#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b6e s TRP 3 N 0.00 2.90 -0.10 1.96 0.52 -1.26 -4.73 118.94 118.23 2b6e s TRP 3 Ca 0.00 1.42 0.06 0.00 0.02 0.00 0.00 56.10 57.60 2b6e s TRP 3 Cb 0.00 -3.65 -0.08 0.00 -1.15 0.00 0.00 33.47 28.59 2b6e s TRP 3 CO 0.00 -1.97 0.17 1.63 0.02 0.00 0.00 176.95 176.80 2b6e n LYS 4 N 0.32 1.99 -4.07 4.98 5.02 0.28 -4.98 118.16 121.69 2b6e n LYS 4 Ca 0.03 -0.03 -0.33 0.00 -2.02 0.00 0.00 58.31 55.95 2b6e n LYS 4 Cb 0.43 -1.00 -0.07 0.00 -0.02 0.00 0.00 35.03 34.37 2b6e n LYS 4 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2b6e s LYS 5 N -2.08 3.14 0.26 1.97 1.02 -1.05 -4.74 119.74 118.27 2b6e s LYS 5 Ca -0.01 -0.43 -0.26 0.00 0.02 0.00 0.00 55.97 55.29 2b6e s LYS 5 Cb 0.04 -2.91 -0.09 0.00 -0.52 0.00 0.00 37.83 34.35 2b6e s LYS 5 CO 0.23 0.66 0.89 -0.08 -0.92 0.00 0.00 175.35 176.14 2b6e s THR 6 N -1.18 4.24 0.12 2.17 -1.32 -1.26 -5.00 115.64 113.41 2b6e s THR 6 Ca 0.22 1.82 -0.25 0.00 -1.21 0.00 0.00 61.69 62.27 2b6e s THR 6 Cb -0.12 -4.11 0.07 0.00 -1.51 0.00 0.00 72.50 66.84 2b6e s THR 6 CO 0.13 0.32 0.74 0.72 -2.21 0.00 0.00 174.62 174.32 2b6e s PHE 7 N -1.40 -0.39 0.05 9.09 -0.12 -1.26 -5.14 117.98 118.82 2b6e s PHE 7 Ca 0.44 0.16 0.03 0.00 -0.05 0.00 0.00 56.93 57.52 2b6e s PHE 7 Cb -0.21 0.58 -0.03 0.00 -0.63 0.00 0.00 43.02 42.73 2b6e s PHE 7 CO 0.26 -0.80 -0.10 0.95 -0.05 0.00 0.00 175.22 175.48 2b6e s THR 8 N -3.52 0.74 0.39 -4.49 -4.23 -1.26 -5.04 115.64 98.23 2b6e s THR 8 Ca 0.05 -1.19 0.06 0.00 -1.18 0.00 0.00 61.69 59.43 2b6e s THR 8 Cb -0.02 -0.81 0.24 0.00 1.34 0.00 0.00 72.50 73.26 2b6e s THR 8 CO -0.08 -0.35 2.02 -0.07 -0.54 0.00 0.00 174.62 175.60 2b6e h LEU 9 N 4.36 0.50 -0.10 4.79 3.38 -1.99 -1.90 115.31 124.33 2b6e h LEU 9 Ca -0.37 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.59 2b6e h LEU 9 Cb 1.20 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.80 2b6e h LEU 9 CO 0.41 0.40 -0.01 -0.08 0.09 0.00 0.00 178.44 179.25 2b6e h GLU 10 N 0.57 0.02 -0.37 1.13 4.81 -1.96 -1.10 114.58 117.69 2b6e h GLU 10 Ca 0.15 -0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.31 2b6e h GLU 10 Cb 0.01 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.37 2b6e h GLU 10 CO -0.03 0.01 -0.05 -0.91 -0.73 0.00 0.00 179.01 177.30 2b6e h ASN 11 N 0.02 0.58 -0.50 1.04 -0.26 -1.86 -1.30 115.58 113.31 2b6e h ASN 11 Ca 0.05 -0.14 -0.11 0.00 -0.56 0.00 0.00 56.30 55.54 2b6e h ASN 11 Cb 0.07 -0.16 -0.02 0.00 -1.06 0.00 0.00 38.32 37.15 2b6e h ASN 11 CO -0.09 0.69 -0.12 -0.07 -1.06 0.00 0.00 177.43 176.78 2b6e h LEU 12 N 0.57 0.96 -1.17 1.61 3.38 -0.99 0.69 115.31 120.36 2b6e h LEU 12 Ca 0.11 -0.36 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 2b6e h LEU 12 Cb 0.44 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2b6e h LEU 12 CO 0.02 1.10 -0.39 0.78 0.09 0.00 0.00 178.44 180.05 2b6e h ASN 13 N 0.81 0.00 -0.22 -0.43 2.35 -0.94 -1.73 115.58 115.42 2b6e h ASN 13 Ca 0.13 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.82 2b6e h ASN 13 Cb 0.68 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.04 2b6e h ASN 13 CO 0.05 0.39 -0.08 -0.61 -1.65 0.00 0.00 177.43 175.53 2b6e h GLN 14 N 0.00 0.43 -0.68 0.81 -0.00 -0.79 -2.55 115.11 112.34 2b6e h GLN 14 Ca -0.00 -0.18 0.06 0.00 -0.00 0.00 0.00 58.65 58.53 2b6e h GLN 14 Cb 0.75 -0.02 -0.04 0.00 0.00 0.00 0.00 27.48 28.17 2b6e h GLN 14 CO 0.05 0.70 0.45 1.25 0.00 0.00 0.00 178.83 181.28 2b6e h LEU 15 N 0.15 0.61 -0.48 -2.39 5.85 -0.40 -1.96 115.31 116.69 2b6e h LEU 15 Ca 0.05 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.77 2b6e h LEU 15 Cb 0.55 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.45 2b6e h LEU 15 CO 0.03 0.40 -0.06 0.00 -0.34 0.00 0.00 178.44 178.47 2b6e s SER 17 N -2.18 4.53 -1.36 0.00 1.04 -0.74 -3.51 113.70 111.48 2b6e s SER 17 Ca 0.36 2.40 -0.02 0.00 0.48 0.00 0.00 55.95 59.18 2b6e s SER 17 Cb 0.21 -2.60 -0.00 0.00 0.10 0.00 0.00 66.02 63.73 2b6e s SER 17 CO 0.40 -2.04 0.50 -3.20 0.98 0.00 0.00 173.24 169.88 2b6e n ASN 18 N -2.29 -0.83 -2.23 7.02 5.15 -1.26 -4.94 115.26 115.87 2b6e n ASN 18 Ca 0.14 -0.97 -0.09 0.00 -0.60 0.00 0.00 54.58 53.05 2b6e n ASN 18 Cb 0.50 -3.28 -0.02 0.00 -0.53 0.00 0.00 39.78 36.44 2b6e n ASN 18 CO 0.00 0.00 0.00 -1.54 1.40 0.00 0.00 177.26 177.12 2b6e n SER 19 N -2.98 -0.74 0.25 1.20 3.41 -1.23 -5.02 113.62 108.50 2b6e n SER 19 Ca -0.29 -2.18 0.07 0.00 -0.26 0.00 0.00 58.87 56.21 2b6e n SER 19 Cb 0.68 1.43 0.60 0.00 -0.26 