SER 73 CO -0.08 -1.38 0.01 -0.04 0.98 0.00 0.00 173.24 172.72 2ete s MET 74 N -2.92 0.78 0.23 4.02 -1.94 -1.01 -1.25 119.30 117.20 2ete s MET 74 Ca 0.15 -1.33 -0.11 0.00 -1.71 0.00 0.00 55.69 52.68 2ete s MET 74 Cb -0.05 0.18 -0.01 0.00 2.01 0.00 0.00 34.83 36.97 2ete s MET 74 CO 0.08 -0.17 0.42 0.54 -0.01 0.00 0.00 175.02 175.88 2ete s ASN 75 N -2.99 -0.06 -0.02 3.03 6.03 -0.43 -0.81 114.94 119.69 2ete s ASN 75 Ca 0.15 -0.93 0.05 0.00 -1.03 0.00 0.00 52.86 51.10 2ete s ASN 75 Cb 0.08 0.54 -0.03 0.00 -3.03 0.00 0.00 41.25 38.81 2ete s ASN 75 CO -0.04 -1.07 -0.17 -0.60 -2.03 0.00 0.00 177.10 173.19 2ete s ARG 76 N -4.01 2.32 -0.08 3.55 3.52 -0.67 -1.06 118.95 122.52 2ete s ARG 76 Ca 0.22 -0.81 0.01 0.00 -0.13 0.00 0.00 55.73 55.02 2ete s ARG 76 Cb 0.01 -2.28 0.02 0.00 -1.56 0.00 0.00 34.95 31.14 2ete s ARG 76 CO 0.07 0.59 -0.08 0.08 -0.81 0.00 0.00 175.30 175.15 2ete s VAL 77 N -0.79 0.93 0.03 7.11 1.01 -0.60 -0.60 120.40 127.48 2ete s VAL 77 Ca 0.12 -0.29 0.01 0.00 0.00 0.00 0.00 61.98 61.83 2ete s VAL 77 Cb -0.11 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.31 2ete s VAL 77 CO 0.02 0.33 0.07 -1.81 0.00 0.00 0.00 175.10 173.71 2ete s ASP 78 N 1.27 5.54 -0.06 3.32 1.01 -0.63 -1.34 116.67 125.80 2ete s ASP 78 Ca -0.04 0.07 0.01 0.00 0.71 0.00 0.00 52.55 53.30 2ete s ASP 78 Cb -0.14 -1.54 0.02 0.00 1.01 0.00 0.00 42.92 42.28 2ete s ASP 78 CO -0.03 0.24 -0.07 -0.36 0.21 0.00 0.00 175.17 175.16 2ete s PHE 79 N -1.25 1.01 0.66 4.23 0.08 0.71 -1.33 117.98 122.09 2ete s PHE 79 Ca 0.25 -0.34 -0.15 0.00 0.12 0.00 0.00 56.93 56.81 2ete s PHE 79 Cb -0.12 -0.83 0.00 0.00 -0.57 0.00 0.00 43.02 41.50 2ete s PHE 79 CO 0.16 -0.24 1.11 0.00 -0.10 0.00 0.00 175.22 176.15 2ete s ALA 80 N 0.93 2.47 0.14 5.36 0.00 -0.10 -1.72 121.76 128.84 2ete s ALA 80 Ca -0.11 0.52 -0.34 0.00 0.00 0.00 0.00 51.96 52.02 2ete s ALA 80 Cb -0.15 -3.31 -0.15 0.00 0.00 0.00 0.00 23.12 19.52 2ete s ALA 80 CO 0.01 -1.29 1.43 -2.30 0.00 0.00 0.00 175.76 173.61 2ete n PRO 81 N -2.48 1.67 -0.94 0.00 -0.02 -1.26 -0.43 135.00 131.54 2ete n PRO 81 Ca 0.10 0.60 0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2ete n PRO 81 Cb 0.52 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 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 2.79 0.64 3.82 -1.23 0.00 -0.75 -5.02 105.19 105.45 2ete n GLY 82 Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 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 2.28 0.03 -0.02 0.00 0.43 -4.76 107.32 103.27 2ete s GLY 83 Ca 0.00 0.38 0.06 0.00 0.00 0.00 0.00 44.72 45.16 2ete s GLY 83 CO 0.00 0.67 -0.19 -1.08 0.00 0.00 0.00 173.10 172.50 2ete s THR 84 N -2.31 1.52 -0.53 0.90 -1.32 -0.27 -0.92 115.64 112.71 2ete s THR 84 Ca 0.62 -1.04 -0.16 0.00 -1.21 0.00 0.00 61.69 59.90 2ete s THR 84 Cb -0.12 -1.31 0.11 0.00 -1.51 0.00 0.00 72.50 69.68 2ete s THR 84 CO 0.23 0.24 0.52 0.21 -2.21 0.00 0.00 174.62 173.61 2ete s ASN 85 N -0.95 6.18 0.84 8.08 2.47 -0.44 -4.06 114.94 127.06 2ete s ASN 85 Ca 0.06 -1.60 -0.11 0.00 0.42 0.00 0.00 52.86 51.63 2ete s ASN 85 Cb -0.08 -2.22 0.09 0.00 -1.45 0.00 0.00 41.25 37.59 2ete s ASN 85 CO 0.01 -0.86 1.10 -2.16 -3.72 0.00 0.00 177.10 171.47 2ete s PRO 86 N 1.83 1.73 -0.19 0.43 0.04 -1.26 -1.87 135.00 135.71 2ete s PRO 86 Ca 0.05 1.12 -0.42 0.00 0.04 0.00 0.00 61.00 61.79 2ete s PRO 86 Cb -0.27 -1.84 -0.19 0.00 0.04 0.00 0.00 34.50 32.24 2ete s PRO 86 CO 0.05 -2.00 1.37 -2.30 0.04 0.00 0.00 177.00 174.16 2ete n PRO 87 N -3.76 0.31 -3.90 0.56 -0.02 -1.25 -4.70 135.00 122.25 2ete n PRO 87 Ca 0.09 0.11 -0.09 0.00 -2.02 0.00 0.00 63.50 61.59 2ete n PRO 87 Cb 0.53 -1.66 -0.05 0.00 -0.02 0.00 0.00 33.50 32.31 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 1.53 0.17 0.01 6.00 -3.43 0.02 -1.11 115.29 118.48 2ete s HIS 88 Ca 0.96 -0.53 0.03 0.00 -0.80 0.00 0.00 55.06 54.71 2ete s HIS 88 Cb -1.28 0.26 -0.01 0.00 -1.43 0.00 0.00 32.58 30.13 2ete s HIS 88 CO 0.65 -0.95 -0.09 0.42 -2.00 0.00 0.00 174.74 172.77 2ete s ILE 89 N -3.96 0.67 -0.40 -5.38 1.09 -0.30 -1.65 121.20 111.26 2ete s ILE 89 Ca 0.17 -0.52 -0.13 0.00 -1.10 0.00 0.00 60.65 59.07 2ete s ILE 89 Cb -0.01 -0.59 0.03 0.00 -1.06 0.00 0.00 42.46 40.83 2ete s ILE 89 CO 0.04 0.08 