#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2b15 n PRO 11 N 0.00 0.49 -3.75 0.00 -0.04 -1.26 -4.74 135.00 125.70 2b15 n PRO 11 Ca 0.00 0.00 -0.19 0.00 -0.04 0.00 0.00 63.50 63.27 2b15 n PRO 11 Cb 0.00 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 31.79 2b15 n PRO 11 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2b15 s LEU 12 N -2.51 0.56 0.00 1.53 2.96 -1.26 -0.39 118.68 119.58 2b15 s LEU 12 Ca 0.31 0.03 0.03 0.00 -0.22 0.00 0.00 54.13 54.27 2b15 s LEU 12 Cb 0.20 -0.19 -0.01 0.00 0.50 0.00 0.00 46.19 46.70 2b15 s LEU 12 CO 0.45 -0.19 -0.09 -0.32 -1.32 0.00 0.00 176.35 174.88 2b15 s MET 13 N 1.73 0.68 -0.07 1.98 -2.45 0.06 -4.44 119.30 116.79 2b15 s MET 13 Ca -0.00 -0.40 0.05 0.00 -1.25 0.00 0.00 55.69 54.09 2b15 s MET 13 Cb -0.12 -0.63 -0.01 0.00 1.25 0.00 0.00 34.83 35.31 2b15 s MET 13 CO -0.03 0.17 -0.22 0.08 1.05 0.00 0.00 175.02 176.07 2b15 s VAL 14 N -0.41 2.31 -0.05 10.11 1.01 -0.78 -0.79 120.40 131.79 2b15 s VAL 14 Ca 0.01 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.05 2b15 s VAL 14 Cb -0.04 -1.87 0.01 0.00 0.00 0.00 0.00 36.38 34.48 2b15 s VAL 14 CO -0.00 0.57 -0.11 -0.75 0.00 0.00 0.00 175.10 174.81 2b15 s LYS 15 N -0.13 1.43 -0.04 2.72 2.20 -0.06 -0.17 119.74 125.69 2b15 s LYS 15 Ca -0.04 -0.37 0.03 0.00 -0.36 0.00 0.00 55.97 55.23 2b15 s LYS 15 Cb -0.14 -1.23 0.00 0.00 -1.51 0.00 0.00 37.83 34.95 2b15 s LYS 15 CO 0.04 0.05 -0.12 0.08 -0.36 0.00 0.00 175.35 175.04 2b15 s VAL 16 N 0.54 1.02 0.18 4.02 1.01 0.05 -1.20 120.40 126.02 2b15 s VAL 16 Ca -0.11 -0.47 0.11 0.00 0.00 0.00 0.00 61.98 61.51 2b15 s VAL 16 Cb -0.14 -0.91 -0.04 0.00 0.00 0.00 0.00 36.38 35.29 2b15 s VAL 16 CO 0.02 0.31 -0.24 -0.76 0.00 0.00 0.00 175.10 174.44 2b15 s LEU 17 N 0.27 2.41 -0.31 3.92 1.43 0.01 -0.95 118.68 125.46 2b15 s LEU 17 Ca -0.06 -0.84 -0.08 0.00 -1.03 0.00 0.00 54.13 52.13 2b15 s LEU 17 Cb -0.11 -1.15 0.01 0.00 0.03 0.00 0.00 46.19 44.97 2b15 s LEU 17 CO 0.02 0.12 0.11 -0.62 0.23 0.00 0.00 176.35 176.21 2b15 s ASP 18 N -2.52 5.29 0.00 2.29 -1.08 0.92 -0.69 116.67 120.88 2b15 s ASP 18 Ca 0.19 -0.68 0.29 0.00 -0.52 0.00 0.00 52.55 51.83 2b15 s ASP 18 Cb -0.08 -1.92 1.35 0.00 -1.46 0.00 0.00 42.92 40.80 2b15 s ASP 18 CO 0.09 -0.21 1.98 0.00 0.52 0.00 0.00 175.17 177.55 2b15 n ALA 19 N 4.91 2.39 -0.02 3.66 0.00 -0.11 -1.23 120.51 130.11 2b15 n ALA 19 Ca -0.14 -0.12 -0.21 0.00 0.00 0.00 0.00 53.44 52.97 2b15 n ALA 19 Cb 0.48 -1.48 -0.13 0.00 0.00 0.00 0.00 19.45 18.32 2b15 n ALA 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 2b15 h VAL 20 N 0.00 0.96 0.00 0.00 2.07 -1.94 -3.39 116.25 113.95 2b15 h VAL 20 Ca 0.00 -2.33 -0.11 0.00 0.82 0.00 0.00 66.70 65.08 2b15 h VAL 20 Cb 0.42 2.