0.00 0.00 64.21 66.66 2b6e n SER 19 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b6e h ALA 20 N 1.76 1.82 0.32 7.33 0.00 -1.93 -1.73 119.26 126.83 2b6e h ALA 20 Ca -0.16 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 2b6e h ALA 20 Cb 0.72 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.50 2b6e h ALA 20 CO 0.22 0.10 -0.15 0.28 0.00 0.00 0.00 179.25 179.70 2b6e h VAL 21 N 0.00 0.71 -0.07 0.00 2.07 -1.95 -2.19 116.25 114.82 2b6e h VAL 21 Ca -0.00 -0.31 -0.11 0.00 0.82 0.00 0.00 66.70 67.10 2b6e h VAL 21 Cb 0.15 0.88 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2b6e h VAL 21 CO 0.01 0.06 -0.46 0.77 0.02 0.00 0.00 177.57 177.97 2b6e h SER 22 N -0.59 0.17 0.16 0.57 4.64 -1.58 -1.76 113.55 115.15 2b6e h SER 22 Ca -0.04 -0.07 -0.02 0.00 -0.47 0.00 0.00 61.79 61.18 2b6e h SER 22 Cb 0.43 -0.05 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2b6e h SER 22 CO 0.07 0.61 -0.10 -0.74 -0.87 0.00 0.00 176.83 175.80 2b6e h HIS 23 N 0.13 0.00 -0.40 4.77 2.76 -1.16 -0.49 115.15 120.76 2b6e h HIS 23 Ca 0.01 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.18 2b6e h HIS 23 Cb 0.87 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.83 2b6e h HIS 23 CO 0.01 0.10 0.00 1.28 -1.30 0.00 0.00 177.93 178.02 2b6e n LEU 24 N -4.07 2.90 -0.93 0.26 4.77 -0.84 -4.93 117.00 114.16 2b6e n LEU 24 Ca -0.02 -1.32 -0.11 0.00 -0.03 0.00 0.00 56.01 54.53 2b6e n LEU 24 Cb 0.18 -0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 40.97 2b6e n LEU 24 CO 0.32 0.66 -0.11 0.61 -1.33 0.00 0.00 177.39 177.54 2b6e n GLY 25 N 1.39 1.04 3.74 -0.72 0.00 -0.19 -4.53 105.19 105.91 2b6e n GLY 25 Ca 0.19 -0.50 -0.41 0.00 0.00 0.00 0.00 46.02 45.30 2b6e n GLY 25 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b6e s ILE 26 N -2.44 3.91 -0.07 -0.61 1.01 -0.69 -4.33 121.20 117.98 2b6e s ILE 26 Ca 0.00 1.68 0.02 0.00 0.00 0.00 0.00 60.65 62.35 2b6e s ILE 26 Cb 0.00 -4.07 0.02 0.00 0.01 0.00 0.00 42.46 38.41 2b6e s ILE 26 CO 0.00 0.31 -0.10 -0.70 0.00 0.00 0.00 174.94 174.44 2b6e s GLU 27 N -0.49 1.52 -0.43 2.79 2.12 -0.29 -4.54 118.70 119.37 2b6e s GLU 27 Ca 0.48 -0.33 -0.29 0.00 0.36 0.00 0.00 54.97 55.19 2b6e s GLU 27 Cb -0.29 -1.33 0.01 0.00 0.26 0.00 0.00 34.13 32.78 2b6e s GLU 27 CO 0.35 -0.04 1.46 0.42 -0.54 0.00 0.00 175.26 176.90 2b6e s ILE 28 N 0.88 3.84 -0.13 -3.70 -1.09 -1.26 -0.44 121.20 119.29 2b6e s ILE 28 Ca -0.11 0.83 0.16 0.00 -2.23 0.00 0.00 60.65 59.30 2b6e s ILE 28 Cb -0.15 -4.18 -0.24 0.00 -1.58 0.00 0.00 42.46 36.31 2b6e s ILE 28 CO 0.01 -0.79 0.34 -1.54 -1.23 0.00 0.00 174.94 171.73 2b6e n SER 29 N 9.15 0.38 -3.58 3.58 3.41 -0.50 -4.90 113.62 121.16 2b6e n SER 29 Ca 0.17 0.18 -0.06 0.00 -0.26 0.00 0.00 58.87 58.89 2b6e n SER 29 Cb 0.48 0.55 -0.02 0.00 -0.26 0.00 0.00 64.21 64.96 2b6e n SER 29 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2b6e s ALA 30 N -2.55 -1.81 -0.02 7.33 0.00 -1.19 -5.01 121.76 118.52 2b6e s ALA 30 Ca -0.08 0.79 -0.21 0.00 0.00 0.00 0.00 51.96 52.47 2b6e s ALA 30 Cb 0.07 0.45 0.04 0.00 0.00 0.00 0.00 23.12 23.68 2b6e s ALA 30 CO 0.83 -0.79 0.45 -0.59 0.00 0.00 0.00 175.76 175.66 2b6e s PHE 31 N -3.10 -0.36 0.00 0.00 -0.71 -1.26 -0.38 117.98 112.16 2b6e s PHE 31 Ca 0.07 0.55 0.00 0.00 -1.04 0.00 0.00 56.93 56.52 2b6e s PHE 31 Cb -0.01 0.22 0.00 0.00 -1.21 0.00 0.00 43.02 42.03 2b6e s PHE 31 CO -0.06 -0.49 0.00 0.41 -1.34 0.00 0.00 175.22 173.74 2b6e n GLY 32 N 1.03 7.05 0.21 1.99 0.00 0.54 -4.99 105.19 111.01 2b6e n GLY 32 Ca -0.20 -2.07 -0.05 0.00 0.00 0.00 0.00 46.02 43.70 2b6e n GLY 32 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2b6e h GLU 33 N 0.00 0.42 -0.05 1.61 5.08 -2.03 -3.34 114.58 116.26 2b6e h GLU 33 Ca 0.00 -0.20 -0.16 0.00 -1.00 0.00 0.00 59.36 57.99 2b6e h GLU 33 Cb 0.00 -0.00 -0.33 0.00 0.50 0.00 0.00 28.75 28.92 2b6e h GLU 33 CO 0.00 0.75 -0.96 -0.40 -1.00 0.00 0.00 179.01 177.41 2b6e n ASP 34 N -4.03 1.23 -3.59 1.42 5.68 -1.26 -2.34 116.55 113.67 2b6e n ASP 34 Ca -0.01 -2.34 -0.14 0.00 -0.50 0.00 0.00 54.79 51.80 2b6e n ASP 34 Cb 0.49 -0.35 -0.05 0.00 -1.14 0.00 0.00 41.12 40.07 2b6e n ASP 34 CO 0.00 0.00 0.00 -1.66 -1.33 0.00 0.00 177.20 174.21 2b6e s TRP 35 N -0.91 -0.40 -0.05 2.11 1.48 -1.26 -4.45 118.94 115.47 2b6e s TRP 35 Ca 0.34 0.42 -0.08 0.00 -1.06 0.00 0.00 56.10 55.72 2b6e s TRP 35 Cb 0.38 0.33 0.02 0.00 -1.16 0.00 0.00 33.47 33.03 2b6e s TRP 35 CO -0.14 -0.64 0.20 -1.50 -4.06 0.00 0.00 176.95 170.82 2b6e s ILE 36 N -2.52 0.03 0.17 0.66 2.07 -1.00 -0.34 121.20 120.27 2b6e s ILE 36 Ca -0.05 -0.27 0.08 0.00 -1.41 0.00 0.00 60.65 59.00 2b6e s ILE 36 Cb -0.01 -0.38 -0.04 0.00 0.13 0.00 0.00 42.46 42.16 2b6e s ILE 36 CO -0.02 -0.15 -0.17 -1.61 -1.91 0.00 0.00 174.94 171.08 2b6e s GLU 37 N -0.52 1.26 -0.01 3.50 2.02 0.48 -0.80 118.70 124.64 2b6e s GLU 37 Ca -0.06 -1.43 -0.01 0.00 0.02 0.00 0.00 54.97 53.49 2b6e s GLU 37 Cb -0.04 -1.24 0.00 0.00 0.10 0.00 0.00 34.13 32.95 2b6e s GLU 37 CO 0.01 0.24 0.03 0.00 0.02 0.00 0.00 175.26 175.56 2b6e s ALA 38 N -2.26 -0.06 0.00 5.21 0.00 -0.79 -1.41 121.76 122.45 2b6e s ALA 38 Ca 0.17 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.12 2b6e s ALA 38 Cb -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.05 2b6e s ALA 38 CO 0.06 -0.04 0.00 0.25 0.00 0.00 0.00 175.76 176.04 2b6e n THR 39 N 2.84 0.00 -4.39 0.00 -2.24 0.42 -1.00 114.28 109.90 2b6e n THR 39 Ca -0.14 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.37 2b6e n THR 39 Cb 0.59 -0.50 -0.12 0.00 -2.10 0.00 0.00 70.33 68.21 2b6e n THR 39 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2b6e s PRO 41 N -1.67 1.59 -0.65 -0.78 0.04 -1.26 -1.14 135.00 131.14 2b6e s PRO 41 Ca 0.00 -1.45 -0.10 0.00 0.04 0.00 0.00 61.00 59.49 2b6e s PRO 41 Cb 0.00 -1.91 0.17 0.00 0.04 0.00 0.00 34.50 32.79 2b6e s PRO 41 CO 0.00 0.42 0.54 0.08 0.04 0.00 0.00 177.00 178.07 2b6e s VAL 42 N -1.56 4.70 0.00 -0.36 1.01 -0.15 -4.65 120.40 119.39 2b6e s VAL 42 Ca 0.20 -2.30 0.00 0.00 0.00 0.00 0.00 61.98 59.89 2b6e s VAL 42 Cb -0.08 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.30 2b6e s VAL 42 CO 0.10 -0.90 0.00 -0.90 0.00 0.00 0.00 175.10 173.40 2b6e n ASP 43 N 4.25 0.00 0.21 3.32 5.68 -1.26 -4.53 116.55 124.23 2b6e n ASP 43 Ca 0.03 -0.43 0.18 0.00 -0.50 0.00 0.00 54.79 54.07 2b6e n ASP 43 Cb 0.42 0.00 0.81 0.00 -1.14 0.00 0.00 41.12 41.21 2b6e n ASP 43 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 2b6e h HIS 44 N 0.43 0.00 0.00 2.11 2.07 -1.98 0.53 115.15 118.32 2b6e h HIS 44 Ca 0.00 0.00 -0.07 0.00 -2.85 0.00 0.00 60.37 57.45 2b6e h HIS 44 Cb 0.00 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 29.97 2b6e h HIS 44 CO 0.00 0.00 -0.34 0.00 -3.07 0.00 0.00 177.93 174.52 2b6e h ARG 45 N 0.00 0.00 -1.57 5.12 3.08 -1.95 -3.49 114.38 115.57 2b6e h ARG 45 Ca 0.09 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.61 2b6e h ARG 45 Cb 0.76 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.39 2b6e h ARG 45 CO -0.00 0.34 -0.85 0.25 -1.07 0.00 0.00 179.97 178.64 2b6e n THR 46 N -3.22 2.02 -4.42 2.04 -2.24 0.18 -4.95 114.28 103.68 2b6e n THR 46 Ca 0.02 -4.62 -0.26 0.00 -2.27 0.00 0.00 64.05 56.92 2b6e n THR 46 Cb 0.64 -0.80 -0.09 0.00 -2.10 0.00 0.00 70.33 67.97 2b6e n THR 46 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2b6e s GLN 48 N -3.36 2.04 0.48 -0.78 -1.52 0.97 -0.75 119.66 116.73 2b6e s GLN 48 Ca 0.43 -1.95 0.15 0.00 -1.95 0.00 0.00 55.36 52.04 2b6e s GLN 48 Cb 0.39 -1.80 1.14 0.00 -0.22 0.00 0.00 33.01 32.52 2b6e s GLN 48 CO -0.12 -0.01 2.07 -1.35 -0.25 0.00 0.00 175.29 175.62 2b6e h PRO 49 N 1.71 0.22 -0.85 2.91 0.11 -2.00 -2.84 132.00 131.25 2b6e h PRO 49 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2b6e h PRO 49 Cb 1.25 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.31 2b6e h PRO 49 CO 0.74 0.14 0.00 1.97 -0.21 0.00 0.00 178.00 180.64 2b6e n PHE 50 N -4.49 0.52 -0.67 0.65 1.16 -1.26 -4.90 117.46 108.47 2b6e n PHE 50 Ca 0.03 -0.18 0.00 0.00 -1.87 0.00 0.00 57.45 55.43 2b6e n PHE 50 Cb 0.21 -0.19 0.00 0.00 -1.61 0.00 0.00 39.48 37.89 2b6e n PHE 50 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 2b6e n GLY 51 N 0.20 0.66 3.36 4.97 0.00 -1.07 -5.07 105.19 108.23 2b6e n GLY 51 Ca 0.07 -0.06 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 2b6e n GLY 51 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2b6e s VAL 52 N -2.00 1.92 0.15 1.61 -7.23 -1.26 -4.62 120.40 108.97 2b6e s VAL 52 Ca 0.00 -2.05 -0.34 0.00 -1.81 0.00 0.00 61.98 57.78 2b6e s VAL 52 Cb 0.00 -1.96 -0.15 0.00 0.56 0.00 0.00 36.38 34.82 2b6e s VAL 52 CO 0.00 -0.37 1.31 -0.11 -0.31 0.00 0.00 175.10 175.62 2b6e n LEU 53 N 0.04 1.98 -4.65 1.32 7.94 0.12 -0.02 117.00 123.72 2b6e n LEU 53 Ca -0.11 1.13 -0.43 0.00 -1.11 0.00 0.00 56.01 55.49 2b6e n LEU 53 Cb 0.58 -1.26 -0.02 0.00 0.53 0.00 0.00 43.42 43.25 2b6e n LEU 53 CO 0.31 -0.98 1.10 -2.28 -1.11 0.00 0.00 177.39 174.43 2b6e s HIS 54 N 0.19 2.80 0.37 1.96 5.65 