#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eej s SER 2 N 0.00 -0.50 0.22 1.61 0.15 -1.26 -5.05 113.70 108.88 2eej s SER 2 Ca 0.00 0.75 -0.08 0.00 0.70 0.00 0.00 55.95 57.31 2eej s SER 2 Cb 0.00 0.68 0.36 0.00 -1.71 0.00 0.00 66.02 65.35 2eej s SER 2 CO 0.00 -0.32 1.68 -1.28 1.20 0.00 0.00 173.24 174.52 2eej h SER 3 N 3.47 -0.08 0.00 5.45 0.87 -2.09 -3.46 113.55 117.71 2eej h SER 3 Ca -0.24 0.14 0.00 0.00 -1.23 0.00 0.00 61.79 60.45 2eej h SER 3 Cb 1.16 0.21 0.00 0.00 -0.44 0.00 0.00 62.40 63.33 2eej h SER 3 CO 0.23 -0.05 0.00 0.61 -0.53 0.00 0.00 176.83 177.09 2eej n GLY 4 N -1.35 3.00 3.55 5.77 0.00 -1.26 -5.05 105.19 109.85 2eej n GLY 4 Ca 0.11 -0.80 -0.51 0.00 0.00 0.00 0.00 46.02 44.82 2eej n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2eej n SER 5 N 1.41 0.99 -4.38 1.61 2.88 -1.26 -4.95 113.62 109.92 2eej n SER 5 Ca 0.00 1.14 -0.34 0.00 -1.33 0.00 0.00 58.87 58.34 2eej n SER 5 Cb 0.00 -1.14 -0.14 0.00 -0.75 0.00 0.00 64.21 62.19 2eej n SER 5 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2eej s SER 6 N 0.05 4.29 0.00 -3.46 0.01 -1.26 -4.94 113.70 108.39 2eej s SER 6 Ca 0.79 -0.30 0.00 0.00 1.31 0.00 0.00 55.95 57.74 2eej s SER 6 Cb -0.96 -1.69 0.00 0.00 0.21 0.00 0.00 66.02 63.58 2eej s SER 6 CO 0.52 0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.88 2eej n GLY 7 N 3.97 -1.71 0.00 3.44 0.00 -1.26 -5.16 105.19 104.47 2eej n GLY 7 Ca -0.18 0.56 0.00 0.00 0.00 0.00 0.00 46.02 46.40 2eej n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eej n PRO 8 N -0.73 -0.71 -4.58 1.61 -0.04 -1.26 -5.02 135.00 124.27 2eej n PRO 8 Ca 0.00 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 2eej n PRO 8 Cb 0.00 0.00 -0.11 0.00 -0.04 0.00 0.00 33.50 33.35 2eej n PRO 8 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2eej s LYS 9 N -2.53 2.54 -0.23 0.54 1.02 -0.61 -5.03 119.74 115.43 2eej s LYS 9 Ca 0.00 -0.70 0.02 0.00 0.02 0.00 0.00 55.97 55.30 2eej s LYS 9 Cb 0.00 -2.47 0.05 0.00 -0.52 0.00 0.00 37.83 34.89 2eej s LYS 9 CO 0.00 0.61 -0.11 -1.17 -0.92 0.00 0.00 175.35 173.76 2eej s LEU 10 N -1.18 2.88 -0.05 3.17 1.98 -1.26 -2.62 118.68 121.60 2eej s LEU 10 Ca 0.15 -1.15 0.01 0.00 -2.89 0.00 0.00 54.13 50.24 2eej s LEU 10 Cb -0.11 -1.41 0.02 0.00 0.66 0.00 0.00 46.19 45.35 2eej s LEU 10 CO 0.05 -0.16 -0.04 0.00 -1.89 0.00 0.00 176.35 174.31 2eej s ARG 12 N 1.10 3.62 0.03 0.00 0.52 -1.26 -4.00 118.95 118.95 2eej s ARG 12 Ca -0.08 0.40 0.07 0.00 -0.52 0.00 0.00 55.73 55.59 2eej s ARG 12 Cb -0.14 -2.31 -0.02 0.00 0.52 0.00 0.00 34.95 33.00 2eej s ARG 12 CO -0.01 -0.25 -0.21 -0.51 0.02 0.00 0.00 175.30 174.35 2eej s LEU 13 N -4.63 2.13 -0.07 2.53 1.43 -1.02 -4.82 118.68 114.23 2eej s LEU 13 Ca 0.50 -0.48 0.02 0.00 -1.03 0.00 0.00 54.13 53.14 2eej s LEU 13 Cb -0.10 -0.99 0.01 0.00 0.03 0.00 0.00 46.19 45.14 2eej s LEU 13 CO 0.44 0.18 -0.12 0.00 0.23 0.00 0.00 176.35 177.08 2eej s ALA 14 N -0.71 1.31 0.32 4.21 0.00 -1.26 -3.02 121.76 122.60 2eej s ALA 14 Ca 0.08 -0.46 -0.27 0.00 0.00 0.00 0.00 51.96 51.31 2eej s ALA 14 Cb -0.09 -0.63 -0.10 0.00 0.00 0.00 0.00 23.12 22.31 2eej s ALA 14 CO 0.01 0.04 0.97 0.15 0.00 0.00 0.00 175.76 176.94 2eej s LYS 15 N 0.80 4.56 0.00 0.00 1.02 -0.13 -4.46 119.74 121.53 2eej s LYS 15 Ca -0.12 1.41 0.00 0.00 0.02 0.00 0.00 55.97 57.29 2eej s LYS 15 Cb -0.15 -2.85 0.00 0.00 -0.52 0.00 0.00 37.83 34.30 2eej s LYS 15 CO 0.02 0.24 0.00 0.41 -0.92 0.00 0.00 175.35 175.10 2eej n GLY 16 N 0.70 1.22 0.02 -3.33 0.00 -1.26 -5.00 105.19 97.54 2eej n GLY 16 Ca 0.02 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.03 2eej n GLY 16 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2eej h GLU 17 N 0.00 -0.04 0.00 1.61 4.81 -2.02 -3.43 114.58 115.51 2eej h GLU 17 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2eej h GLU 17 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.39 2eej h GLU 17 CO 0.00 -0.02 0.00 0.09 -0.73 0.00 0.00 179.01 178.35 2eej n ASN 18 N -2.60 0.00 -1.66 1.04 3.02 -1.26 -5.07 115.26 108.73 2eej n ASN 18 Ca -0.00 0.59 -0.01 0.00 -0.03 0.00 0.00 54.58 55.13 2eej n ASN 18 Cb 0.01 -0.49 0.01 0.00 -0.61 0.00 0.00 39.78 38.70 2eej n ASN 18 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2eej n GLY 19 N 1.42 1.06 0.48 7.41 0.00 -1.26 -5.00 105.19 109.30 2eej n GLY 19 Ca 0.00 -0.98 0.29 0.00 0.00 0.00 0.00 46.02 45.34 2eej n GLY 19 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2eej h TYR 20 N 1.28 0.02 0.00 1.61 0.05 -1.95 -3.37 116.97 114.61 2eej h TYR 20 Ca -0.08 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.71 2eej h TYR 20 Cb 0.34 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.07 2eej h TYR 20 CO 0.00 0.00 0.00 0.41 -1.05 0.00 0.00 178.16 177.52 2eej n GLY 21 N -1.72 2.89 3.90 3.88 0.00 -1.26 -4.07 105.19 108.81 2eej n GLY 21 Ca 0.20 -0.75 -0.28 0.00 0.00 0.00 0.00 46.02 45.18 2eej n GLY 21 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2eej s PHE 22 N -0.23 3.44 0.34 1.61 -0.71 -1.26 -4.33 117.98 116.83 2eej s PHE 22 Ca 0.00 0.91 0.05 0.00 -1.04 0.00 0.00 56.93 56.85 2eej s PHE 22 Cb 0.00 -2.68 -0.02 0.00 -1.21 0.00 0.00 43.02 39.12 2eej s PHE 22 CO 0.00 -0.71 0.18 0.72 -1.34 0.00 0.00 175.22 174.07 2eej n HIS 23 N -2.61 -0.22 -4.39 3.49 8.25 0.14 -4.93 115.22 114.95 2eej n HIS 23 Ca 0.04 -2.41 -0.25 0.00 -0.26 0.00 0.00 57.72 54.84 2eej n HIS 23 Cb 0.56 0.10 -0.10 0.00 1.12 0.00 0.00 29.99 31.68 2eej n HIS 23 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2eej s LEU 24 N 0.00 2.77 -0.04 2.41 1.02 -1.26 -0.30 118.68 123.28 2eej s LEU 24 Ca 0.26 -0.83 -0.02 0.00 0.02 0.00 0.00 54.13 53.56 2eej s LEU 24 Cb 0.01 -1.36 0.03 0.00 0.02 0.00 0.00 46.19 44.90 2eej s LEU 24 CO 0.18 0.06 0.06 0.21 0.02 0.00 0.00 176.35 176.88 2eej s ASN 25 N -3.27 0.79 0.22 2.29 3.84 -0.68 -4.82 114.94 113.32 2eej s ASN 25 Ca 0.28 0.09 -0.30 0.00 0.21 0.00 0.00 52.86 53.14 2eej s ASN 25 Cb -0.07 -0.08 -0.09 0.00 -0.55 0.00 0.00 41.25 40.47 2eej s ASN 25 CO 0.15 -0.21 1.17 0.00 -2.79 0.00 0.00 177.10 175.42 2eej s ALA 26 N 1.86 3.43 -0.13 1.71 0.00 -1.26 -3.40 121.76 123.97 2eej s ALA 26 Ca 0.01 0.95 -0.07 0.00 0.00 0.00 