0.26 -1.00 -0.10 0.00 0.00 174.94 174.22 2ete s HIS 90 N -0.42 3.25 0.44 3.97 3.76 -1.26 -0.45 115.29 124.57 2ete s HIS 90 Ca 0.01 -0.82 0.34 0.00 -0.15 0.00 0.00 55.06 54.44 2ete s HIS 90 Cb -0.05 -2.57 1.76 0.00 1.11 0.00 0.00 32.58 32.83 2ete s HIS 90 CO -0.00 -0.64 2.16 -1.00 -0.85 0.00 0.00 174.74 174.41 2ete h PRO 91 N 8.54 0.00 0.00 8.40 0.13 -1.71 -2.14 132.00 145.22 2ete h PRO 91 Ca -0.26 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.85 2ete h PRO 91 Cb 1.11 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.19 2ete h PRO 91 CO 0.71 0.05 -0.39 0.54 -0.23 0.00 0.00 178.00 178.68 2ete n ARG 92 N -3.39 0.62 -3.56 0.86 1.74 -0.93 -4.67 116.66 107.32 2ete n ARG 92 Ca -0.02 -1.93 -0.15 0.00 -0.77 0.00 0.00 57.85 54.99 2ete n ARG 92 Cb 0.19 -0.90 -0.06 0.00 -1.02 0.00 0.00 32.46 30.66 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 -1.35 -1.82 0.31 7.54 0.00 -1.25 -4.64 121.76 120.56 2ete s ALA 93 Ca 0.20 1.56 -0.27 0.00 0.00 0.00 0.00 51.96 53.45 2ete s ALA 93 Cb 0.19 -0.49 -0.10 0.00 0.00 0.00 0.00 23.12 22.72 2ete s ALA 93 CO -0.02 -0.34 0.97 0.99 0.00 0.00 0.00 175.76 177.36 2ete s THR 94 N -0.74 4.05 -0.07 0.00 2.01 -1.26 -3.84 115.64 115.81 2ete s THR 94 Ca -0.06 1.79 0.02 0.00 0.31 0.00 0.00 61.69 63.75 2ete s THR 94 Cb -0.02 -4.03 -0.03 0.00 0.01 0.00 0.00 72.50 68.44 2ete s THR 94 CO 0.05 0.22 -0.10 -0.70 -0.69 0.00 0.00 174.62 173.40 2ete s GLU 95 N -1.87 2.70 -0.06 4.92 2.12 -0.53 -2.54 118.70 123.44 2ete s GLU 95 Ca 0.49 -0.61 -0.00 0.00 0.36 0.00 0.00 54.97 55.21 2ete s GLU 95 Cb -0.22 -2.52 0.02 0.00 0.26 0.00 0.00 34.13 31.68 2ete s GLU 95 CO 0.28 0.62 -0.02 -1.50 -0.54 0.00 0.00 175.26 174.10 2ete s ILE 96 N -0.71 0.46 0.09 -3.70 2.07 -0.06 -0.46 121.20 118.90 2ete s ILE 96 Ca 0.11 -0.01 0.00 0.00 -1.41 0.00 0.00 60.65 59.34 2ete s ILE 96 Cb -0.11 -0.55 -0.04 0.00 0.13 0.00 0.00 42.46 41.89 2ete s ILE 96 CO 0.01 0.24 -0.02 -0.83 -1.91 0.00 0.00 174.94 172.43 2ete s GLY 97 N 1.42 0.73 -0.04 1.50 0.00 -0.28 -0.56 107.32 110.09 2ete s GLY 97 Ca -0.03 -1.34 0.02 0.00 0.00 0.00 0.00 44.72 43.37 2ete s GLY 97 CO -0.03 -1.39 -0.10 -0.29 0.00 0.00 0.00 173.10 171.29 2ete s MET 98 N -3.91 1.25 0.01 2.90 1.75 -0.67 -1.59 119.30 119.04 2ete s MET 98 Ca 0.13 -0.32 -0.30 0.00 -1.25 0.00 0.00 55.69 53.95 2ete s MET 98 Cb 0.07 -1.11 -0.04 0.00 2.84 0.00 0.00 34.83 36.59 2ete s MET 98 CO -0.05 0.05 1.06 0.08 -0.65 0.00 0.00 175.02 175.51 2ete s VAL 99 N 0.49 4.58 -0.19 10.11 1.01 -0.77 -1.60 120.40 134.03 2ete s VAL 99 Ca -0.09 1.85 0.17 0.00 0.00 0.00 0.00 61.98 63.91 2ete s VAL 99 Cb -0.13 -4.19 -0.24 0.00 0.00 0.00 0.00 36.38 31.82 2ete s VAL 99 CO 0.02 0.14 0.12 0.23 0.00 0.00 0.00 175.10 175.60 2ete n MET 100 N 3.98 0.68 -3.70 2.72 2.81 -0.13 -0.56 117.12 122.93 2ete n MET 100 Ca 0.07 0.03 -0.14 0.00 -1.81 0.00 0.00 57.70 55.85 2ete n MET 100 Cb 0.49 -1.55 -0.09 0.00 -0.71 0.00 0.00 33.22 31.37 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 -2.50 0.62 0.79 0.03 2.20 -1.11 -4.65 119.74 115.12 2ete s LYS 101 Ca -0.11 0.55 0.00 0.00 -0.36 0.00 0.00 55.97 56.05 2ete s LYS 101 Cb 0.06 0.30 0.00 0.00 -1.51 0.00 0.00 37.83 36.68 2ete s LYS 101 CO 0.82 -0.10 0.00 0.41 -0.36 0.00 0.00 175.35 176.12 2ete n GLY 102 N 2.50 -1.80 2.84 5.54 0.00 -1.26 -1.95 105.19 111.06 2ete n GLY 102 Ca -0.15 -1.68 -0.29 0.00 0.00 0.00 0.00 46.02 43.90 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 1.15 -0.18 1.61 2.02 -1.26 -3.88 118.70 118.16 2ete s GLU 103 Ca 0.00 -0.65 0.00 0.00 0.02 0.00 0.00 54.97 54.34 2ete s GLU 103 Cb 0.00 -2.27 0.01 0.00 0.10 0.00 0.00 34.13 31.97 2ete s GLU 103 CO 0.00 -0.59 -0.16 -0.51 0.02 0.00 0.00 175.26 174.02 2ete s LEU 104 N 1.64 2.35 -0.06 1.80 1.43 -0.56 -1.92 118.68 123.36 2ete s LEU 104 Ca -0.03 -0.55 -0.30 0.00 -1.03 0.00 0.00 54.13 52.22 2ete s LEU 104 Cb -0.17 -1.54 -0.05 0.00 0.03 0.00 0.00 46.19 44.46 2ete s LEU 104 CO -0.07 0.03 1.44 -0.22 0.23 0.00 0.00 176.35 177.76 2ete s LEU 105 N 1.14 4.29 -0.16 1.79 2.96 0.30 0.18 118.68 129.17 2ete s LEU 105 Ca 0.01 2.05 0.01 0.00 -0.22 0.00 0.00 54.13 55.97 2ete s LEU 105 Cb -0.14 -3.55 0.01 0.00 0.50 0.00 0.00 46.19 43.01 2ete s LEU 105 CO -0.07 -0.79 -0.17 -0.69 -1.32 0.00 