0.07 -4.59 115.29 121.74 2b6e s HIS 54 Ca 0.77 0.97 0.10 0.00 0.25 0.00 0.00 55.06 57.15 2b6e s HIS 54 Cb -0.84 -3.67 0.85 0.00 -1.18 0.00 0.00 32.58 27.75 2b6e s HIS 54 CO 0.48 -1.65 1.90 0.78 -0.65 0.00 0.00 174.74 175.60 2b6e h GLY 55 N 10.22 1.06 1.71 1.59 0.00 -1.89 -0.77 103.07 114.98 2b6e h GLY 55 Ca -0.26 -0.28 -0.08 0.00 0.00 0.00 0.00 47.33 46.72 2b6e h GLY 55 CO 1.00 0.11 -0.22 -1.33 0.00 0.00 0.00 176.54 176.09 2b6e h GLY 56 N 0.65 0.37 2.00 4.60 0.00 -1.96 -2.23 103.07 106.49 2b6e h GLY 56 Ca 0.41 -0.27 -0.12 0.00 0.00 0.00 0.00 47.33 47.34 2b6e h GLY 56 CO -0.17 0.25 -0.56 -2.08 0.00 0.00 0.00 176.54 173.98 2b6e h VAL 57 N 0.31 1.17 -0.68 4.60 2.07 -1.50 -2.34 116.25 119.88 2b6e h VAL 57 Ca 0.05 -2.09 -0.08 0.00 0.82 0.00 0.00 66.70 65.40 2b6e h VAL 57 Cb 0.57 2.21 -0.03 0.00 -1.52 0.00 0.00 31.29 32.52 2b6e h VAL 57 CO 0.04 0.55 0.11 0.28 0.02 0.00 0.00 177.57 178.57 2b6e h SER 58 N 0.00 1.08 -0.46 0.57 0.02 -0.79 -1.35 113.55 112.62 2b6e h SER 58 Ca -0.01 -0.26 -0.07 0.00 -0.84 0.00 0.00 61.79 60.62 2b6e h SER 58 Cb 1.16 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 2b6e h SER 58 CO 0.07 1.07 0.06 0.58 -1.14 0.00 0.00 176.83 177.47 2b6e h VAL 59 N 1.05 1.24 -0.64 2.27 2.07 -1.18 -0.29 116.25 120.77 2b6e h VAL 59 Ca 0.21 -0.95 0.02 0.00 0.82 0.00 0.00 66.70 66.80 2b6e h VAL 59 Cb 0.45 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 30.96 2b6e h VAL 59 CO 0.01 0.34 0.41 0.00 0.02 0.00 0.00 177.57 178.35 2b6e h ALA 60 N 1.26 0.82 -0.48 1.67 0.00 -0.85 0.19 119.26 121.87 2b6e h ALA 60 Ca 0.16 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2b6e h ALA 60 Cb 0.40 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2b6e h ALA 60 CO 0.01 0.19 0.20 1.25 0.00 0.00 0.00 179.25 180.90 2b6e h LEU 61 N 0.82 0.65 -0.13 0.00 5.85 -0.70 -1.06 115.31 120.75 2b6e h LEU 61 Ca 0.25 -0.16 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2b6e h LEU 61 Cb -0.04 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.82 2b6e h LEU 61 CO -0.08 0.64 0.08 0.00 -0.34 0.00 0.00 178.44 178.74 2b6e h ALA 62 N 1.04 0.16 -0.51 1.25 0.00 -0.26 -1.73 119.26 119.21 2b6e h ALA 62 Ca 0.16 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 2b6e h ALA 62 Cb 0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 2b6e h ALA 62 CO -0.01 -0.35 0.19 1.49 0.00 0.00 0.00 179.25 180.56 2b6e h GLU 63 N 0.17 0.75 0.79 0.00 4.81 -0.52 -1.04 114.58 119.54 2b6e h GLU 63 Ca 0.05 -0.12 -0.04 0.00 -0.13 0.00 0.00 59.36 59.12 2b6e h GLU 63 Cb -0.01 -0.13 0.01 0.00 0.63 0.00 0.00 28.75 29.24 2b6e h GLU 63 CO -0.01 0.63 -0.38 1.15 -0.73 0.00 0.00 179.01 179.67 2b6e h THR 64 N 0.74 0.20 -0.25 0.32 2.02 -0.69 -0.64 112.91 114.61 2b6e h THR 64 Ca 0.17 -0.05 -0.11 0.00 0.77 0.00 0.00 66.41 67.19 2b6e h THR 64 Cb 0.18 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 2b6e h THR 64 CO -0.01 0.00 -0.32 -0.29 0.37 0.00 0.00 175.52 175.27 2b6e h ILE 65 N -1.10 1.28 -0.49 3.11 6.09 -1.26 -1.96 117.51 123.19 2b6e h ILE 65 Ca -0.11 -1.42 -0.12 0.00 -1.37 0.00 0.00 64.86 61.84 2b6e h ILE 65 Cb 0.82 1.45 -0.02 0.00 0.47 0.00 0.00 36.82 39.54 2b6e h ILE 65 CO 0.18 0.45 -0.16 1.23 -3.07 0.00 0.00 178.15 176.78 2b6e h GLY 66 N 1.05 1.04 1.30 8.18 0.00 -1.18 -0.88 103.07 112.57 2b6e h GLY 66 Ca 0.05 -0.87 -0.16 0.00 0.00 0.00 0.00 47.33 46.35 2b6e h GLY 66 CO 0.06 0.80 -0.44 1.76 0.00 0.00 0.00 176.54 178.72 2b6e h SER 67 N 0.84 0.82 -0.18 0.19 0.02 -0.98 -1.66 113.55 112.60 2b6e h SER 67 Ca 0.12 -0.39 -0.02 0.00 -0.84 0.00 0.00 61.79 60.66 2b6e h SER 67 Cb 0.72 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.02 2b6e h SER 67 CO 0.06 1.14 0.02 0.25 -1.14 0.00 0.00 176.83 177.16 2b6e h LEU 68 N 0.61 0.30 -0.53 5.07 5.85 -1.27 -2.33 115.31 123.00 2b6e h LEU 68 Ca 0.04 -0.27 0.07 0.00 0.84 0.00 0.00 57.88 58.56 2b6e h LEU 68 Cb 1.01 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 41.90 2b6e h LEU 68 CO 0.10 0.49 0.21 0.00 -0.34 0.00 0.00 178.44 178.90 2b6e h ALA 69 N 0.81 0.67 -0.72 1.25 0.00 -1.08 -1.78 119.26 118.42 2b6e h ALA 69 Ca 0.06 0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2b6e h ALA 69 Cb 0.33 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.10 2b6e h ALA 69 CO 0.00 -0.18 0.48 0.78 0.00 0.00 0.00 179.25 180.33 2b6e h GLY 70 N 0.40 1.01 1.70 0.00 0.00 -1.15 -2.61 103.07 102.43 2b6e h GLY 70 Ca 0.26 -0.38 -0.12 0.00 0.00 0.00 0.00 47.33 47.09 2b6e h GLY 70 CO -0.24 0.37 -0.42 1.48 0.00 0.00 