0.00 51.96 52.84 2eej s ALA 26 Cb -0.12 -3.39 0.05 0.00 0.00 0.00 0.00 23.12 19.65 2eej s ALA 26 CO -0.03 -0.32 0.31 0.42 0.00 0.00 0.00 175.76 176.13 2eej s ILE 27 N -0.42 -0.03 0.10 0.00 1.01 -1.26 -5.04 121.20 115.56 2eej s ILE 27 Ca 0.50 0.11 -0.00 0.00 0.00 0.00 0.00 60.65 61.26 2eej s ILE 27 Cb -0.33 -0.46 -0.24 0.00 0.01 0.00 0.00 42.46 41.44 2eej s ILE 27 CO 0.39 0.05 1.21 0.08 0.00 0.00 0.00 174.94 176.67 2eej h ARG 28 N 6.99 0.19 -0.96 2.79 0.11 -1.96 -3.32 114.38 118.22 2eej h ARG 28 Ca -0.38 -0.31 0.30 0.00 0.10 0.00 0.00 59.98 59.70 2eej h ARG 28 Cb 1.17 0.11 -0.17 0.00 1.11 0.00 0.00 29.97 32.19 2eej h ARG 28 CO 0.34 1.12 0.28 0.78 0.10 0.00 0.00 179.97 182.59 2eej h GLY 29 N 1.99 1.62 -4.31 0.08 0.00 -2.00 -3.41 103.07 97.05 2eej h GLY 29 Ca -0.09 -0.02 -0.20 0.00 0.00 0.00 0.00 47.33 47.02 2eej h GLY 29 CO 0.17 -0.54 -0.71 1.08 0.00 0.00 0.00 176.54 176.55 2eej s LEU 30 N -10.71 2.33 0.98 3.11 1.43 -1.25 -5.16 118.68 109.41 2eej s LEU 30 Ca -0.11 -0.68 -0.12 0.00 -1.03 0.00 0.00 54.13 52.18 2eej s LEU 30 Cb 0.29 0.02 0.17 0.00 0.03 0.00 0.00 46.19 46.71 2eej s LEU 30 CO 0.78 -0.35 1.09 -2.16 0.23 0.00 0.00 176.35 175.94 2eej s PRO 31 N -2.30 0.61 0.53 1.29 0.04 -1.26 -4.67 135.00 129.24 2eej s PRO 31 Ca -0.06 0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.57 2eej s PRO 31 Cb -0.04 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.74 2eej s PRO 31 CO -0.03 -2.62 0.00 0.41 0.04 0.00 0.00 177.00 174.80 2eej n GLY 32 N -1.08 -3.80 2.50 0.56 0.00 -0.97 -4.94 105.19 97.45 2eej n GLY 32 Ca 0.06 -0.94 -0.22 0.00 0.00 0.00 0.00 46.02 44.92 2eej n GLY 32 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2eej n SER 33 N -2.82 -1.97 -3.79 1.61 7.64 -1.26 -4.77 113.62 108.25 2eej n SER 33 Ca -0.02 -0.95 -0.13 0.00 1.01 0.00 0.00 58.87 58.79 2eej n SER 33 Cb 0.47 -0.72 -0.12 0.00 -1.01 0.00 0.00 64.21 62.83 2eej n SER 33 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2eej s PHE 34 N -2.36 -0.24 -0.02 1.43 0.40 -1.22 -3.72 117.98 112.25 2eej s PHE 34 Ca 0.51 0.58 -0.30 0.00 -0.60 0.00 0.00 56.93 57.12 2eej s PHE 34 Cb -0.05 0.08 -0.05 0.00 0.51 0.00 0.00 43.02 43.51 2eej s PHE 34 CO 0.39 -0.14 1.33 0.42 0.70 0.00 0.00 175.22 177.93 2eej s ILE 35 N 0.00 3.89 0.07 0.64 1.01 0.05 -1.69 121.20 125.17 2eej s ILE 35 Ca -0.01 1.25 -0.08 0.00 0.00 0.00 0.00 60.65 61.82 2eej s ILE 35 Cb -0.02 -3.81 -0.01 0.00 0.01 0.00 0.00 42.46 38.64 2eej s ILE 35 CO 0.01 -0.00 0.16 -0.75 0.00 0.00 0.00 174.94 174.35 2eej s LYS 36 N 2.32 0.78 -1.38 2.79 2.20 0.59 -3.57 119.74 123.46 2eej s LYS 36 Ca 0.61 -0.94 -0.05 0.00 -0.36 0.00 0.00 55.97 55.23 2eej s LYS 36 Cb -0.29 0.31 0.01 0.00 -1.51 0.00 0.00 37.83 36.34 2eej s LYS 36 CO 0.25 -0.23 0.69 0.39 -0.36 0.00 0.00 175.35 176.09 2eej n GLU 37 N 0.10 -5.18 -3.08 4.03 1.02 -1.26 0.28 120.64 116.55 2eej n GLU 37 Ca -0.16 0.82 -0.41 0.00 -0.02 0.00 0.00 57.16 57.39 2eej n GLU 37 Cb 0.62 -5.55 -0.06 0.00 -0.02 0.00 0.00 31.44 26.43 2eej n GLU 37 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2eej s VAL 