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.76 2b15 h VAL 20 CO 0.00 0.64 -1.47 0.54 0.02 0.00 0.00 177.57 177.30 2b15 n ARG 21 N -4.00 0.63 -2.54 1.57 1.74 -1.24 -5.00 116.66 107.81 2b15 n ARG 21 Ca -0.27 0.10 -0.08 0.00 -0.77 0.00 0.00 57.85 56.83 2b15 n ARG 21 Cb 0.85 -1.74 0.04 0.00 -1.02 0.00 0.00 32.46 30.59 2b15 n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2b15 n GLY 22 N 1.34 -0.02 3.42 -0.13 0.00 -0.36 -5.05 105.19 104.38 2b15 n GLY 22 Ca -0.08 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.81 2b15 n GLY 22 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2b15 s SER 23 N -3.45 -0.03 0.62 1.61 0.01 -1.08 -5.00 113.70 106.38 2b15 s SER 23 Ca 0.10 -0.86 -0.19 0.00 1.31 0.00 0.00 55.95 56.32 2b15 s SER 23 Cb -0.01 0.49 -0.02 0.00 0.21 0.00 0.00 66.02 66.68 2b15 s SER 23 CO 0.36 -0.97 1.29 -2.16 0.41 0.00 0.00 173.24 172.17 2b15 s PRO 24 N -3.98 2.74 -0.47 12.44 0.04 -1.26 -0.05 135.00 144.47 2b15 s PRO 24 Ca 0.18 2.06 -0.20 0.00 0.04 0.00 0.00 61.00 63.08 2b15 s PRO 24 Cb 0.02 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.65 2b15 s PRO 24 CO 0.02 -1.45 0.64 0.00 0.04 0.00 0.00 177.00 176.25 2b15 s ALA 25 N -1.41 3.35 0.07 8.56 0.00 -0.12 -4.54 121.76 127.67 2b15 s ALA 25 Ca 0.80 -1.41 -0.09 0.00 0.00 0.00 0.00 51.96 51.26 2b15 s ALA 25 Cb -0.37 -3.32 -0.06 0.00 0.00 0.00 0.00 23.12 19.37 2b15 s ALA 25 CO 0.40 -1.88 0.38 0.42 0.00 0.00 0.00 175.76 175.08 2b15 s ILE 26 N 2.77 5.13 -1.38 0.00 1.01 -1.26 -4.32 121.20 123.15 2b15 s ILE 26 Ca 0.20 0.39 -0.01 0.00 0.00 0.00 0.00 60.65 61.23 2b15 s ILE 26 Cb -0.16 -3.63 0.00 0.00 0.01 0.00 0.00 42.46 38.68 2b15 s ILE 26 CO 0.16 0.28 0.14 0.59 0.00 0.00 0.00 174.94 176.11 2b15 n ASN 27 N 0.89 -5.02 -4.68 3.58 3.02 -0.30 -4.95 115.26 107.80 2b15 n ASN 27 Ca -0.08 -0.08 -0.41 0.00 -0.03 0.00 0.00 54.58 53.99 2b15 n ASN 27 Cb 0.52 -4.05 -0.04 0.00 -0.61 0.00 0.00 39.78 35.60 2b15 n ASN 27 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2b15 s VAL 28 N -2.89 4.95 0.28 2.41 1.01 -1.26 -4.77 120.40 120.13 2b15 s VAL 28 Ca 0.07 1.54 -0.29 0.00 0.00 0.00 0.00 61.98 63.29 2b15 s VAL 28 Cb -0.03 -4.09 -0.09 0.00 0.00 0.00 0.00 36.38 32.16 2b15 s VAL 28 CO 0.08 0.11 1.06 0.00 0.00 0.00 0.00 175.10 176.36 2b15 s ALA 29 N 1.64 3.38 -0.06 5.51 0.00 -1.26 -1.53 121.76 129.44 2b15 s ALA 29 Ca 0.38 0.83 0.01 0.00 0.00 0.00 0.00 51.96 53.17 2b15 