0.00 176.54 177.72 2b6e h SER 71 N 0.97 0.35 0.68 0.19 4.64 -1.00 -2.42 113.55 116.96 2b6e h SER 71 Ca 0.26 -0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2b6e h SER 71 Cb -0.11 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 61.88 2b6e h SER 71 CO -0.06 0.74 0.00 0.18 -0.87 0.00 0.00 176.83 176.82 2b6e n LEU 72 N -4.01 0.34 -0.86 5.97 4.77 -0.71 -2.21 117.00 120.28 2b6e n LEU 72 Ca -0.02 0.58 0.11 0.00 -0.03 0.00 0.00 56.01 56.65 2b6e n LEU 72 Cb 0.50 -0.52 0.28 0.00 -2.33 0.00 0.00 43.42 41.35 2b6e n LEU 72 CO 0.43 -0.37 0.73 0.00 -1.33 0.00 0.00 177.39 176.85 2b6e s LEU 74 N -1.42 2.80 0.90 0.00 1.43 -0.94 -4.56 118.68 116.88 2b6e s LEU 74 Ca 0.35 -0.74 -0.11 0.00 -1.03 0.00 0.00 54.13 52.60 2b6e s LEU 74 Cb 0.19 -1.45 0.13 0.00 0.03 0.00 0.00 46.19 45.10 2b6e s LEU 74 CO 0.28 0.08 1.10 -1.61 0.23 0.00 0.00 176.35 176.43 2b6e s GLU 75 N -3.03 1.21 0.82 1.70 2.02 -1.26 -3.92 118.70 116.24 2b6e s GLU 75 Ca 0.26 1.13 -0.13 0.00 0.02 0.00 0.00 54.97 56.24 2b6e s GLU 75 Cb -0.08 -1.78 0.09 0.00 0.10 0.00 0.00 34.13 32.46 2b6e s GLU 75 CO 0.14 -2.36 1.20 -1.21 0.02 0.00 0.00 175.26 173.05 2b6e s GLU 76 N -4.79 1.56 0.00 1.61 0.41 -1.26 -2.49 118.70 113.74 2b6e s GLU 76 Ca 0.64 1.73 0.00 0.00 -0.41 0.00 0.00 54.97 56.93 2b6e s GLU 76 Cb -0.20 -1.77 0.00 0.00 -1.78 0.00 0.00 34.13 30.38 2b6e s GLU 76 CO 0.58 -2.26 0.00 0.41 -0.49 0.00 0.00 175.26 173.50 2b6e n GLY 77 N 0.43 1.41 3.23 -1.39 0.00 -1.26 -5.02 105.19 102.60 2b6e n GLY 77 Ca 0.13 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.98 2b6e n GLY 77 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b6e s LYS 78 N -0.43 0.99 0.09 1.61 1.02 -1.04 -1.69 119.74 120.30 2b6e s LYS 78 Ca 0.00 -1.22 -0.02 0.00 0.02 0.00 0.00 55.97 54.75 2b6e s LYS 78 Cb 0.00 -0.83 0.01 0.00 -0.52 0.00 0.00 37.83 36.48 2b6e s LYS 78 CO 0.00 0.16 0.16 -2.37 -0.92 0.00 0.00 175.35 172.38 2b6e n THR 79 N 0.54 0.00 -4.41 2.17 5.66 -0.58 -4.81 114.28 112.85 2b6e n THR 79 Ca -0.16 -0.35 -0.21 0.00 -3.05 0.00 0.00 64.05 60.28 2b6e n THR 79 Cb 0.57 0.26 -0.10 0.00 -1.55 0.00 0.00 70.33 69.51 2b6e n THR 79 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 2b6e s VAL 80 N -2.65 1.94 -0.05 1.08 -7.23 -1.26 -0.70 120.40 111.53 2b6e s VAL 80 Ca 0.06 -2.24 0.02 0.00 -1.81 0.00 0.00 61.98 58.01 2b6e s VAL 80 Cb -0.01 -2.26 0.01 0.00 0.56 0.00 0.00 36.38 34.69 2b6e s VAL 80 CO 0.04 -0.44 -0.10 -0.69 -0.31 0.00 0.00 175.10 173.60 2b6e s VAL 81 N -2.84 0.92 -0.02 1.32 1.01 0.03 -4.93 120.40 115.89 2b6e s VAL 81 Ca 0.27 -0.38 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 2b6e s VAL 81 Cb -0.00 -0.85 -0.05 0.00 0.00 0.00 0.00 36.38 35.48 2b6e s VAL 81 CO 0.11 0.30 1.32 -0.83 0.00 0.00 0.00 175.10 176.00 2b6e s GLY 82 N 0.58 1.96 -0.24 4.51 0.00 -1.26 -0.70 107.32 112.18 2b6e s GLY 82 Ca -0.11 0.78 -0.17 0.00 0.00 0.00 0.00 44.72 45.22 2b6e s GLY 82 CO 0.02 2.39 -0.11 1.04 0.00 0.00 0.00 173.10 176.44 2b6e n LEU 83 N 5.28 1.91 -3.50 0.66 4.32 0.01 -4.92 117.00 120.76 2b6e n LEU 83 Ca 0.12 0.39 -0.11 0.00 -0.02 0.00 0.00 56.01 56.39 2b6e n LEU 83 Cb 0.45 -0.88 -0.03 0.00 -1.62 0.00 0.00 43.42 41.34 2b6e n LEU 83 CO 0.57 0.34 0.35 1.51 -1.22 0.00 0.00 177.39 178.95 2b6e s ASP 84 N -7.04 -0.47 -0.05 -1.43 1.47 -1.13 -5.02 116.67 103.01 2b6e s ASP 84 Ca -0.33 -0.12 -0.21 0.00 1.18 0.00 0.00 52.55 53.07 2b6e s ASP 84 Cb 0.10 0.58 0.04 0.00 -0.34 0.00 0.00 42.92 43.31 2b6e s ASP 84 CO 0.51 -0.98 0.47 -0.51 0.68 0.00 0.00 175.17 175.34 2b6e s ILE 85 N -3.78 0.03 0.11 2.11 2.07 -1.26 -1.20 121.20 119.28 2b6e s ILE 85 Ca 0.02 -0.25 -0.00 0.00 -1.41 0.00 0.00 60.65 59.01 2b6e s ILE 85 Cb -0.01 -0.77 -0.04 0.00 0.13 0.00 0.00 42.46 41.78 2b6e s ILE 85 CO -0.11 -0.14 0.02 0.54 -1.91 0.00 0.00 174.94 173.34 2b6e s ASN 86 N -1.10 0.54 -0.09 4.50 2.20 -0.83 -5.00 114.94 115.16 2b6e s ASN 86 Ca -0.11 -1.13 -0.30 0.00 -0.94 0.00 0.00 52.86 50.37 2b6e s ASN 86 Cb -0.03 0.23 0.10 0.00 -2.00 0.00 0.00 41.25 39.55 2b6e s ASN 86 CO 0.06 -0.65 0.83 0.00 -2.94 0.00 0.00 177.10 174.40 2b6e s ALA 87 N -3.93 -1.84 -0.11 3.54 0.00 -1.26 -2.06 121.76 116.11 2b6e s ALA 87 Ca 0.19 1.39 0.04 0.00 0.00 0.00 0.00 51.96 53.57 2b6e s ALA 87 Cb 0.07 -0.26 -0.00 0.00 0.00 0.00 0.00 23.12 22.93 2b6e s ALA 87 CO -0.02 -0.38 -0.23 -0.80 0.00 0.00 0.00 175.76 174.34 2b6e s ASN 88 N -1.30 3.16 -0.29 0.00 -0.87 -0.41 -4.99 114.94 110.24 2b6e s ASN 88 Ca -0.05 -0.55 -0.17 0.00 -1.57 0.00 0.00 52.86 