38 N -3.17 4.94 0.35 2.62 0.11 -1.26 -4.05 120.40 119.94 2eej s VAL 38 Ca 0.34 1.07 -0.24 0.00 -2.93 0.00 0.00 61.98 60.23 2eej s VAL 38 Cb -0.15 -3.99 -0.10 0.00 -1.53 0.00 0.00 36.38 30.60 2eej s VAL 38 CO 0.42 -0.07 0.92 -1.58 -3.33 0.00 0.00 175.10 171.47 2eej s GLN 39 N 2.62 4.42 -0.64 1.54 2.00 -1.26 -4.97 119.66 123.37 2eej s GLN 39 Ca 0.27 1.20 -0.23 0.00 -2.00 0.00 0.00 55.36 54.61 2eej s GLN 39 Cb -0.15 -2.58 0.07 0.00 0.80 0.00 0.00 33.01 31.15 2eej s GLN 39 CO 0.10 0.18 0.94 0.21 -0.50 0.00 0.00 175.29 176.22 2eej s LYS 40 N -2.47 3.13 0.00 1.67 2.36 -1.26 -3.83 119.74 119.34 2eej s LYS 40 Ca 0.54 -0.79 0.00 0.00 -2.55 0.00 0.00 55.97 53.17 2eej s LYS 40 Cb -0.15 -4.21 0.00 0.00 -1.05 0.00 0.00 37.83 32.43 2eej s LYS 40 CO 0.20 -1.75 0.00 0.41 1.55 0.00 0.00 175.35 175.75 2eej n GLY 41 N 5.30 0.78 0.00 5.54 0.00 -1.26 -5.07 105.19 110.48 2eej n GLY 41 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.98 2eej n GLY 41 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2eej n GLY 42 N 0.00 -0.60 0.24 -0.02 0.00 -1.25 -4.78 105.19 98.77 2eej n GLY 42 Ca 0.00 -1.63 -0.09 0.00 0.00 0.00 0.00 46.02 44.30 2eej n GLY 42 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eej h PRO 43 N 0.00 0.66 0.00 1.61 0.13 -1.78 -2.69 132.00 129.93 2eej h PRO 43 Ca 0.00 -0.35 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 2eej h PRO 43 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 2eej h PRO 43 CO 0.00 0.95 0.00 0.00 -0.23 0.00 0.00 178.00 178.72 2eej n ALA 44 N -2.52 -0.38 -0.28 -0.56 0.00 -1.26 -0.78 120.51 114.73 2eej n ALA 44 Ca -0.02 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.51 2eej n ALA 44 Cb 0.53 0.00 0.23 0.00 0.00 0.00 0.00 19.45 20.21 2eej n ALA 44 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.50 177.72 2eej h ASP 45 N 0.00 -0.08 -0.08 0.00 1.82 -1.72 0.74 116.42 117.10 2eej h ASP 45 Ca 0.00 0.18 -0.01 0.00 -0.39 0.00 0.00 57.03 56.82 2eej h ASP 45 Cb 0.00 0.27 -0.01 0.00 0.68 0.00 0.00 39.33 40.27 2eej h ASP 45 CO 0.00 -0.13 0.04 -0.07 -1.61 0.00 0.00 179.24 177.47 2eej h LEU 46 N 0.20 0.13 -0.22 2.28 3.38 -1.47 -0.84 115.31 118.76 2eej h LEU 46 Ca 0.48 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.39 2eej h LEU 46 Cb 0.91 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.62 2eej h LEU 46 CO -0.62 0.13 -0.28 0.00 0.09 0.00 0.00 178.44 177.76 2eej h ALA 47 N 1.89 0.85 0.00 1.53 0.00 0.26 -3.47 119.26 120.31 2eej h ALA 47 Ca 0.04 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2eej h ALA 47 Cb 0.05 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2eej h ALA 47 CO -0.00 0.34 0.00 0.41 0.00 0.00 0.00 179.25 180.00 2eej n GLY 48 N 0.98 1.69 3.82 0.00 0.00 -0.32 -4.92 105.19 106.44 2eej n GLY 48 Ca 0.02 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.67 2eej n GLY 48 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2eej s LEU 49 N 0.00 4.37 0.29 0.99 1.43 -1.09 -5.01 118.68 119.66 2eej s LEU 49 Ca 0.00 0.63 0.08 0.00 -1.03 0.00 0.00 54.13 53.80 2eej s LEU 49 Cb 0.00 