0.00 176.35 173.32 2ete s VAL 106 N 3.13 2.46 -0.06 1.68 1.01 -0.60 -0.82 120.40 127.20 2ete s VAL 106 Ca 0.64 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.85 2ete s VAL 106 Cb -0.30 -2.03 -0.01 0.00 0.00 0.00 0.00 36.38 34.04 2ete s VAL 106 CO 0.24 0.52 -0.24 -0.83 0.00 0.00 0.00 175.10 174.79 2ete s GLY 107 N 0.99 1.32 -0.07 4.51 0.00 -0.58 -2.54 107.32 110.96 2ete s GLY 107 Ca -0.02 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.68 2ete s GLY 107 CO -0.04 -0.62 -0.11 -0.42 0.00 0.00 0.00 173.10 171.91 2ete s ILE 108 N -0.14 1.08 -0.19 0.90 1.01 0.99 -1.56 121.20 123.28 2ete s ILE 108 Ca -0.04 -0.43 -0.03 0.00 0.00 0.00 0.00 60.65 60.15 2ete s ILE 108 Cb -0.14 -1.00 -0.01 0.00 0.01 0.00 0.00 42.46 41.32 2ete s ILE 108 CO 0.04 0.34 -0.06 -0.76 0.00 0.00 0.00 174.94 174.50 2ete s LEU 109 N 0.76 2.92 0.83 2.97 1.43 -0.39 -0.57 118.68 126.64 2ete s LEU 109 Ca -0.13 -0.33 -0.11 0.00 -1.03 0.00 0.00 54.13 52.54 2ete s LEU 109 Cb -0.15 -1.72 0.09 0.00 0.03 0.00 0.00 46.19 44.44 2ete s LEU 109 CO 0.02 0.06 1.10 -0.83 0.23 0.00 0.00 176.35 176.94 2ete s GLY 110 N 1.02 1.67 0.54 -3.19 0.00 -0.06 -4.11 107.32 103.19 2ete s GLY 110 Ca 0.00 0.31 -0.09 0.00 0.00 0.00 0.00 44.72 44.94 2ete s GLY 110 CO -0.00 0.69 0.62 -1.14 0.00 0.00 0.00 173.10 173.27 2ete n SER 111 N -3.77 -0.59 -0.30 1.64 3.41 -1.26 -3.97 113.62 108.77 2ete n SER 111 Ca 0.09 -1.08 -0.00 0.00 -0.26 0.00 0.00 58.87 57.63 2ete n SER 111 Cb 0.53 -0.51 0.13 0.00 -0.26 0.00 0.00 64.21 64.10 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 0.82 -2.21 1.04 5.85 -1.97 -0.82 115.31 118.02 2ete h LEU 112 Ca -0.21 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.51 2ete h LEU 112 Cb 0.61 -0.16 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 2ete h LEU 112 CO 0.14 0.54 -0.03 0.44 -0.34 0.00 0.00 178.44 179.19 2ete h ASP 113 N 0.96 0.00 -0.59 1.25 5.19 -2.04 -0.42 116.42 120.77 2ete h ASP 113 Ca 0.36 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.77 2ete h ASP 113 Cb 0.13 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.64 2ete h ASP 113 CO -0.16 0.03 0.00 -1.20 -3.12 0.00 0.00 179.24 174.79 2ete n SER 114 N -3.22 4.31 -1.43 6.45 7.64 -0.44 -4.93 113.62 121.99 2ete n SER 114 Ca -0.01 -2.39 -0.15 0.00 1.01 0.00 0.00 58.87 57.33 2ete n SER 114 Cb 0.19 -0.55 -0.04 0.00 -1.01 0.00 0.00 64.21 62.81 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 1.08 0.69 4.07 0.23 0.00 -0.17 -2.78 105.19 108.31 2ete n GLY 115 Ca 0.23 -0.28 -0.34 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.66 -3.62 -4.76 1.61 3.02 -0.48 -4.90 115.26 105.47 2ete n ASN 116 Ca -0.17 -0.89 -0.41 0.00 -0.03 0.00 0.00 54.58 53.08 2ete n ASN 116 Cb 0.56 -2.95 -0.03 0.00 -0.61 0.00 0.00 39.78 36.75 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 -6.77 4.42 -0.33 3.52 2.20 -1.12 -4.65 119.74 117.02 2ete s LYS 117 Ca 0.70 2.09 -0.13 0.00 -0.36 0.00 0.00 55.97 58.27 2ete s LYS 117 Cb -0.37 -3.13 -0.02 0.00 -1.51 0.00 0.00 37.83 32.79 2ete s LYS 117 CO 0.86 -0.13 0.23 -1.17 -0.36 0.00 0.00 175.35 174.78 2ete s LEU 118 N -1.17 4.42 -0.25 5.43 2.96 -1.26 -0.88 118.68 127.94 2ete s LEU 118 Ca 0.51 -0.33 -0.10 0.00 -0.22 0.00 0.00 54.13 53.98 2ete s LEU 118 Cb -0.37 -2.14 -0.05 0.00 0.50 0.00 0.00 46.19 44.13 2ete s LEU 118 CO 0.46 -0.20 0.16 -0.31 -1.32 0.00 0.00 176.35 175.14 2ete s TYR 119 N 1.73 3.28 0.02 5.38 1.51 0.26 -4.96 117.35 124.58 2ete s TYR 119 Ca 0.06 0.17 -0.16 0.00 -1.01 0.00 0.00 57.07 56.13 2ete s TYR 119 Cb -0.17 -2.28 0.03 0.00 -0.11 0.00 0.00 41.96 39.42 2ete s TYR 119 CO 0.11 0.00 0.35 -1.54 -1.11 0.00 0.00 175.55 173.36 2ete s SER 120 N 1.20 -0.21 0.16 2.29 1.04 -1.26 -0.01 113.70 116.91 2ete s SER 120 Ca 0.07 -0.01 -0.23 0.00 0.48 0.00 0.00 55.95 56.26 2ete s SER 120 Cb -0.14 0.36 0.06 0.00 0.10 0.00 0.00 66.02 66.41 2ete s SER 120 CO 0.06 -0.57 0.69 0.00 0.98 0.00 0.00 173.24 174.40 2ete s ARG 121 N -2.04 1.32 -0.28 4.02 1.70 -1.05 -5.01 118.95 117.61 2ete s ARG 121 Ca -0.08 -0.57 -0.25 0.00 -0.47 0.00 0.00 55.73 54.36 2ete s ARG 121 Cb -0.02 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 34.91 2ete s ARG 121 CO 0.00 -0.59 0.85 0.08 -1.08 0.00 0.00 175.30 174.56 2ete s VAL 122 N -3.67 4.77 -0.19 4.99 1.01 -1.26 -1.56 120.40 124.49 2ete s VAL 122 Ca 0.04 1.45 -0.07 0.00 0.00 0.00 0.00 61.98 63.40 2ete s VAL 122 Cb -0.02 -4.17 -0.04 0.00 0.00 0.00 0.00 36.38 32.15 2ete s VAL 122 CO -0.07 -0.20 0.06 -0.69 0.00 0.00 0.00 175.10 174.20 2ete s VAL 123 N 3.00 4.63 0.34 2.92 1.01 0.13 -4.90 120.40 127.53 2ete s VAL 123 Ca 0.35 -0.09 0.01 0.00 0.00 0.00 0.00 61.98 62.26 2ete s VAL 123 Cb -0.14 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.15 2ete s VAL 123 CO 0.10 0.44 0.12 0.54 0.00 0.00 0.00 175.10 176.30 2ete n ARG 124 N 3.79 1.09 -1.65 2.72 1.74 -1.26 -1.50 116.66 121.58 2ete n ARG 124 Ca -0.16 -2.34 -0.50 0.00 -0.77 0.00 0.00 57.85 54.08 2ete n ARG 124 Cb 0.52 0.47 -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 -2.08 0.38 -0.07 7.54 0.00 -1.25 -1.30 120.51 123.73 2ete n ALA 125 Ca -0.13 0.43 0.00 0.00 0.00 0.00 0.00 53.44 53.75 2ete n ALA 125 Cb 0.41 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.59 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 3.39 2.21 3.89 0.00 0.00 0.28 -5.00 105.19 109.96 2ete n GLY 126 Ca 0.19 0.00 -0.29 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 -0.22 3.68 0.19 1.61 2.02 -0.42 -4.90 118.70 120.66 2ete s GLU 127 Ca 0.00 0.18 0.06 0.00 0.02 0.00 0.00 54.97 55.23 2ete s GLU 127 Cb 0.00 -2.53 -0.05 0.00 0.10 0.00 0.00 34.13 31.65 2ete s GLU 127 CO 0.00 0.09 -0.10 0.95 0.02 0.00 0.00 175.26 176.22 2ete s THR 128 N -2.24 1.42 0.05 3.63 -4.23 -1.26 -1.85 115.64 111.17 2ete s THR 128 Ca 0.47 -2.13 -0.07 0.00 -1.18 0.00 0.00 61.69 58.78 2ete s THR 128 Cb -0.10 -2.04 -0.01 0.00 1.34 0.00 0.00 72.50 71.69 2ete s THR 128 CO 0.31 -0.60 0.14 0.72 -0.54 0.00 0.00 174.62 174.65 2ete s PHE 129 N -3.17 0.17 -0.03 3.99 -0.12 -0.62 -5.00 117.98 113.20 2ete s PHE 129 Ca 0.21 -0.50 0.02 0.00 -0.05 0.00 0.00 56.93 56.62 2ete s PHE 129 Cb 0.02 -0.11 0.01 0.00 -0.63 0.00 0.00 43.02 42.30 2ete s PHE 129 CO 0.05 -0.43 -0.08 0.54 -0.05 0.00 0.00 175.22 175.25 2ete s VAL 130 N -3.00 0.74 -0.26 -2.49 0.11 -1.26 -1.12 120.40 113.11 2ete s VAL 130 Ca -0.02 -0.33 0.02 0.00 -2.93 0.00 0.00 61.98 58.73 2ete s VAL 130 Cb 0.01 -0.67 0.06 0.00 -1.53 0.00 0.00 36.38 34.26 2ete s VAL 130 CO -0.06 0.24 -0.07 -0.63 -3.33 0.00 0.00 175.10 171.24 2ete s ILE 131 N 0.26 1.92 0.44 7.04 -1.09 0.39 -5.01 121.20 125.16 2ete s ILE 131 Ca -0.04 -1.55 -0.24 0.00 -2.23 0.00 0.00 60.65 56.59 2ete s ILE 131 Cb -0.09 -2.13 -0.09 0.00 -1.58 0.00 0.00 42.46 38.57 2ete s ILE 131 CO 0.00 -0.12 1.16 -2.65 -1.23 0.00 0.00 174.94 172.11 2ete n PRO 132 N 4.51 1.63 -1.55 2.79 -0.02 -1.26 -1.45 135.00 139.64 2ete n PRO 132 Ca -0.11 0.58 -0.54 0.00 -2.02 0.00 0.00 63.50 61.41 2ete n PRO 132 Cb 0.43 -2.26 -0.07 0.00 -0.02 0.00 0.00 33.50 31.58 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 -0.09 0.67 -0.76 -0.52 0.63 -1.25 -2.61 116.66 112.73 2ete n ARG 133 Ca 0.08 0.24 0.00 0.00 -0.92 0.00 0.00 57.85 57.25 2ete n ARG 133 Cb 0.40 -1.80 0.00 0.00 0.45 0.00 0.00 32.46 31.52 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 2.06 1.45 3.85 5.14 0.00 -0.80 -4.96 105.19 111.92 2ete n GLY 134 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 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 4.39 0.33 0.99 1.43 -1.07 -4.83 118.68 119.92 2ete s LEU 135 Ca 0.00 0.96 -0.29 0.00 -1.03 0.00 0.00 54.13 53.77 2ete s LEU 135 Cb 0.00 -2.96 -0.10 0.00 0.03 0.00 0.00 46.19 43.16 2ete s LEU 135 CO 0.00 0.20 1.30 -0.32 0.23 0.00 0.00 176.35 177.76 2ete s MET 136 N -1.64 4.36 0.20 1.70 -2.45 -1.26 -4.56 119.30 115.65 2ete s MET 136 Ca 0.32 2.20 -0.22 0.00 -1.25 0.00 0.00 55.69 56.73 2ete s MET 136 Cb -0.15 -3.07 0.05 0.00 1.25 0.00 0.00 34.83 32.91 2ete s MET 136 CO 0.17 -0.17 0.63 -3.38 1.05 0.00 0.00 175.02 173.32 2ete s HIS 137 N -1.14 -0.41 0.18 4.11 -3.43 -0.66 -1.26 115.29 112.67 2ete s HIS 137 Ca 0.49 0.12 -0.16 0.00 -0.80 0.00 0.00 55.06 54.71 2ete s HIS 137 Cb -0.39 0.60 0.02 0.00 -1.43 0.00 0.00 32.58 31.38 2ete s HIS 137 CO 0.52 -0.97 0.47 -0.59 -2.00 0.00 0.00 174.74 172.17 2ete s PHE 138 N -3.81 -0.05 0.06 0.38 -0.12 -0.60 -0.80 117.98 113.04 2ete s PHE 138 Ca 0.04 -0.29 0.04 0.00 -0.05 0.00 0.00 56.93 56.67 2ete s PHE 138 Cb -0.03 0.31 -0.03 0.00 -0.63 0.00 0.00 43.02 42.65 2ete s PHE 138 CO -0.06 -0.86 -0.12 -0.65 -0.05 0.00 0.00 175.22 173.47 2ete s GLN 139 N -3.88 0.75 -0.09 1.99 1.11 -0.78 -1.53 119.66 117.22 2ete s GLN 139 Ca 0.10 -0.88 -0.04 0.00 0.01 0.00 0.00 55.36 54.55 2ete s GLN 139 Cb -0.00 -0.69 0.04 0.00 -1.01 0.00 0.00 33.01 31.35 2ete s GLN 139 CO -0.03 0.15 0.20 0.12 0.01 0.00 0.00 175.29 175.74 2ete s PHE 140 N -1.25 -0.26 -0.62 0.91 5.36 0.00 -1.33 117.98 120.80 2ete s PHE 140 Ca -0.04 0.67 -0.28 0.00 -0.96 0.00 0.00 56.93 56.32 2ete s PHE 140 Cb -0.10 -0.04 0.03 0.00 -0.34 0.00 0.00 43.02 42.58 2ete s PHE 140 CO 0.02 -0.22 1.20 1.21 -1.46 0.00 0.00 175.22 175.96 2ete s ASN 141 N 1.41 6.37 0.00 6.13 3.84 -0.09 -0.54 114.94 132.06 2ete s ASN 141 Ca -0.07 -0.07 0.26 0.00 0.21 0.00 0.00 52.86 53.20 2ete s ASN 141 Cb -0.11 -2.55 0.74 0.00 -0.55 0.00 0.00 41.25 38.78 2ete s ASN 141 CO -0.07 -1.56 1.56 1.33 -2.79 0.00 0.00 177.10 175.57 2ete n VAL 142 N 6.57 0.00 -2.44 -5.21 0.24 -0.81 -1.82 118.33 114.86 2ete n VAL 142 Ca 0.07 -0.22 -0.25 0.00 -2.04 0.00 0.00 64.34 61.90 2ete n VAL 142 Cb 0.49 0.62 0.11 0.00 -1.47 0.00 0.00 33.84 33.59 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 -2.27 1.76 0.01 7.63 0.00 -1.22 -4.97 107.32 108.26 2ete s GLY 143 Ca 0.29 -1.52 0.23 0.00 0.00 0.00 0.00 44.72 43.72 2ete s GLY 143 CO 0.44 -0.96 1.16 0.28 0.00 0.00 0.00 173.10 174.01 2ete n LYS 144 N -2.95 0.05 -3.89 2.90 5.02 -1.26 -4.38 118.16 113.65 2ete n LYS 144 Ca 0.14 -0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.20 2ete n LYS 144 Cb 0.60 -1.52 -0.05 0.00 -0.02 0.00 0.00 35.03 34.05 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 3.07 0.33 -0.18 -4.23 -1.26 -4.79 115.64 105.55 2ete s THR 145 Ca 0.09 -1.51 -0.29 0.00 -1.18 0.00 0.00 61.69 58.80 2ete s THR 145 Cb 0.16 -3.06 -0.10 0.00 1.34 0.00 0.00 72.50 70.84 2ete s THR 145 CO 0.78 -0.13 1.36 -0.70 -0.54 0.00 0.00 174.62 175.39 2ete s GLU 146 N -3.96 4.29 0.21 3.99 2.12 -1.26 -4.21 118.70 119.89 2ete s GLU 146 Ca 0.41 2.30 0.11 0.00 0.36 0.00 0.00 54.97 58.15 2ete s GLU 146 Cb -0.03 -3.05 -0.05 0.00 0.26 0.00 0.00 34.13 31.26 2ete s GLU 146 CO 0.25 -0.29 -0.21 0.00 -0.54 0.00 0.00 175.26 174.47 2ete s ALA 147 N -1.02 2.45 0.05 6.30 0.00 -0.70 -4.49 121.76 124.35 2ete s ALA 147 Ca 0.51 -1.68 -0.13 0.00 0.00 0.00 0.00 51.96 50.66 2ete s ALA 147 Cb -0.41 -0.26 0.02 0.00 0.00 0.00 0.00 23.12 22.46 2ete s ALA 147 CO 0.54 0.32 0.29 1.52 0.00 0.00 0.00 175.76 178.43 2ete s TYR 148 N -2.07 -0.07 0.08 0.00 -0.85 -0.82 -0.21 117.35 113.41 2ete s TYR 148 Ca 0.22 -0.12 0.02 0.00 -0.52 0.00 0.00 57.07 56.68 2ete s TYR 148 Cb -0.06 0.08 -0.04 0.00 0.38 0.00 0.00 41.96 42.32 2ete s TYR 148 CO 0.10 -0.51 -0.07 0.00 -1.52 0.00 0.00 175.55 173.55 2ete s MET 149 N -2.75 0.72 -0.11 -3.49 0.23 -0.45 -0.95 119.30 112.51 2ete s MET 149 Ca -0.04 -1.12 0.02 0.00 -1.03 0.00 0.00 55.69 53.52 2ete s MET 149 Cb -0.00 -0.25 0.01 0.00 -1.53 0.00 0.00 34.83 33.07 2ete s MET 149 CO -0.05 0.01 -0.16 0.08 -2.03 0.00 0.00 175.02 172.88 2ete s VAL 150 N -2.79 1.52 0.14 5.16 1.01 -0.63 -1.56 120.40 123.25 2ete s VAL 150 Ca 0.04 -0.67 0.08 0.00 0.00 0.00 0.00 61.98 61.43 2ete s VAL 150 Cb -0.00 -1.38 -0.04 0.00 0.00 0.00 0.00 36.38 34.95 2ete s VAL 150 CO -0.03 0.45 -0.18 0.68 0.00 0.00 0.00 175.10 176.02 2ete s VAL 151 N 0.91 1.68 0.19 2.92 -7.23 -0.22 -1.66 120.40 116.99 2ete s VAL 151 Ca -0.08 -1.77 0.09 0.00 -1.81 0.00 0.00 61.98 58.41 2ete s VAL 151 Cb -0.15 -1.69 -0.04 0.00 0.56 0.00 0.00 36.38 35.05 2ete s VAL 151 CO -0.00 -0.27 -0.19 -0.44 -0.31 0.00 0.00 175.10 173.89 2ete s SER 152 N -2.41 2.91 0.10 4.85 0.01 0.27 -1.32 113.70 118.10 2ete s SER 152 Ca 0.12 -0.91 0.06 0.00 1.31 0.00 0.00 55.95 56.52 2ete s SER 152 Cb -0.07 -0.19 -0.03 0.00 0.21 0.00 0.00 66.02 65.94 2ete s SER 152 CO 0.05 -0.02 -0.15 -0.36 0.41 0.00 0.00 173.24 173.18 2ete s PHE 153 N -2.19 1.34 -0.26 2.43 0.40 -0.38 -0.88 117.98 118.44 2ete s PHE 153 Ca 0.19 -0.50 -0.00 0.00 -0.60 0.00 0.00 56.93 56.02 2ete s PHE 153 Cb -0.05 -0.73 0.22 0.00 0.51 0.00 0.00 43.02 42.97 2ete s PHE 153 CO 0.08 0.10 1.84 0.27 0.70 0.00 0.00 175.22 178.22 2ete n ASN 154 N 0.94 5.51 -3.83 1.36 6.94 -1.05 -2.57 