50.52 2b6e s ASN 88 Cb -0.00 -1.43 -0.02 0.00 -0.02 0.00 0.00 41.25 39.78 2b6e s ASN 88 CO 0.04 0.15 0.48 -1.00 -2.57 0.00 0.00 177.10 174.21 2b6e s HIS 89 N 0.38 3.23 -0.09 2.20 3.76 -1.26 -2.28 115.29 121.23 2b6e s HIS 89 Ca -0.18 0.44 0.08 0.00 -0.15 0.00 0.00 55.06 55.26 2b6e s HIS 89 Cb -0.18 -2.75 -0.24 0.00 1.11 0.00 0.00 32.58 30.53 2b6e s HIS 89 CO 0.08 -0.35 0.49 1.28 -0.85 0.00 0.00 174.74 175.39 2b6e n LEU 90 N 5.56 1.27 -3.48 0.89 4.77 -0.07 -5.00 117.00 120.94 2b6e n LEU 90 Ca -0.05 0.30 -0.14 0.00 -0.03 0.00 0.00 56.01 56.09 2b6e n LEU 90 Cb 0.50 -0.14 -0.04 0.00 -2.33 0.00 0.00 43.42 41.41 2b6e n LEU 90 CO 0.41 0.53 0.48 0.00 -1.33 0.00 0.00 177.39 177.48 2b6e s ARG 91 N -2.57 1.08 0.46 3.23 1.70 -1.22 -5.03 118.95 116.60 2b6e s ARG 91 Ca -0.11 -0.10 -0.21 0.00 -0.47 0.00 0.00 55.73 54.84 2b6e s ARG 91 Cb 0.07 0.50 -0.08 0.00 -0.57 0.00 0.00 34.95 34.87 2b6e s ARG 91 CO 0.80 -0.41 1.05 -1.25 -1.08 0.00 0.00 175.30 174.41 2b6e s PRO 92 N -2.41 3.87 -0.10 3.89 0.04 -1.26 -4.84 135.00 134.20 2b6e s PRO 92 Ca -0.04 1.42 0.02 0.00 0.04 0.00 0.00 61.00 62.45 2b6e s PRO 92 Cb -0.01 -2.21 0.01 0.00 0.04 0.00 0.00 34.50 32.33 2b6e s PRO 92 CO -0.02 -0.38 -0.16 0.08 0.04 0.00 0.00 177.00 176.57 2b6e s VAL 93 N -1.88 1.49 -0.22 -0.36 1.01 -1.26 -5.00 120.40 114.18 2b6e s VAL 93 Ca 0.65 -0.65 0.11 0.00 0.00 0.00 0.00 61.98 62.09 2b6e s VAL 93 Cb -0.18 -1.35 -0.16 0.00 0.00 0.00 0.00 36.38 34.69 2b6e s VAL 93 CO 0.23 0.44 0.34 0.54 0.00 0.00 0.00 175.10 176.64 2b6e n ARG 94 N 4.03 1.53 -3.87 2.72 1.74 -1.26 0.13 116.66 121.68 2b6e n ARG 94 Ca -0.20 -0.06 -0.09 0.00 -0.77 0.00 0.00 57.85 56.73 2b6e n ARG 94 Cb 0.52 -1.18 -0.01 0.00 -1.02 0.00 0.00 32.46 30.77 2b6e n ARG 94 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2b6e s SER 95 N -2.82 -0.03 0.07 0.55 1.04 -1.26 -4.88 113.70 106.37 2b6e s SER 95 Ca -0.01 -0.95 0.00 0.00 0.48 0.00 0.00 55.95 55.47 2b6e s SER 95 Cb 0.08 0.76 0.00 0.00 0.10 0.00 0.00 66.02 66.96 2b6e s SER 95 CO 0.47 -1.48 0.00 0.61 0.98 0.00 0.00 173.24 173.83 2b6e n GLY 96 N -0.49 -1.10 3.37 7.32 0.00 -1.26 -4.83 105.19 108.21 2b6e n GLY 96 Ca -0.05 -1.23 -0.26 0.00 0.00 0.00 0.00 46.02 44.47 2b6e n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b6e s LYS 97 N 0.00 1.36 0.17 1.61 1.02 -1.26 -0.98 119.74 121.67 2b6e s LYS 97 Ca 0.00 -1.38 0.06 0.00 0.02 0.00 0.00 55.97 54.67 2b6e s LYS 97 Cb 0.00 -1.69 -0.04 0.00 -0.52 0.00 0.00 37.83 35.58 2b6e s LYS 97 CO 0.00 0.38 0.09 0.14 -0.92 0.00 0.00 175.35 175.04 2b6e s VAL 98 N -1.45 4.22 -0.13 3.17 -7.23 -1.26 -3.33 120.40 114.39 2b6e s VAL 98 Ca 0.15 -1.20 0.01 0.00 -1.81 0.00 0.00 61.98 59.14 2b6e s VAL 98 Cb -0.09 -3.15 0.02 0.00 0.56 0.00 0.00 36.38 33.72 2b6e s VAL 98 CO 0.07 -0.11 -0.16 -0.89 -0.31 0.00 0.00 175.10 173.70 2b6e s THR 99 N -1.75 1.63 -0.20 5.32 2.01 0.15 -4.35 115.64 118.45 2b6e s THR 99 Ca 0.30 -0.70 -0.08 0.00 0.31 0.00 0.00 61.69 61.52 2b6e s THR 99 Cb -0.10 -1.49 -0.04 0.00 0.01 0.00 0.00 72.50 70.89 2b6e s THR 99 CO 0.22 0.47 0.07 0.00 -0.69 0.00 0.00 174.62 174.69 2b6e s ALA 100 N 1.09 3.37 -0.17 7.40 0.00 -0.17 -0.88 121.76 132.41 2b6e s ALA 100 Ca -0.03 -0.84 -0.02 0.00 0.00 0.00 0.00 51.96 51.06 2b6e s ALA 100 Cb -0.14 -2.00 -0.01 0.00 0.00 0.00 0.00 23.12 20.97 2b6e s ALA 100 CO -0.04 -0.00 -0.08 0.50 0.00 0.00 0.00 175.76 176.13 2b6e s ARG 101 N 0.71 3.42 -0.20 0.00 3.52 -0.07 -1.89 118.95 124.44 2b6e s ARG 101 Ca 0.04 -0.64 -0.08 0.00 -0.13 0.00 0.00 55.73 54.92 2b6e s ARG 101 Cb -0.13 -2.82 -0.04 0.00 -1.56 0.00 0.00 34.95 30.40 2b6e s ARG 101 CO 0.02 0.06 0.09 0.00 -0.81 0.00 0.00 175.30 174.65 2b6e s ALA 102 N 0.79 3.48 0.01 6.12 0.00 0.01 -2.03 121.76 130.14 2b6e s ALA 102 Ca -0.03 -0.78 0.02 0.00 0.00 0.00 0.00 51.96 51.17 2b6e s ALA 102 Cb -0.15 -2.04 -0.01 0.00 0.00 0.00 0.00 23.12 20.92 2b6e s ALA 102 CO 0.01 0.08 -0.08 0.95 0.00 0.00 0.00 175.76 176.72 2b6e s THR 103 N 0.55 0.59 0.35 0.00 -4.23 -0.35 -2.38 115.64 110.17 2b6e s THR 103 Ca 0.05 -0.60 -0.27 0.00 -1.18 0.00 0.00 61.69 59.70 2b6e s THR 103 Cb -0.12 -0.55 -0.09 0.00 1.34 0.00 0.00 72.50 73.07 2b6e s THR 103 CO 0.01 -0.02 1.09 -2.16 -0.54 0.00 0.00 174.62 172.99 2b6e s PRO 104 N -0.68 4.36 -0.22 3.99 0.04 -1.26 -0.86 135.00 140.35 2b6e s PRO 104 Ca -0.01 1.69 -0.07 0.00 0.04 0.00 0.00 61.00 62.64 2b6e s PRO 104 Cb -0.05 -2.85 -0.11 0.00 0.04 0.00 0.00 34.50 31.53 2b6e s PRO 104 CO 0.00 -0.01 -0.26 -0.89 0.04 0.00 