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 2eej s LEU 49 CO 0.00 0.29 0.21 -0.70 0.23 0.00 0.00 176.35 176.38 2eej s GLU 50 N -0.61 2.73 0.00 1.70 2.56 -1.26 -4.43 118.70 119.40 2eej s GLU 50 Ca 0.18 -1.23 0.11 0.00 0.00 0.00 0.00 54.97 54.03 2eej s GLU 50 Cb -0.14 -2.45 0.66 0.00 2.00 0.00 0.00 34.13 34.20 2eej s GLU 50 CO 0.07 0.25 1.24 -0.40 -0.56 0.00 0.00 175.26 175.86 2eej n ASP 51 N -1.22 0.00 -0.10 -1.70 5.68 -1.26 -2.27 116.55 115.68 2eej n ASP 51 Ca -0.05 -1.20 0.02 0.00 -0.50 0.00 0.00 54.79 53.06 2eej n ASP 51 Cb 0.59 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.57 2eej n ASP 51 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 2eej n GLU 52 N -0.72 2.15 -1.28 0.11 1.02 -1.23 -4.38 120.64 116.31 2eej n GLU 52 Ca 0.08 -0.44 -0.31 0.00 -0.02 0.00 0.00 57.16 56.48 2eej n GLU 52 Cb 0.04 -0.91 0.10 0.00 -0.02 0.00 0.00 31.44 30.65 2eej n GLU 52 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2eej s ASP 53 N -0.77 4.25 -0.03 1.62 1.11 -0.96 -4.81 116.67 117.08 2eej s ASP 53 Ca 0.03 1.68 0.02 0.00 0.18 0.00 0.00 52.55 54.46 2eej s ASP 53 Cb 0.03 -2.39 0.01 0.00 1.07 0.00 0.00 42.92 41.65 2eej s ASP 53 CO 0.09 -2.18 -0.06 0.68 1.18 0.00 0.00 175.17 174.89 2eej s VAL 54 N -2.94 0.61 -0.68 -1.27 -7.23 -1.26 -0.77 120.40 106.86 2eej s VAL 54 Ca 0.62 -0.21 -0.27 0.00 -1.81 0.00 0.00 61.98 60.30 2eej s VAL 54 Cb -0.17 -0.59 0.02 0.00 0.56 0.00 0.00 36.38 36.21 2eej s VAL 54 CO 0.56 0.22 1.37 -0.63 -0.31 0.00 0.00 175.10 176.31 2eej s ILE 55 N 0.57 3.71 0.00 -0.62 1.09 -1.24 -4.07 121.20 120.63 2eej s ILE 55 Ca -0.08 0.46 0.00 0.00 -1.10 0.00 0.00 60.65 59.93 2eej s ILE 55 Cb -0.11 -4.70 0.00 0.00 -1.06 0.00 0.00 42.46 36.59 2eej s ILE 55 CO 0.00 -1.58 0.32 -0.38 -0.10 0.00 0.00 174.94 173.20 2eej n ILE 56 N 6.59 0.00 -3.73 2.92 5.41 -0.16 -4.47 119.36 125.92 2eej n ILE 56 Ca 0.07 0.79 -0.23 0.00 1.00 0.00 0.00 62.75 64.38 2eej n ILE 56 Cb 0.49 -1.72 -0.03 0.00 -0.71 0.00 0.00 39.64 37.67 2eej n ILE 56 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 176.55 174.94 2eej s GLU 57 N -1.54 2.40 -0.22 0.38 2.02 -1.25 -2.71 118.70 117.77 2eej s GLU 57 Ca 0.00 -1.72 -0.04 0.00 0.02 0.00 0.00 54.97 53.23 2eej s GLU 57 Cb 0.00 -2.24 0.12 0.00 0.10 0.00 0.00 34.13 32.11 2eej s GLU 57 CO 0.00 -0.31 0.36 0.54 0.02 0.00 0.00 175.26 175.87 2eej s VAL 58 N -2.58 -0.56 -1.57 2.63 0.11 -0.41 -3.17 120.40 114.85 2eej s VAL 58 Ca 0.44 -0.01 0.00 0.00 -2.93 0.00 0.00 61.98 59.48 2eej s VAL 58 Cb -0.02 -0.74 0.00 0.00 -1.53 0.00 0.00 36.38 34.09 2eej s VAL 58 CO 0.25 -0.08 0.00 0.59 -3.33 0.00 0.00 175.10 172.54 2eej n ASN 59 N 5.36 -5.02 -1.02 3.54 3.02 -0.91 -3.37 115.26 116.87 2eej n ASN 59 Ca -0.05 0.13 0.00 0.00 -0.03 0.00 0.00 54.58 54.63 2eej n ASN 59 Cb 0.50 -4.08 0.00 0.00 -0.61 0.00 0.00 39.78 35.59 2eej n ASN 59 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2eej n GLY 60 N -0.97 0.76 3.64 7.41 0.00 -1.26 -5.10 105.19 109.66 2eej n GLY 60 Ca -0.19 -0.39 -0.08 0.00 0.00 0.00 0.00 46.02 45.36 2eej n GLY 60 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eej