s ALA 29 Cb -0.17 -3.30 0.02 0.00 0.00 0.00 0.00 23.12 19.67 2b15 s ALA 29 CO 0.15 -0.09 -0.05 0.08 0.00 0.00 0.00 175.76 175.85 2b15 s VAL 30 N -1.20 0.67 -0.11 0.00 1.01 0.29 -0.93 120.40 120.12 2b15 s VAL 30 Ca 0.44 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.29 2b15 s VAL 30 Cb -0.30 -0.69 -0.00 0.00 0.00 0.00 0.00 36.38 35.39 2b15 s VAL 30 CO 0.38 0.27 -0.21 -1.00 0.00 0.00 0.00 175.10 174.54 2b15 s HIS 31 N 1.10 2.64 -0.09 5.22 3.76 -0.20 -1.26 115.29 126.47 2b15 s HIS 31 Ca -0.08 -0.99 -0.00 0.00 -0.15 0.00 0.00 55.06 53.84 2b15 s HIS 31 Cb -0.14 -1.76 -0.03 0.00 1.11 0.00 0.00 32.58 31.76 2b15 s HIS 31 CO -0.01 -0.40 -0.05 0.08 -0.85 0.00 0.00 174.74 173.51 2b15 s VAL 32 N 0.41 3.82 0.19 -0.90 1.01 0.25 -0.24 120.40 124.93 2b15 s VAL 32 Ca -0.15 -0.43 0.08 0.00 0.00 0.00 0.00 61.98 61.48 2b15 s VAL 32 Cb -0.17 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 2b15 s VAL 32 CO 0.07 0.58 -0.17 -0.36 0.00 0.00 0.00 175.10 175.22 2b15 s PHE 33 N -0.59 1.81 -0.05 5.22 0.40 0.23 -0.59 117.98 124.41 2b15 s PHE 33 Ca 0.09 -0.49 0.03 0.00 -0.60 0.00 0.00 56.93 55.95 2b15 s PHE 33 Cb -0.12 -0.87 0.01 0.00 0.51 0.00 0.00 43.02 42.55 2b15 s PHE 33 CO 0.02 0.37 -0.12 0.50 0.70 0.00 0.00 175.22 176.68 2b15 s ARG 34 N -3.13 1.50 0.11 0.44 3.52 -0.15 -0.87 118.95 120.36 2b15 s ARG 34 Ca 0.19 -0.42 -0.31 0.00 -0.13 0.00 0.00 55.73 55.06 2b15 s ARG 34 Cb -0.04 -1.29 -0.09 0.00 -1.56 0.00 0.00 34.95 31.97 2b15 s ARG 34 CO 0.07 0.10 1.54 0.15 -0.81 0.00 0.00 175.30 176.35 2b15 s LYS 35 N 0.40 4.24 0.70 5.12 1.02 -0.07 -0.81 119.74 130.34 2b15 s LYS 35 Ca -0.09 2.25 -0.02 0.00 0.02 0.00 0.00 55.97 58.13 2b15 s LYS 35 Cb -0.13 -3.36 0.11 0.00 -0.52 0.00 0.00 37.83 33.92 2b15 s LYS 35 CO 0.02 -0.61 0.97 0.00 -0.92 0.00 0.00 175.35 174.82 2b15 s ALA 36 N 1.76 3.60 0.48 5.17 0.00 0.49 -4.71 121.76 128.54 2b15 s ALA 36 Ca 0.70 -1.54 0.16 0.00 0.00 0.00 0.00 51.96 51.28 2b15 s ALA 36 Cb -0.40 -2.13 1.16 0.00 0.00 0.00 0.00 23.12 21.76 2b15 s ALA 36 CO 0.31 -1.36 2.04 0.00 0.00 0.00 0.00 175.76 176.75 2b15 h ALA 37 N -0.49 2.09 -0.07 0.00 0.00 -1.95 0.46 119.26 119.31 2b15 h ALA 37 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2b15 h ALA 37 Cb 1.28 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2b15 h ALA 37 CO 0.44 -0.17 0.00 -0.40 0.00 0.00 0.00 179.25 179.12 2b15 n ASP 38 N -4.47 0.66 -0.12 0.00 5.75 -1.26 -4.89 116.55 112.22 2b15 n ASP 38 Ca 0.05 -1.55 -0.02 0.00 -0.01 0.00 0.00 54.79 53.27 2b15 n ASP 38 Cb 0.31 -0.04 -0.01 0.00 -1.03 0.00 0.00 41.12 