115.26 122.55 2ete n ASN 154 Ca -0.19 -2.91 -0.12 0.00 -0.02 0.00 0.00 54.58 51.34 2ete n ASN 154 Cb 0.55 -0.95 -0.10 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 0.27 -0.08 0.43 0.53 0.15 -1.08 -4.39 113.70 109.53 2ete s SER 155 Ca 0.27 -0.03 0.29 0.00 0.70 0.00 0.00 55.95 57.18 2ete s SER 155 Cb 0.21 0.27 1.15 0.00 -1.71 0.00 0.00 66.02 65.95 2ete s SER 155 CO 0.01 -0.36 1.86 0.06 1.20 0.00 0.00 173.24 176.01 2ete h GLN 156 N 4.35 0.00 -1.22 5.44 3.07 -1.78 -2.70 115.11 122.27 2ete h GLN 156 Ca -0.30 0.00 -0.40 0.00 0.09 0.00 0.00 58.65 58.04 2ete h GLN 156 Cb 1.19 0.00 -0.28 0.00 0.08 0.00 0.00 27.48 28.47 2ete h GLN 156 CO 0.40 0.00 -0.81 -1.71 0.09 0.00 0.00 178.83 176.80 2ete n ASN 157 N -2.75 -1.38 0.17 0.06 4.05 -1.26 -1.44 115.26 112.71 2ete n ASN 157 Ca 0.02 -2.90 0.06 0.00 0.45 0.00 0.00 54.58 52.20 2ete n ASN 157 Cb 0.30 0.51 0.54 0.00 1.23 0.00 0.00 39.78 42.35 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 0.17 0.00 1.20 0.13 -1.88 -3.45 132.00 132.46 2ete h PRO 158 Ca 0.01 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 2ete h PRO 158 Cb 0.96 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.05 2ete h PRO 158 CO 0.36 0.16 0.00 0.41 -0.23 0.00 0.00 178.00 178.70 2ete n GLY 159 N -1.39 -2.48 2.82 1.56 0.00 -1.26 -2.19 105.19 102.25 2ete n GLY 159 Ca -0.01 -1.37 -0.22 0.00 0.00 0.00 0.00 46.02 44.42 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 -3.61 0.46 -0.54 -0.61 2.07 -1.26 -4.24 121.20 113.47 2ete s ILE 160 Ca 0.00 0.02 -0.07 0.00 -1.41 0.00 0.00 60.65 59.19 2ete s ILE 160 Cb 0.00 -0.56 0.14 0.00 0.13 0.00 0.00 42.46 42.17 2ete s ILE 160 CO 0.00 0.25 0.39 -0.69 -1.91 0.00 0.00 174.94 172.98 2ete s VAL 161 N 1.59 4.04 -0.10 4.00 1.01 0.40 -4.98 120.40 126.35 2ete s VAL 161 Ca -0.01 -2.23 -0.30 0.00 0.00 0.00 0.00 61.98 59.45 2ete s VAL 161 Cb -0.13 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.58 2ete s VAL 161 CO -0.04 -0.81 1.20 -0.36 0.00 0.00 0.00 175.10 175.09 2ete s PHE 162 N 0.81 3.10 0.02 5.22 2.99 -1.26 -1.15 117.98 127.71 2ete s PHE 162 Ca 0.10 1.18 -0.25 0.00 0.00 0.00 0.00 56.93 57.96 2ete s PHE 162 Cb -0.22 -3.43 -0.17 0.00 0.00 0.00 0.00 43.02 39.20 2ete s PHE 162 CO -0.03 -1.33 1.31 0.28 -0.00 0.00 0.00 175.22 175.45 2ete h VAL 163 N 5.20 0.77 -0.02 -0.44 2.07 -1.43 -0.95 116.25 121.45 2ete h VAL 163 Ca -0.31 -0.57 0.00 0.00 0.82 0.00 0.00 66.70 66.65 2ete h VAL 163 Cb 1.14 1.08 -0.00 0.00 -1.52 0.00 0.00 31.29 31.99 2ete h VAL 163 CO 0.91 0.12 0.01 -0.65 0.02 0.00 0.00 177.57 177.98 2ete h PRO 164 N -0.67 0.03 -0.81 1.57 0.11 -1.94 -0.99 132.00 129.30 2ete h PRO 164 Ca -0.04 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.09 2ete h PRO 164 Cb 0.47 -0.01 -0.05 0.00 0.11 0.00 0.00 31.00 31.52 2ete h PRO 164 CO 0.06 0.05 0.53 1.25 -0.21 0.00 0.00 178.00 179.67 2ete h LEU 165 N 0.00 0.89 -0.26 2.35 5.85 -1.94 -1.44 115.31 120.76 2ete h LEU 165 Ca 0.01 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.63 2ete h LEU 165 Cb 0.02 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 40.84 2ete h LEU 165 CO -0.00 0.63 -0.18 0.74 -0.34 0.00 0.00 178.44 179.28 2ete h THR 166 N 1.05 1.31 -0.76 1.05 2.02 -1.07 0.22 112.91 116.73 2ete h THR 166 Ca 0.31 -1.31 -0.04 0.00 0.77 0.00 0.00 66.41 66.14 2ete h THR 166 Cb -0.05 1.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.93 2ete h THR 166 CO -0.09 0.41 0.31 -0.07 0.37 0.00 0.00 175.52 176.45 2ete h LEU 167 N 0.29 1.05 0.00 2.58 3.38 -1.00 -3.26 115.31 118.35 2ete h LEU 167 Ca 0.05 -0.17 0.00 0.00 0.09 0.00 0.00 57.88 57.85 2ete h LEU 167 Cb 0.72 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2ete h LEU 167 CO 0.05 0.93 -0.72 0.49 0.09 0.00 0.00 178.44 179.28 2ete n PHE 168 N -4.32 0.00 -2.08 1.13 3.01 -0.56 -4.57 117.46 110.08 2ete n PHE 168 Ca 0.07 0.00 0.04 0.00 1.01 0.00 0.00 57.45 58.57 2ete n PHE 168 Cb 0.18 -0.06 0.07 0.00 -0.01 0.00 0.00 39.48 39.66 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 1.59 2.20 3.67 1.37 0.00 0.77 -4.51 105.19 110.28 2ete n GLY 169 Ca 0.00 -0.82 -0.30 0.00 0.00 0.00 0.00 46.02 44.90 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 -2.18 2.87 -0.35 1.61 1.04 -1.10 -4.57 113.70 111.03 2ete s SER 