s VAL 61 N -2.69 0.00 -0.48 1.61 0.11 -1.22 -5.12 120.40 112.61 2eej s VAL 61 Ca 0.00 0.00 -0.29 0.00 -2.93 0.00 0.00 61.98 58.76 2eej s VAL 61 Cb 0.00 -1.00 0.03 0.00 -1.53 0.00 0.00 36.38 33.88 2eej s VAL 61 CO 0.00 0.00 1.13 0.21 -3.33 0.00 0.00 175.10 173.11 2eej s ASN 62 N 0.93 6.62 0.00 3.54 3.84 -1.26 -1.29 114.94 127.32 2eej s ASN 62 Ca -0.04 0.43 0.05 0.00 0.21 0.00 0.00 52.86 53.51 2eej s ASN 62 Cb -0.05 -2.54 0.13 0.00 -0.55 0.00 0.00 41.25 38.24 2eej s ASN 62 CO -0.11 -1.25 1.04 1.33 -2.79 0.00 0.00 177.10 175.32 2eej n VAL 63 N 6.83 0.81 -0.22 -5.21 0.24 -1.10 -4.71 118.33 114.97 2eej n VAL 63 Ca 0.12 -0.90 0.02 0.00 -2.04 0.00 0.00 64.34 61.53 2eej n VAL 63 Cb 0.49 0.62 0.11 0.00 -1.47 0.00 0.00 33.84 33.59 2eej n VAL 63 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2eej h LEU 64 N 1.02 -0.33 -1.20 1.34 3.38 -1.79 0.22 115.31 117.95 2eej h LEU 64 Ca 0.00 0.17 -0.05 0.00 0.09 0.00 0.00 57.88 58.08 2eej h LEU 64 Cb 0.54 0.30 -0.02 0.00 0.09 0.00 0.00 40.66 41.57 2eej h LEU 64 CO 0.00 -0.14 -0.02 0.44 0.09 0.00 0.00 178.44 178.81 2eej h ASP 65 N 0.10 0.49 -4.10 -0.43 3.32 -1.91 -2.56 116.42 111.33 2eej h ASP 65 Ca 0.34 -0.10 -0.56 0.00 0.02 0.00 0.00 57.03 56.73 2eej h ASP 65 Cb 0.56 -0.13 0.16 0.00 0.22 0.00 0.00 39.33 40.13 2eej h ASP 65 CO -0.57 0.58 0.53 -1.61 -1.72 0.00 0.00 179.24 176.45 2eej s GLU 66 N -4.94 2.61 1.13 3.56 0.41 0.79 -4.89 118.70 117.38 2eej s GLU 66 Ca -0.08 2.10 -0.17 0.00 -0.41 0.00 0.00 54.97 56.42 2eej s GLU 66 Cb 0.15 -1.90 0.25 0.00 -1.78 0.00 0.00 34.13 30.86 2eej s GLU 66 CO 0.77 -1.56 1.10 -1.25 -0.49 0.00 0.00 175.26 173.83 2eej s PRO 67 N -3.32 -0.66 0.21 0.39 0.04 -1.26 -4.56 135.00 125.84 2eej s PRO 67 Ca 0.81 0.14 0.02 0.00 0.04 0.00 0.00 61.00 62.01 2eej s PRO 67 Cb -0.38 -1.64 0.15 0.00 0.04 0.00 0.00 34.50 32.66 2eej s PRO 67 CO 0.41 -3.38 1.49 -0.92 0.04 0.00 0.00 177.00 174.65 2eej h TYR 68 N -2.35 0.40 0.00 0.56 5.03 -1.95 -1.83 116.97 116.84 2eej h TYR 68 Ca -0.49 -0.17 -0.07 0.00 2.58 0.00 0.00 58.73 60.59 2eej h TYR 68 Cb 1.31 -0.06 -0.01 0.00 1.55 0.00 0.00 36.73 39.51 2eej h TYR 68 CO -1.23 0.88 -0.32 0.93 -1.32 0.00 0.00 178.16 177.09 2eej h GLU 69 N 0.21 0.00 0.00 1.82 5.08 -1.99 -1.38 114.58 118.32 2eej h GLU 69 Ca -0.02 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 2eej h GLU 69 Cb 1.22 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 2eej h GLU 69 CO 0.11 0.32 -0.25 -0.22 -1.00 0.00 0.00 179.01 177.98 2eej h LYS 70 N 0.00 0.00 -0.58 2.33 1.63 -1.90 -3.25 116.57 114.79 2eej h LYS 70 Ca -0.00 0.00 0.10 0.00 -0.85 0.00 0.00 60.65 59.90 2eej h LYS 70 Cb 0.61 0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 32.16 2eej h LYS 70 CO 0.04 0.30 0.15 -0.39 -3.45 0.00 0.00 179.45 176.09 2eej h VAL 71 N -1.00 0.68 -0.36 2.00 -1.51 -1.38 -1.86 116.25 112.82 2eej h VAL 71 Ca -0.04 -0.10 0.07 0.00 -1.23 0.00 0.00 66.70 65.41 2eej h VAL 71 Cb 0.45 0.37 -0.07 0.00 -2.13 0.00 0.00 31.29 29.91 2eej h VAL 71 CO -0.02 0.05 -0.09 1.62 -1.23 0.00 0.00 177.57 177.90 2eej h