40.35 2b15 n ASP 38 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 2b15 n ASP 39 N -0.34 -3.66 -4.96 -1.12 -0.08 0.15 -5.04 116.55 101.50 2b15 n ASP 39 Ca 0.15 0.04 -0.22 0.00 -1.51 0.00 0.00 54.79 53.25 2b15 n ASP 39 Cb 0.17 -1.29 -0.02 0.00 2.34 0.00 0.00 41.12 42.32 2b15 n ASP 39 CO 0.00 0.00 0.00 0.42 0.12 0.00 0.00 177.20 177.74 2b15 s THR 40 N -1.90 5.24 -0.52 5.18 -4.23 -1.26 -4.79 115.64 113.35 2b15 s THR 40 Ca 0.00 -0.90 -0.26 0.00 -1.18 0.00 0.00 61.69 59.35 2b15 s THR 40 Cb 0.00 -3.86 0.03 0.00 1.34 0.00 0.00 72.50 70.01 2b15 s THR 40 CO 0.00 -0.36 1.04 0.26 -0.54 0.00 0.00 174.62 175.01 2b15 s TRP 41 N -2.03 2.79 -0.12 3.99 0.52 -1.26 -0.38 118.94 122.44 2b15 s TRP 41 Ca 0.35 0.34 -0.05 0.00 0.02 0.00 0.00 56.10 56.76 2b15 s TRP 41 Cb -0.09 -4.22 -0.04 0.00 -1.15 0.00 0.00 33.47 27.97 2b15 s TRP 41 CO 0.30 -1.32 0.06 -2.00 0.02 0.00 0.00 176.95 174.01 2b15 s GLU 42 N 4.24 3.41 0.30 4.98 -6.30 0.01 -4.85 118.70 120.49 2b15 s GLU 42 Ca 0.39 -0.31 -0.29 0.00 -2.50 0.00 0.00 54.97 52.26 2b15 s GLU 42 Cb -0.09 -3.03 -0.10 0.00 0.00 0.00 0.00 34.13 30.90 2b15 s GLU 42 CO 0.25 0.60 1.20 -2.14 0.02 0.00 0.00 175.26 175.19 2b15 s PRO 43 N -0.56 4.50 0.00 4.30 0.02 -1.26 -0.98 135.00 141.02 2b15 s PRO 43 Ca 0.11 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.13 2b15 s PRO 43 Cb -0.12 -3.13 0.00 0.00 0.02 0.00 0.00 34.50 31.27 2b15 s PRO 43 CO 0.02 0.01 0.00 0.34 -0.33 0.00 0.00 177.00 177.04 2b15 n PHE 44 N 1.04 0.00 -3.60 6.54 7.35 0.24 -4.72 117.46 124.31 2b15 n PHE 44 Ca -0.00 0.00 -0.07 0.00 -0.76 0.00 0.00 57.45 56.61 2b15 n PHE 44 Cb 0.43 0.11 -0.02 0.00 0.35 0.00 0.00 39.48 40.36 2b15 n PHE 44 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2b15 s ALA 45 N -1.96 -1.68 0.19 3.13 0.00 -0.92 -5.00 121.76 115.52 2b15 s ALA 45 Ca 0.00 0.54 -0.20 0.00 0.00 0.00 0.00 51.96 52.30 2b15 s ALA 45 Cb 0.00 0.60 0.04 0.00 0.00 0.00 0.00 23.12 23.76 2b15 s ALA 45 CO 0.00 -0.84 0.57 -1.54 0.00 0.00 0.00 175.76 173.95 2b15 s SER 46 N -2.71 -0.36 0.00 0.00 1.04 -1.26 0.87 113.70 111.28 2b15 s SER 46 Ca 0.07 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.17 2b15 s SER 46 Cb -0.02 0.60 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2b15 s SER 46 CO -0.05 -1.06 0.00 0.61 0.98 0.00 0.00 173.24 173.72 2b15 n GLY 47 N -0.36 0.51 2.99 7.32 0.00 -0.39 -4.95 105.19 110.31 2b15 n GLY 47 Ca -0.12 -0.76 -0.15 0.00 0.00 0.00 0.00 46.02 44.99 2b15 n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2b15 s LYS 48 N -1.29 0.47 0.50 1.61 1.02 -1.26 -0.55 