170 Ca 0.28 1.55 0.02 0.00 0.48 0.00 0.00 55.95 58.28 2ete s SER 170 Cb 0.30 -2.21 0.11 0.00 0.10 0.00 0.00 66.02 64.32 2ete s SER 170 CO -0.10 -3.03 0.10 -0.62 0.98 0.00 0.00 173.24 170.58 2ete s ASP 171 N -3.17 4.31 0.81 7.02 2.15 -1.26 -1.61 116.67 124.92 2ete s ASP 171 Ca 0.65 -2.03 -0.11 0.00 0.43 0.00 0.00 52.55 51.48 2ete s ASP 171 Cb -0.20 -1.24 0.08 0.00 -0.30 0.00 0.00 42.92 41.26 2ete s ASP 171 CO 0.58 -0.37 1.10 -2.16 -0.17 0.00 0.00 175.17 174.15 2ete s PRO 172 N 1.08 1.95 0.64 4.34 0.04 -1.26 -5.13 135.00 136.66 2ete s PRO 172 Ca 0.12 0.65 -0.17 0.00 0.04 0.00 0.00 61.00 61.63 2ete s PRO 172 Cb -0.19 -1.90 -0.01 0.00 0.04 0.00 0.00 34.50 32.43 2ete s PRO 172 CO -0.14 -1.72 1.20 -2.14 0.04 0.00 0.00 177.00 174.24 2ete s PRO 173 N -5.13 2.73 0.26 0.56 0.02 -0.63 -4.97 135.00 127.83 2ete s PRO 173 Ca 0.61 1.78 -0.30 0.00 0.02 0.00 0.00 61.00 63.11 2ete s PRO 173 Cb -0.15 -1.90 -0.11 0.00 0.02 0.00 0.00 34.50 32.36 2ete s PRO 173 CO 0.54 -1.39 1.52 0.42 -0.33 0.00 0.00 177.00 177.77 2ete s ILE 174 N -1.75 2.41 0.32 2.83 1.01 -1.26 -4.92 121.20 119.84 2ete s ILE 174 Ca 0.76 0.34 -0.28 0.00 0.00 0.00 0.00 60.65 61.47 2ete s ILE 174 Cb -0.30 -3.22 -0.13 0.00 0.01 0.00 0.00 42.46 38.83 2ete s ILE 174 CO 0.37 0.05 1.16 -2.65 0.00 0.00 0.00 174.94 173.88 2ete n PRO 175 N 2.46 1.78 -0.22 2.79 -0.02 -1.26 -4.84 135.00 135.70 2ete n PRO 175 Ca 0.08 0.62 -0.00 0.00 -2.02 0.00 0.00 63.50 62.18 2ete n PRO 175 Cb 0.39 -2.12 0.11 0.00 -0.02 0.00 0.00 33.50 31.86 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 2.29 0.86 -0.20 3.45 2.02 -2.00 -1.80 112.91 117.53 2ete h THR 176 Ca -0.43 -0.18 0.06 0.00 0.77 0.00 0.00 66.41 66.62 2ete h THR 176 Cb 1.31 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.99 2ete h THR 176 CO 0.62 0.10 0.14 -0.65 0.37 0.00 0.00 175.52 176.10 2ete h PRO 177 N 0.53 0.00 -0.28 6.66 0.11 -1.99 0.11 132.00 137.14 2ete h PRO 177 Ca 0.31 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 66.36 2ete h PRO 177 Cb 0.31 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.41 2ete h PRO 177 CO -0.25 0.00 -0.03 0.28 -0.21 0.00 0.00 178.00 177.79 2ete h VAL 178 N 0.00 1.27 -0.14 3.15 2.07 -1.69 -2.82 116.25 118.09 2ete h VAL 178 Ca 0.09 -1.00 -0.16 0.00 0.82 0.00 0.00 66.70 66.45 2ete h VAL 178 Cb 0.38 1.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.51 2ete h VAL 178 CO -0.00 0.32 -0.60 -0.07 0.02 0.00 0.00 177.57 177.24 2ete h LEU 179 N 0.28 0.53 -0.62 2.57 3.38 -1.05 -1.50 115.31 118.89 2ete h LEU 179 Ca 0.07 -0.30 -0.06 0.00 0.09 0.00 0.00 57.88 57.69 2ete h LEU 179 Cb 0.48 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 2ete h LEU 179 CO 0.02 1.00 0.17 0.71 0.09 0.00 0.00 178.44 180.43 2ete h THR 180 N 0.35 1.25 -0.40 0.22 1.35 -0.88 0.13 112.91 114.93 2ete h THR 180 Ca -0.00 -0.89 -0.05 0.00 -0.55 0.00 0.00 66.41 64.91 2ete h THR 180 Cb 1.14 0.65 -0.02 0.00 -1.73 0.00 0.00 68.15 68.19 2ete h THR 180 CO 0.11 0.34 0.05 0.50 -0.25 0.00 0.00 175.52 176.27 2ete h LYS 181 N 0.90 0.66 -0.21 4.72 1.63 -1.43 -1.15 116.57 121.69 2ete h LYS 181 Ca 0.20 -0.18 -0.15 0.00 -0.85 0.00 0.00 60.65 59.67 2ete h LYS 181 Cb 0.33 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.88 2ete h LYS 181 CO -0.00 0.72 -0.48 0.00 -3.45 0.00 0.00 179.45 176.23 2ete h ALA 182 N 0.92 0.76 0.00 5.00 0.00 -1.13 -3.30 119.26 121.51 2ete h ALA 182 Ca 0.12 -0.48 0.00 0.00 0.00 0.00 0.00 54.91 54.55 2ete h ALA 182 Cb 0.38 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2ete h ALA 182 CO 0.01 0.67 -0.93 1.28 0.00 0.00 0.00 179.25 180.28 2ete n LEU 183 N -3.99 0.90 -1.93 0.00 4.77 0.44 -4.98 117.00 112.21 2ete n LEU 183 Ca -0.02 -0.41 -0.16 0.00 -0.03 0.00 0.00 56.01 55.39 2ete n LEU 183 Cb 0.57 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2ete n LEU 183 CO 0.46 0.22 -0.13 0.54 -1.33 0.00 0.00 177.39 177.16 2ete n ARG 184 N -1.52 -2.05 -4.32 3.23 1.74 -0.44 -5.01 116.66 108.29 2ete n ARG 184 Ca 0.04 0.72 -0.17 0.00 -0.77 0.00 0.00 57.85 57.67 2ete n ARG 184 Cb 0.34 -5.07 -0.10 0.00 -1.02 0.00 0.00 32.46 26.60 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 -2.85 1.07 0.83 1.55 -7.23 -1.21 -5.08 120.40 107.48 2ete s VAL 185 Ca 0.08 -2.04 -0.11 