0.00 177.00 175.88 2b6e n ILE 105 N 0.50 1.22 -3.66 0.56 5.41 0.12 -4.83 119.36 118.69 2b6e n ILE 105 Ca 0.02 -0.36 -0.09 0.00 1.00 0.00 0.00 62.75 63.33 2b6e n ILE 105 Cb 0.47 -1.63 -0.08 0.00 -0.71 0.00 0.00 39.64 37.68 2b6e n ILE 105 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 2b6e s ASN 106 N -6.72 -0.78 -0.35 4.38 3.84 -0.91 -4.99 114.94 109.41 2b6e s ASN 106 Ca -0.30 1.28 0.01 0.00 0.21 0.00 0.00 52.86 54.06 2b6e s ASN 106 Cb 0.11 1.16 0.09 0.00 -0.55 0.00 0.00 41.25 42.06 2b6e s ASN 106 CO 0.42 -0.22 0.08 -0.76 -2.79 0.00 0.00 177.10 173.83 2b6e s LEU 107 N 1.49 4.67 0.57 3.21 1.43 -1.26 -0.39 118.68 128.40 2b6e s LEU 107 Ca -0.09 -1.90 0.08 0.00 -1.03 0.00 0.00 54.13 51.18 2b6e s LEU 107 Cb -0.06 -1.70 0.07 0.00 0.03 0.00 0.00 46.19 44.53 2b6e s LEU 107 CO -0.16 -0.40 0.65 -0.83 0.23 0.00 0.00 176.35 175.84 2b6e s GLY 108 N 1.29 1.98 0.26 -3.19 0.00 0.26 -5.02 107.32 102.91 2b6e s GLY 108 Ca 0.06 -1.80 0.04 0.00 0.00 0.00 0.00 44.72 43.02 2b6e s GLY 108 CO -0.05 -1.80 1.64 3.21 0.00 0.00 0.00 173.10 176.10 2b6e h ARG 109 N 0.37 0.31 0.00 2.90 -0.00 -2.01 -3.35 114.38 112.60 2b6e h ARG 109 Ca -0.32 -0.16 -0.01 0.00 -0.50 0.00 0.00 59.98 58.98 2b6e h ARG 109 Cb 1.30 0.01 -0.00 0.00 0.00 0.00 0.00 29.97 31.27 2b6e h ARG 109 CO 0.47 0.71 -1.29 0.09 0.00 0.00 0.00 179.97 179.95 2b6e n ASN 110 N -3.99 3.63 -4.00 7.04 3.02 -1.26 -4.75 115.26 114.95 2b6e n ASN 110 Ca -0.02 0.00 -0.16 0.00 -0.03 0.00 0.00 54.58 54.38 2b6e n ASN 110 Cb 0.52 1.19 -0.14 0.00 -0.61 0.00 0.00 39.78 40.74 2b6e n ASN 110 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2b6e s ILE 111 N -2.38 0.50 0.04 2.41 -1.09 -1.26 -1.39 121.20 118.04 2b6e s ILE 111 Ca -0.02 -0.45 0.07 0.00 -2.23 0.00 0.00 60.65 58.02 2b6e s ILE 111 Cb 0.04 -0.46 -0.02 0.00 -1.58 0.00 0.00 42.46 40.43 2b6e s ILE 111 CO 0.25 0.02 -0.20 -1.10 -1.23 0.00 0.00 174.94 172.67 2b6e s GLN 112 N -0.48 1.38 -0.11 2.79 -0.21 -0.18 -0.57 119.66 122.28 2b6e s GLN 112 Ca -0.00 -0.91 0.01 0.00 0.02 0.00 0.00 55.36 54.47 2b6e s GLN 112 Cb -0.04 -1.48 0.02 0.00 1.00 0.00 0.00 33.01 32.51 2b6e s GLN 112 CO -0.00 0.38 -0.13 0.08 -2.12 0.00 0.00 175.29 173.50 2b6e s VAL 113 N -0.78 1.35 0.11 1.09 1.01 0.48 -0.26 120.40 123.40 2b6e s VAL 113 Ca 0.07 -0.53 0.11 0.00 0.00 0.00 0.00 61.98 61.62 2b6e s VAL 113 Cb -0.09 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 2b6e s VAL 113 CO 0.02 0.41 -0.27 0.26 0.00 0.00 0.00 175.10 175.52 2b6e s TRP 114 N 1.20 2.30 -0.15 5.22 0.52 0.42 -0.70 118.94 127.75 2b6e s TRP 114 Ca -0.03 -0.39 -0.05 0.00 0.02 0.00 0.00 56.10 55.66 2b6e s TRP 114 Cb -0.14 -1.27 -0.03 0.00 -1.15 0.00 0.00 33.47 30.87 2b6e s TRP 114 CO -0.04 0.29 0.01 -1.14 0.02 0.00 0.00 176.95 176.09 2b6e s GLN 115 N -1.88 3.66 -0.15 4.98 0.74 -0.04 -0.86 119.66 126.12 2b6e s GLN 115 Ca 0.13 -0.43 -0.01 0.00 0.05 0.00 0.00 55.36 55.10 2b6e s GLN 115 Cb -0.10 -3.01 0.04 0.00 1.10 0.00 0.00 33.01 31.04 2b6e s GLN 115 CO 0.05 0.34 -0.03 0.42 -0.55 0.00 0.00 175.29 175.53 2b6e s ILE 116 N 0.12 0.85 -0.12 -2.34 1.09 -0.02 -1.21 121.20 119.57 2b6e s ILE 116 Ca 0.02 -0.45 -0.01 0.00 -1.10 0.00 0.00 60.65 59.11 2b6e s ILE 116 Cb -0.13 -1.08 -0.02 0.00 -1.06 0.00 0.00 42.46 40.17 2b6e s ILE 116 CO 0.02 0.11 -0.08 -1.81 -0.10 0.00 0.00 174.94 173.08 2b6e s ASP 117 N 1.75 4.49 -0.16 3.58 1.01 -0.86 -0.45 116.67 126.03 2b6e s ASP 117 Ca 0.02 -0.16 -0.02 0.00 0.71 0.00 0.00 52.55 53.09 2b6e s ASP 117 Cb -0.15 -1.52 -0.02 0.00 1.01 0.00 0.00 42.92 42.25 2b6e s ASP 117 CO -0.07 0.23 -0.08 -0.63 0.21 0.00 0.00 175.17 174.83 2b6e s ILE 118 N -0.02 3.41 0.23 0.77 1.01 0.19 -0.90 121.20 125.91 2b6e s ILE 118 Ca -0.01 -0.52 0.11 0.00 0.00 0.00 0.00 60.65 60.23 2b6e s ILE 118 Cb -0.14 -2.48 -0.05 0.00 0.01 0.00 0.00 42.46 39.81 2b6e s ILE 118 CO 0.03 0.49 -0.21 -0.13 0.00 0.00 0.00 174.94 175.12 2b6e s ARG 119 N 0.58 1.57 0.82 2.79 0.52 -0.05 -0.66 118.95 124.50 2b6e s ARG 119 Ca -0.05 -1.63 -0.07 0.00 -0.52 0.00 0.00 55.73 53.45 2b6e s ARG 119 Cb -0.15 -1.74 0.15 0.00 0.52 0.00 0.00 34.95 33.73 2b6e s ARG 119 CO 0.03 0.35 1.13 0.95 0.02 0.00 0.00 175.30 177.78 2b6e s THR 120 N -2.14 2.09 -0.02 0.02 -4.23 0.39 -0.67 115.64 111.07 2b6e s THR 120 Ca 0.25 -0.33 0.30 0.00 -1.18 0.00 0.00 61.69 60.73 2b6e s THR 120 Cb -0.06 -2.76 0.33 0.00 1.34 0.00 0.00 72.50 71.35 2b6e s THR 120 CO 0.12 0.00 1.92 1.05 -0.54 0.00 0.00 174.62 177.16 2b6e h GLU 121 N -0.98 0.00 -0.34 3.99 4.11 -1.88 0.18 114.58 119.65 2b6e h GLU 121 Ca -0.40 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.03 2b6e h GLU 121 Cb 1.