119.74 120.24 2b15 s LYS 48 Ca 0.00 -0.34 -0.23 0.00 0.02 0.00 0.00 55.97 55.42 2b15 s LYS 48 Cb 0.00 -0.41 -0.06 0.00 -0.52 0.00 0.00 37.83 36.84 2b15 s LYS 48 CO 0.00 0.10 1.29 0.95 -0.92 0.00 0.00 175.35 176.77 2b15 s THR 49 N -0.44 2.48 0.27 2.17 -4.23 -0.58 -4.74 115.64 110.57 2b15 s THR 49 Ca -0.01 0.37 -0.04 0.00 -1.18 0.00 0.00 61.69 60.83 2b15 s THR 49 Cb -0.04 -3.19 0.06 0.00 1.34 0.00 0.00 72.50 70.67 2b15 s THR 49 CO -0.00 0.00 0.36 -1.54 -0.54 0.00 0.00 174.62 172.91 2b15 n SER 50 N -0.69 0.08 0.25 3.99 3.41 -0.09 -1.15 113.62 119.42 2b15 n SER 50 Ca 0.08 -1.16 0.17 0.00 -0.26 0.00 0.00 58.87 57.70 2b15 n SER 50 Cb 0.46 -0.27 0.84 0.00 -0.26 0.00 0.00 64.21 64.97 2b15 n SER 50 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 2b15 h GLU 51 N 0.00 0.00 -0.01 4.33 3.07 -1.94 0.19 114.58 120.22 2b15 h GLU 51 Ca -0.12 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.74 2b15 h GLU 51 Cb 0.34 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 2b15 h GLU 51 CO 0.09 0.00 -0.01 -1.13 -1.40 0.00 0.00 179.01 176.56 2b15 n SER 52 N -2.77 1.31 -0.01 1.42 3.41 -1.26 -4.81 113.62 110.92 2b15 n SER 52 Ca -0.01 -1.42 -0.00 0.00 -0.26 0.00 0.00 58.87 57.18 2b15 n SER 52 Cb 0.14 0.00 -0.00 0.00 -0.26 0.00 0.00 64.21 64.10 2b15 n SER 52 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b15 n GLY 53 N 1.16 0.39 3.74 5.00 0.00 0.06 -4.78 105.19 110.76 2b15 n GLY 53 Ca 0.19 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.89 2b15 n GLY 53 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2b15 s GLU 54 N -0.52 2.73 -0.24 1.61 2.02 -1.26 -0.77 118.70 122.27 2b15 s GLU 54 Ca 0.00 -0.79 -0.01 0.00 0.02 0.00 0.00 54.97 54.19 2b15 s GLU 54 Cb 0.00 -2.62 0.07 0.00 0.10 0.00 0.00 34.13 31.67 2b15 s GLU 54 CO 0.00 0.54 0.00 -1.17 0.02 0.00 0.00 175.26 174.65 2b15 s LEU 55 N -2.48 2.15 0.34 1.80 2.96 0.76 -0.91 118.68 123.30 2b15 s LEU 55 Ca 0.28 -1.17 0.08 0.00 -0.22 0.00 0.00 54.13 53.10 2b15 s LEU 55 Cb -0.12 -0.96 -0.03 0.00 0.50 0.00 0.00 46.19 45.58 2b15 s LEU 55 CO 0.21 -0.29 0.22 -1.00 -1.32 0.00 0.00 176.35 174.16 2b15 s HIS 56 N 1.56 2.79 -0.50 5.38 3.76 -1.26 -1.87 115.29 125.15 2b15 s HIS 56 Ca -0.01 -0.36 0.00 0.00 -0.15 0.00 0.00 55.06 54.54 2b15 s HIS 56 Cb -0.18 -1.74 0.00 0.00 1.11 0.00 0.00 32.58 31.77 2b15 s HIS 56 CO -0.10 0.25 0.00 0.41 -0.85 0.00 0.00 174.74 174.45 2b15 n GLY 57 N -1.27 0.73 0.34 -2.22 0.00 -1.26 -4.91 105.19 96.61 2b15 n GLY 57 Ca -0.02 -0.55 0.02 0.00 0.00 0.00 0.00 46.02 45.47 2b15 n GLY 57 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2b15 