0.00 -1.81 0.00 0.00 61.98 58.09 2ete s VAL 185 Cb -0.03 -2.27 0.09 0.00 0.56 0.00 0.00 36.38 34.72 2ete s VAL 185 CO 0.10 -0.39 1.09 -1.61 -0.31 0.00 0.00 175.10 173.98 2ete s GLU 186 N -3.84 1.84 0.38 4.82 2.02 -1.26 -4.56 118.70 118.09 2ete s GLU 186 Ca 0.27 0.87 0.10 0.00 0.02 0.00 0.00 54.97 56.23 2ete s GLU 186 Cb 0.05 -1.87 0.86 0.00 0.10 0.00 0.00 34.13 33.27 2ete s GLU 186 CO 0.08 -1.85 1.90 0.00 0.02 0.00 0.00 175.26 175.41 2ete h ALA 187 N -1.27 1.88 -0.86 5.21 0.00 -1.96 -2.22 119.26 120.04 2ete h ALA 187 Ca -0.47 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.52 2ete h ALA 187 Cb 1.26 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 18.86 2ete h ALA 187 CO 0.55 -0.08 0.51 0.78 0.00 0.00 0.00 179.25 181.02 2ete h GLY 188 N 0.63 1.32 0.95 0.00 0.00 -1.99 0.11 103.07 104.09 2ete h GLY 188 Ca 0.39 -0.36 -0.10 0.00 0.00 0.00 0.00 47.33 47.27 2ete h GLY 188 CO -0.16 0.19 -0.17 -2.08 0.00 0.00 0.00 176.54 174.32 2ete h VAL 189 N 0.89 1.29 -0.36 4.60 2.07 -1.77 -1.46 116.25 121.51 2ete h VAL 189 Ca 0.40 -1.29 -0.01 0.00 0.82 0.00 0.00 66.70 66.61 2ete h VAL 189 Cb 0.28 1.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.47 2ete h VAL 189 CO -0.21 0.42 0.17 0.58 0.02 0.00 0.00 177.57 178.55 2ete h VAL 190 N 0.45 1.17 -0.20 2.57 2.07 -1.30 -2.02 116.25 118.99 2ete h VAL 190 Ca 0.07 -0.47 -0.08 0.00 0.82 0.00 0.00 66.70 67.03 2ete h VAL 190 Cb 0.71 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 31.28 2ete h VAL 190 CO 0.05 0.18 -0.24 -0.33 0.02 0.00 0.00 177.57 177.25 2ete h GLU 191 N 0.45 0.36 -0.14 1.57 4.39 -0.77 -0.06 114.58 120.38 2ete h GLU 191 Ca 0.12 -0.12 0.01 0.00 0.34 0.00 0.00 59.36 59.71 2ete h GLU 191 Cb 0.12 -0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2ete h GLU 191 CO -0.02 0.58 0.07 1.25 -1.16 0.00 0.00 179.01 179.74 2ete h LEU 192 N 0.32 0.11 -0.55 1.33 5.85 -1.07 -1.66 115.31 119.66 2ete h LEU 192 Ca 0.05 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.72 2ete h LEU 192 Cb 0.60 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.59 2ete h LEU 192 CO 0.04 0.09 0.14 -0.07 -0.34 0.00 0.00 178.44 178.30 2ete h LEU 193 N 0.16 0.82 -0.89 2.25 3.38 -0.92 -2.47 115.31 117.64 2ete h LEU 193 Ca 0.06 -0.23 0.09 0.00 0.09 0.00 0.00 57.88 57.89 2ete h LEU 193 Cb 0.01 -0.22 -0.07 0.00 0.09 0.00 0.00 40.66 40.47 2ete h LEU 193 CO -0.04 0.84 0.54 0.11 0.09 0.00 0.00 178.44 179.98 2ete h LYS 194 N 0.77 0.89 0.00 1.13 1.57 -0.93 -2.33 116.57 117.67 2ete h LYS 194 Ca 0.17 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 2ete h LYS 194 Cb 0.33 -0.20 -0.00 0.00 0.08 0.00 0.00 32.23 32.44 2ete h LYS 194 CO 0.00 0.59 -0.04 0.66 -0.57 0.00 0.00 179.45 180.09 2ete h SER 195 N 0.92 0.00 1.33 0.86 4.64 -0.81 -1.69 113.55 118.79 2ete h SER 195 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2ete h SER 195 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.41 2ete h SER 195 CO -0.23 0.04 -0.07 0.29 -0.87 0.00 0.00 176.83 175.99 2ete n LYS 196 N -3.69 0.22 -0.13 4.77 4.76 -0.88 -3.71 118.16 119.49 2ete n LYS 196 Ca -0.03 0.17 0.07 0.00 -2.87 0.00 0.00 58.31 55.65 2ete n LYS 196 Cb 0.13 -1.74 0.10 0.00 -1.84 0.00 0.00 35.03 31.68 2ete n LYS 196 CO 0.00 0.00 0.00 1.19 -1.37 0.00 0.00 177.40 177.22 2ete n PHE 197 N -2.12 0.00 0.31 2.13 3.01 -0.67 -4.83 117.46 115.29 2ete n PHE 197 Ca 0.06 -0.75 0.10 0.00 1.01 0.00 0.00 57.45 57.87 2ete n PHE 197 Cb 0.42 -0.12 0.47 0.00 -0.01 0.00 0.00 39.48 40.24 2ete n PHE 197 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2ete n ALA 198 N -1.05 1.42 1.02 4.37 0.00 -1.02 -2.06 120.51 123.19 2ete n ALA 198 Ca 0.11 0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.77 2ete n ALA 198 Cb 0.60 -1.32 0.30 0.00 0.00 0.00 0.00 19.45 19.04 2ete n ALA 198 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ete n GLY 199 N -0.51 0.74 2.08 0.00 0.00 -1.26 -4.95 105.19 101.29 2ete n GLY 199 Ca 0.01 -0.57 -0.01 0.00 0.00 0.00 0.00 46.02 45.45 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 1.29 0.49 0.00 -0.02 0.00 -0.88 -5.21 105.19 100.86 2ete n GLY 200 Ca 0.17 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.79 2ete n GLY 200 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18