VAL 72 N 0.29 0.63 -0.96 7.19 3.04 -1.42 -0.18 116.25 124.85 2eej h VAL 72 Ca 0.30 0.00 0.20 0.00 -1.01 0.00 0.00 66.70 66.20 2eej h VAL 72 Cb 0.43 0.63 -0.08 0.00 -2.01 0.00 0.00 31.29 30.26 2eej h VAL 72 CO -0.37 0.00 0.61 -0.78 -1.01 0.00 0.00 177.57 176.03 2eej h ASP 73 N -0.00 0.55 -0.25 3.17 1.82 -1.38 0.27 116.42 120.60 2eej h ASP 73 Ca 0.17 0.06 -0.13 0.00 -0.39 0.00 0.00 57.03 56.75 2eej h ASP 73 Cb 0.27 -0.04 -0.00 0.00 0.68 0.00 0.00 39.33 40.24 2eej h ASP 73 CO -0.37 0.21 -0.33 0.03 -1.61 0.00 0.00 179.24 177.16 2eej h ARG 74 N 0.54 0.67 -0.38 0.28 3.08 -0.84 0.50 114.38 118.23 2eej h ARG 74 Ca 0.52 -0.38 -0.11 0.00 0.07 0.00 0.00 59.98 60.07 2eej h ARG 74 Cb 1.10 0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.16 2eej h ARG 74 CO -0.26 1.00 -0.22 0.82 -1.07 0.00 0.00 179.97 180.24 2eej h ILE 75 N 0.38 1.27 0.24 2.04 2.04 -0.04 -0.43 117.51 123.00 2eej h ILE 75 Ca 0.03 -1.32 -0.33 0.00 1.00 0.00 0.00 64.86 64.24 2eej h ILE 75 Cb 0.91 1.21 0.03 0.00 -0.74 0.00 0.00 36.82 38.24 2eej h ILE 75 CO 0.08 0.44 -1.47 1.56 0.00 0.00 0.00 178.15 178.76 2eej h GLN 76 N 0.65 0.50 0.00 2.37 1.08 -0.54 -3.26 115.11 115.92 2eej h GLN 76 Ca 0.09 -0.86 -0.01 0.00 -1.45 0.00 0.00 58.65 56.42 2eej h GLN 76 Cb 0.72 0.32 -0.00 0.00 -0.05 0.00 0.00 27.48 28.47 2eej h GLN 76 CO 0.06 1.41 -0.05 1.03 -0.95 0.00 0.00 178.83 180.32 2eej h SER 77 N 0.14 0.00 -0.41 1.46 0.87 0.04 -3.28 113.55 112.37 2eej h SER 77 Ca -0.25 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.36 2eej h SER 77 Cb 2.15 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 64.03 2eej h SER 77 CO 0.26 0.05 -0.53 0.77 -0.53 0.00 0.00 176.83 176.86 2eej h SER 78 N 0.00 -1.77 0.00 6.23 4.64 -1.11 -3.48 113.55 118.05 2eej h SER 78 Ca -0.00 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 2eej h SER 78 Cb 0.59 0.73 0.00 0.00 -0.31 0.00 0.00 62.40 63.40 2eej h SER 78 CO 0.01 -0.37 0.00 0.61 -0.87 0.00 0.00 176.83 176.21 2eej n GLY 79 N -1.35 0.63 0.13 -0.77 0.00 -1.24 -4.85 105.19 97.75 2eej n GLY 79 Ca -0.03 -0.84 -0.19 0.00 0.00 0.00 0.00 46.02 44.96 2eej n GLY 79 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2eej n LYS 80 N 0.00 0.74 -4.83 1.61 4.81 -1.26 -4.90 118.16 114.33 2eej n LYS 80 Ca 0.00 0.27 -0.26 0.00 -0.87 0.00 0.00 58.31 57.44 2eej n LYS 80 Cb 0.00 -1.72 -0.16 0.00 0.02 0.00 0.00 35.03 33.16 2eej n LYS 80 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 2eej s ASN 81 N -6.89 2.19 0.07 3.14 2.20 -1.26 -0.96 114.94 113.43 2eej s ASN 81 Ca -0.19 -0.37 0.04 0.00 -0.94 0.00 0.00 52.86 51.40 2eej s ASN 81 Cb 0.07 -0.73 -0.03 0.00 -2.00 0.00 0.00 41.25 38.55 2eej s ASN 81 CO 0.78 0.13 -0.11 0.54 -2.94 0.00 0.00 177.10 175.50 2eej s VAL 82 N 0.19 0.86 -0.27 3.54 0.11 -1.17 -4.97 120.40 118.70 2eej s VAL 82 Ca -0.08 -1.30 -0.06 0.00 -2.93 0.00 0.00 61.98 57.61 2eej s VAL 82 Cb -0.13 -0.97 0.00 0.00 -1.53 0.00 0.00 36.38 33.75 2eej s VAL 82 CO 0.03 -0.36 0.04 -0.89 -3.33 0.00 0.00 175.10 170.59 2eej s THR 83 N -1.60 3.78 0.02 5.04 2.01 -1.26 -2.44 115.64 121.20 2eej s