h LEU 58 N 0.00 0.78 0.00 0.99 3.38 -1.85 -3.47 115.31 115.14 2b15 h LEU 58 Ca -0.10 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.66 2b15 h LEU 58 Cb 0.39 -0.19 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2b15 h LEU 58 CO 0.14 0.55 -0.02 1.07 0.09 0.00 0.00 178.44 180.28 2b15 n THR 59 N -4.44 0.00 -4.44 0.22 5.66 -1.26 -4.77 114.28 105.25 2b15 n THR 59 Ca 0.08 -1.53 -0.22 0.00 -3.05 0.00 0.00 64.05 59.33 2b15 n THR 59 Cb 0.07 1.06 -0.10 0.00 -1.55 0.00 0.00 70.33 69.81 2b15 n THR 59 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 2b15 s THR 60 N -2.60 2.10 0.33 1.09 -4.23 -1.26 -4.59 115.64 106.47 2b15 s THR 60 Ca 0.25 -2.28 0.05 0.00 -1.18 0.00 0.00 61.69 58.52 2b15 s THR 60 Cb -0.02 -2.29 0.30 0.00 1.34 0.00 0.00 72.50 71.83 2b15 s THR 60 CO 0.18 -0.42 1.88 -0.33 -0.54 0.00 0.00 174.62 175.39 2b15 h GLU 61 N 2.33 0.84 -0.24 3.99 3.07 -1.98 -1.22 114.58 121.36 2b15 h GLU 61 Ca -0.40 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.40 2b15 h GLU 61 Cb 1.24 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.95 2b15 h GLU 61 CO 0.63 0.55 0.12 0.93 -1.40 0.00 0.00 179.01 179.84 2b15 h GLU 62 N 0.86 0.35 0.00 2.33 5.08 -2.04 -3.19 114.58 117.98 2b15 h GLU 62 Ca 0.43 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.64 2b15 h GLU 62 Cb 0.47 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 2b15 h GLU 62 CO -0.19 0.36 -0.46 0.93 -1.00 0.00 0.00 179.01 178.65 2b15 h GLU 63 N 0.26 0.00 -3.81 2.33 4.39 -1.87 -3.39 114.58 112.50 2b15 h GLU 63 Ca 0.08 0.00 -0.74 0.00 0.34 0.00 0.00 59.36 59.04 2b15 h GLU 63 Cb 0.12 0.00 -0.13 0.00 -0.10 0.00 0.00 28.75 28.64 2b15 h GLU 63 CO -0.01 0.46 2.21 0.34 -1.16 0.00 0.00 179.01 180.85 2b15 n PHE 64 N -3.25 3.32 -2.01 4.33 7.35 -0.50 -4.95 117.46 121.75 2b15 n PHE 64 Ca 0.02 -2.88 -0.29 0.00 -0.76 0.00 0.00 57.45 53.53 2b15 n PHE 64 Cb 0.69 -2.13 0.18 0.00 0.35 0.00 0.00 39.48 38.57 2b15 n PHE 64 CO 0.00 0.00 0.00 0.14 -0.76 0.00 0.00 176.76 176.14 2b15 s VAL 65 N 1.23 2.01 0.52 -2.13 -7.23 -1.26 -4.94 120.40 108.60 2b15 s VAL 65 Ca 0.42 -0.07 -0.23 0.00 -1.81 0.00 0.00 61.98 60.29 2b15 s VAL 65 Cb 0.09 -2.94 -0.06 0.00 0.56 0.00 0.00 36.38 34.03 2b15 s VAL 65 CO -0.01 0.00 1.37 1.21 -0.31 0.00 0.00 175.10 177.36 2b15 n GLU 66 N -3.66 1.84 0.00 4.82 0.00 -1.26 -4.81 120.64 117.57 2b15 n GLU 66 Ca 0.15 0.67 0.00 0.00 0.00 0.00 0.00 57.16 57.98 2b15 n GLU 66 Cb 0.60 -2.58 0.00 0.00 0.00 0.00 0.00 31.44 29.45 2b15 n GLU 66 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2b15 