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.51 2b6e h GLU 121 CO 0.41 0.00 0.00 0.39 0.07 0.00 0.00 179.01 179.88 2b6e n GLU 122 N -2.67 2.00 -2.11 1.06 -0.58 -1.26 -4.91 120.64 112.17 2b6e n GLU 122 Ca -0.00 -1.53 -0.15 0.00 -0.42 0.00 0.00 57.16 55.06 2b6e n GLU 122 Cb 0.18 -1.39 -0.02 0.00 -0.57 0.00 0.00 31.44 29.65 2b6e n GLU 122 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2b6e n ASN 123 N 0.74 -4.59 -4.82 1.62 3.02 0.62 -5.00 115.26 106.85 2b6e n ASN 123 Ca 0.16 0.06 -0.37 0.00 -0.03 0.00 0.00 54.58 54.40 2b6e n ASN 123 Cb 0.39 -3.67 -0.06 0.00 -0.61 0.00 0.00 39.78 35.83 2b6e n ASN 123 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2b6e s LYS 124 N -4.45 3.86 -0.10 3.52 1.02 -1.26 -4.77 119.74 117.57 2b6e s LYS 124 Ca 0.00 0.14 -0.30 0.00 0.02 0.00 0.00 55.97 55.83 2b6e s LYS 124 Cb 0.00 -3.27 -0.03 0.00 -0.52 0.00 0.00 37.83 34.01 2b6e s LYS 124 CO 0.00 0.59 1.40 -1.17 -0.92 0.00 0.00 175.35 175.25 2b6e s LEU 125 N -0.61 4.25 -0.01 3.17 2.96 -1.26 -0.46 118.68 126.72 2b6e s LEU 125 Ca 0.19 1.93 0.09 0.00 -0.22 0.00 0.00 54.13 56.12 2b6e s LEU 125 Cb -0.14 -3.54 -0.13 0.00 0.50 0.00 0.00 46.19 42.88 2b6e s LEU 125 CO 0.07 -0.80 0.29 0.00 -1.32 0.00 0.00 176.35 174.59 2b6e s VAL 128 N 0.37 1.51 0.03 0.00 -7.23 -0.97 -0.63 120.40 113.48 2b6e s VAL 128 Ca -0.00 -0.76 -0.02 0.00 -1.81 0.00 0.00 61.98 59.39 2b6e s VAL 128 Cb -0.05 -1.30 -0.02 0.00 0.56 0.00 0.00 36.38 35.58 2b6e s VAL 128 CO 0.00 0.43 0.01 -0.55 -0.31 0.00 0.00 175.10 174.68 2b6e s SER 129 N 0.04 0.28 -0.04 4.85 0.15 0.41 -1.29 113.70 118.11 2b6e s SER 129 Ca -0.04 -0.62 0.02 0.00 0.70 0.00 0.00 55.95 56.00 2b6e s SER 129 Cb -0.12 0.16 0.01 0.00 -1.71 0.00 0.00 66.02 64.36 2b6e s SER 129 CO 0.03 -0.43 -0.10 -0.60 1.20 0.00 0.00 173.24 173.34 2b6e s ARG 130 N -2.36 1.13 -0.06 5.44 3.52 -0.87 -0.84 118.95 124.91 2b6e s ARG 130 Ca -0.07 -0.32 0.05 0.00 -0.13 0.00 0.00 55.73 55.26 2b6e s ARG 130 Cb -0.03 -1.02 -0.01 0.00 -1.56 0.00 0.00 34.95 32.33 2b6e s ARG 130 CO -0.04 0.08 -0.22 -1.17 -0.81 0.00 0.00 175.30 173.14 2b6e s LEU 131 N 0.36 2.01 -0.16 -0.88 2.96 -0.04 -1.97 118.68 120.96 2b6e s LEU 131 Ca -0.06 -0.46 -0.02 0.00 -0.22 0.00 0.00 54.13 53.37 2b6e s LEU 131 Cb -0.11 -1.23 -0.02 0.00 0.50 0.00 0.00 46.19 45.34 2b6e s LEU 131 CO 0.01 0.20 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.28 2b6e s THR 132 N -0.05 3.39 0.14 3.68 2.01 -0.34 -0.43 115.64 124.04 2b6e s THR 132 Ca -0.05 -0.52 0.11 0.00 0.31 0.00 0.00 61.69 61.54 2b6e s THR 132 Cb -0.13 -2.48 -0.04 0.00 0.01 0.00 0.00 72.50 69.86 2b6e s THR 132 CO 0.03 0.49 -0.26 -0.76 -0.69 0.00 0.00 174.62 173.43 2b6e s LEU 133 N 0.69 2.35 -0.13 4.42 1.43 0.65 -0.81 118.68 127.27 2b6e s LEU 133 Ca -0.04 -0.77 -0.04 0.00 -1.03 0.00 0.00 54.13 52.24 2b6e s LEU 133 Cb -0.15 -1.17 -0.03 0.00 0.03 0.00 0.00 46.19 44.86 2b6e s LEU 133 CO 0.02 0.15 0.02 -0.55 0.23 0.00 0.00 176.35 176.22 2b6e s SER 134 N -2.20 5.34 -0.13 2.29 0.15 0.12 -1.01 113.70 118.26 2b6e s SER 134 Ca 0.15 0.08 -0.19 0.00 0.70 0.00 0.00 55.95 56.70 2b6e s SER 134 Cb -0.09 -1.74 -0.04 0.00 -1.71 0.00 0.00 66.02 62.44 2b6e s SER 134 CO 0.07 0.27 0.51 -0.69 1.20 0.00 0.00 173.24 174.59 2b6e s VAL 135 N -0.21 5.16 0.09 4.45 1.01 -0.49 -0.79 120.40 129.62 2b6e s VAL 135 Ca 0.06 1.00 0.07 0.00 0.00 0.00 0.00 61.98 63.11 2b6e s VAL 135 Cb -0.12 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 2b6e s VAL 135 CO 0.02 0.29 -0.18 0.27 0.00 0.00 0.00 175.10 175.50 2b6e s ILE 136 N 0.82 1.49 -0.34 2.22 -4.36 0.12 -4.88 121.20 116.27 2b6e s ILE 136 Ca 0.27 -1.44 -0.14 0.00 -0.26 0.00 0.00 60.65 59.08 2b6e s ILE 136 Cb -0.15 -1.37 -0.01 0.00 1.25 0.00 0.00 42.46 42.17 2b6e s ILE 136 CO 0.11 -0.11 0.32 0.20 0.24 0.00 0.00 174.94 175.71 2b6e s ASN 137 N -1.81 6.14 0.23 4.36 0.01 -1.26 -1.53 114.94 121.08 2b6e s ASN 137 Ca 0.03 -0.30 0.15 0.00 -0.71 0.00 0.00 52.86 52.03 2b6e s ASN 137 Cb -0.10 -2.18 0.79 0.00 0.41 0.00 0.00 41.25 40.17 2b6e s ASN 137 CO 0.03 -0.31 1.43 0.18 -1.51 0.00 0.00 177.10 176.92 2b6e n LEU 138 N 5.29 0.38 -0.48 0.60 4.77 -0.68 -5.02 117.00 121.86 2b6e n LEU 138 Ca -0.10 0.66 0.14 0.00 -0.03 0.00 0.00 56.01 56.68 2b6e n LEU 138 Cb 0.49 -0.70 0.53 0.00 -2.33 0.00 0.00 43.42 41.42 2b6e n LEU 138 CO 0.39 -0.79 0.87 -0.11 -1.33 0.00 0.00 177.39 176.43