THR 83 Ca -0.03 -0.64 0.08 0.00 0.31 0.00 0.00 61.69 61.41 2eej s THR 83 Cb -0.08 -2.89 -0.02 0.00 0.01 0.00 0.00 72.50 69.51 2eej s THR 83 CO 0.01 0.18 -0.22 -0.76 -0.69 0.00 0.00 174.62 173.14 2eej s LEU 84 N 1.49 2.12 -0.37 4.42 1.43 -1.26 -2.13 118.68 124.39 2eej s LEU 84 Ca 0.03 -0.49 -0.08 0.00 -1.03 0.00 0.00 54.13 52.56 2eej s LEU 84 Cb -0.16 -1.10 0.05 0.00 0.03 0.00 0.00 46.19 45.01 2eej s LEU 84 CO 0.01 0.22 0.16 -0.22 0.23 0.00 0.00 176.35 176.75 2eej s LEU 85 N -0.95 4.62 -0.09 1.79 0.20 -1.19 -3.79 118.68 119.26 2eej s LEU 85 Ca 0.09 -1.23 -0.02 0.00 0.69 0.00 0.00 54.13 53.66 2eej s LEU 85 Cb -0.09 -1.92 -0.03 0.00 -0.43 0.00 0.00 46.19 43.71 2eej s LEU 85 CO 0.01 -0.39 0.01 0.68 -0.29 0.00 0.00 176.35 176.36 2eej s VAL 86 N 1.43 4.37 0.18 1.68 -7.23 -1.08 -0.99 120.40 118.76 2eej s VAL 86 Ca 0.00 -0.22 0.09 0.00 -1.81 0.00 0.00 61.98 60.04 2eej s VAL 86 Cb -0.20 -2.85 -0.04 0.00 0.56 0.00 0.00 36.38 33.84 2eej s VAL 86 CO 0.03 0.59 -0.11 0.00 -0.31 0.00 0.00 175.10 175.31 2eej n GLY 88 N 0.12 -0.44 2.55 0.00 0.00 -1.26 -4.57 105.19 101.59 2eej n GLY 88 Ca -0.11 -0.65 -0.35 0.00 0.00 0.00 0.00 46.02 44.91 2eej n GLY 88 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2eej n LYS 89 N -3.70 2.91 -0.65 1.61 4.81 -1.26 -4.76 118.16 117.12 2eej n LYS 89 Ca 0.12 -3.64 -0.07 0.00 -0.87 0.00 0.00 58.31 53.85 2eej n LYS 89 Cb 0.52 -2.28 0.02 0.00 0.02 0.00 0.00 35.03 33.31 2eej n LYS 89 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 2eej n LYS 90 N -0.69 1.34 -3.59 1.64 4.01 -1.26 -4.71 118.16 114.91 2eej n LYS 90 Ca 0.54 -0.67 -0.02 0.00 -0.51 0.00 0.00 58.31 57.66 2eej n LYS 90 Cb 0.52 -1.26 -0.05 0.00 -0.51 0.00 0.00 35.03 33.73 2eej n LYS 90 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2eej s SER 91 N 1.20 -0.89 0.00 4.39 0.15 -1.26 -5.17 113.70 112.12 2eej s SER 91 Ca 0.13 1.28 0.00 0.00 0.70 0.00 0.00 55.95 58.06 2eej s SER 91 Cb 0.10 1.81 0.00 0.00 -1.71 0.00 0.00 66.02 66.22 2eej s SER 91 CO -0.00 -0.19 0.00 0.61 1.20 0.00 0.00 173.24 174.86 2eej n GLY 92 N 4.85 2.91 0.25 9.45 0.00 -1.26 -5.00 105.19 116.40 2eej n GLY 92 Ca -0.14 -0.38 0.14 0.00 0.00 0.00 0.00 46.02 45.63 2eej n GLY 92 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eej h PRO 93 N 0.00 0.00 -6.69 1.61 0.13 -2.02 -3.45 132.00 121.58 2eej h PRO 93 Ca 0.00 0.00 -0.56 0.00 -0.87 0.00 0.00 66.00 64.57 2eej h PRO 93 Cb 0.00 0.00 0.19 0.00 0.13 0.00 0.00 31.00 31.32 2eej h PRO 93 CO 0.00 0.11 -0.37 0.43 -0.23 0.00 0.00 178.00 177.94 2eej n SER 94 N -3.28 -1.15 -4.63 1.44 7.64 -1.26 -5.02 113.62 107.36 2eej n SER 94 Ca -0.00 0.57 -0.29 0.00 1.01 0.00 0.00 58.87 60.15 2eej n SER 94 Cb 0.34 -1.23 -0.09 0.00 -1.01 0.00 0.00 64.21 62.22 2eej n SER 94 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2eej s SER 95 N -1.55 3.77 0.00 6.43 1.04 -1.26 -5.15 113.70 116.98 2eej s SER 95 Ca 0.65 -1.52 0.00 0.00 0.48 0.00 0.00 55.95 55.56 2eej s SER 95 Cb -0.33 0.10 0.00 0.00 0.10 0.00 0.00 66.02 65.89 2eej s SER 95 CO 0.58 -0.68 0.00 0.61 0.98 0.00 0.00 173.24 174.74