n GLY 67 N 0.72 -0.60 3.64 8.31 0.00 -1.03 -5.00 105.19 111.23 2b15 n GLY 67 Ca 0.09 -1.19 -0.37 0.00 0.00 0.00 0.00 46.02 44.55 2b15 n GLY 67 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b15 s ILE 68 N -2.00 5.30 0.13 -0.61 1.01 -1.26 -0.90 121.20 122.87 2b15 s ILE 68 Ca 0.00 0.30 0.09 0.00 0.00 0.00 0.00 60.65 61.04 2b15 s ILE 68 Cb 0.00 -3.56 -0.04 0.00 0.01 0.00 0.00 42.46 38.87 2b15 s ILE 68 CO 0.00 0.28 -0.18 -0.31 0.00 0.00 0.00 174.94 174.74 2b15 s TYR 69 N 1.41 2.53 -0.13 3.97 1.51 0.33 -0.89 117.35 126.08 2b15 s TYR 69 Ca 0.10 -0.27 0.00 0.00 -1.01 0.00 0.00 57.07 55.90 2b15 s TYR 69 Cb -0.15 -1.32 0.02 0.00 -0.11 0.00 0.00 41.96 40.40 2b15 s TYR 69 CO 0.07 0.41 -0.12 0.21 -1.11 0.00 0.00 175.55 175.01 2b15 s LYS 70 N -2.25 2.00 -0.34 -0.62 2.20 -0.05 -1.42 119.74 119.27 2b15 s LYS 70 Ca 0.19 -0.45 -0.11 0.00 -0.36 0.00 0.00 55.97 55.24 2b15 s LYS 70 Cb -0.10 -1.87 0.00 0.00 -1.51 0.00 0.00 37.83 34.35 2b15 s LYS 70 CO 0.11 -0.21 0.20 0.08 -0.36 0.00 0.00 175.35 175.16 2b15 s VAL 71 N 1.45 4.77 -0.29 4.02 1.01 0.07 -0.60 120.40 130.82 2b15 s VAL 71 Ca 0.02 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 2b15 s VAL 71 Cb -0.13 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 2b15 s VAL 71 CO -0.08 -0.07 0.14 -0.70 0.00 0.00 0.00 175.10 174.39 2b15 s GLU 72 N 1.62 3.53 -0.24 2.72 2.12 0.67 -0.56 118.70 128.56 2b15 s GLU 72 Ca 0.04 -0.58 -0.08 0.00 0.36 0.00 0.00 54.97 54.71 2b15 s GLU 72 Cb -0.18 -3.51 -0.04 0.00 0.26 0.00 0.00 34.13 30.66 2b15 s GLU 72 CO 0.07 -0.31 0.09 0.42 -0.54 0.00 0.00 175.26 174.99 2b15 s ILE 73 N 1.64 4.67 -1.30 -3.70 1.01 0.65 -1.03 121.20 123.13 2b15 s ILE 73 Ca 0.06 -0.06 -0.13 0.00 0.00 0.00 0.00 60.65 60.52 2b15 s ILE 73 Cb -0.16 -3.17 0.13 0.00 0.01 0.00 0.00 42.46 39.27 2b15 s ILE 73 CO 0.06 0.36 1.81 0.47 0.00 0.00 0.00 174.94 177.64 2b15 n ASP 74 N 4.53 4.87 0.04 3.58 8.00 -0.11 -0.82 116.55 136.64 2b15 n ASP 74 Ca -0.16 -3.00 -0.05 0.00 0.71 0.00 0.00 54.79 52.29 2b15 n ASP 74 Cb 0.52 -1.58 0.14 0.00 -0.02 0.00 0.00 41.12 40.18 2b15 n ASP 74 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 2b15 h THR 75 N 4.30 1.32 -0.13 -3.53 1.35 -1.87 -2.86 112.91 111.49 2b15 h THR 75 Ca 0.42 -1.64 -0.01 0.00 -0.55 0.00 0.00 66.41 64.62 2b15 h THR 75 Cb 0.73 1.69 -0.01 0.00 -1.73 0.00 0.00 68.15 68.84 2b15 h THR 75 CO 1.55 0.50 0.03 0.50 -0.25 0.00 0.00 175.52 177.85 2b15 h LYS 76 N 0.32 0.20 -0.88 4.72 3.64 -1.69 -0.98 116.57 121.91 2b15 h LYS 76 Ca 0.02 -0.05 0.09 0.00 -1.27 0.00 0.00 60.65 59.44 2b15 h LYS 76 Cb 0.92 -0.03 -0.07 0.00 -0.41 0.00 0.00 32.23 32.65 2b15 h LYS 76 CO 0.08 0.37 0.53 0.77 -2.27 0.00 0.00 179.45 178.93 2b15 h SER 77 N 0.00 0.79 0.37 4.20 0.02 -1.81 -0.08 113.55 117.03 2b15 h SER 77 Ca 0.04 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.02 2b15 h SER 77 Cb 0.26 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2b15 h SER 77 CO 0.00 0.46 -0.25 0.22 -1.14 0.00 0.00 176.83 176.12 2b15 h TYR 78 N 0.90 -0.65 -0.44 3.45 3.20 -1.20 -1.68 116.97 120.55 2b15 h TYR 78 Ca 0.42 -0.00 -0.08 0.00 3.14 0.00 0.00 58.73 62.20 2b15 h TYR 78 Cb 0.33 0.24 -0.02 0.00 1.54 0.00 0.00 36.73 38.82 2b15 h TYR 78 CO -0.04 -0.38 -0.05 -1.49 -1.64 0.00 0.00 178.16 174.56 2b15 h TRP 79 N -0.60 0.82 -0.05 -3.82 4.06 -0.87 -2.89 115.95 112.59 2b15 h TRP 79 Ca -0.03 -0.13 -0.12 0.00 2.06 0.00 0.00 58.89 60.67 2b15 h TRP 79 Cb 0.51 -0.22 -0.01 0.00 -1.00 0.00 0.00 29.16 28.44 2b15 h TRP 79 CO -0.11 0.79 -0.51 0.87 -3.56 0.00 0.00 178.44 175.91 2b15 h LYS 80 N 0.70 0.14 0.00 0.49 1.57 -0.87 0.12 116.57 118.72 2b15 h LYS 80 Ca 0.13 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 2b15 h LYS 80 Cb 0.50 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.82 2b15 h LYS 80 CO 0.03 0.62 0.00 0.00 -0.57 0.00 0.00 179.45 179.53 2b15 h ALA 81 N 1.36 1.00 -0.71 3.86 0.00 -1.09 -1.56 119.26 122.12 2b15 h ALA 81 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2b15 h ALA 81 Cb 0.95 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.74 2b15 h ALA 81 CO 0.07 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.60 2b15 n LEU 82 N -2.87 4.34 -1.19 0.00 4.77 -0.91 -4.96 117.00 116.18 2b15 n LEU 82 Ca 0.01 -2.18 -0.11 0.00 -0.03 0.00 0.00 56.01 53.70 2b15 n LEU 82 Cb 0.28 -0.54 -0.01 0.00 -2.33 0.00 0.00 43.42 40.83 2b15 n LEU 82 CO 0.25 0.92 -0.13 0.61 -1.33 0.00 0.00 177.39 177.71 2b15 n GLY 83 N 1.48 0.12 3.37 -0.72 0.00 -0.59 -5.05 105.19 103.80 2b15 n GLY 83 Ca 0.26 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.52 2b15 n GLY 83 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2b15 s ILE 84 N -2.52 2.36 -0.56 -0.61 1.01 0.36 -4.99 121.20 116.25 2b15 s ILE 84 Ca 0.00 -1.12 -0.15 0.00 0.00 0.00 0.00 60.65 59.38 2b15 s ILE 84 Cb 0.00 -1.89 0.14 0.00 0.01 0.00 0.00 42.46 40.72 2b15 s ILE 84 CO 0.00 0.49 0.51 -0.55 0.00 0.00 0.00 174.94 175.39 2b15 s SER 85 N -0.91 6.19 0.71 3.58 0.15 -1.26 -2.86 113.70 119.29 2b15 s SER 85 Ca 0.11 -1.90 -0.04 0.00 0.70 0.00 0.00 55.95 54.83 2b15 s SER 85 Cb -0.10 -2.19 0.10 0.00 -1.71 0.00 0.00 66.02 62.12 2b15 s SER 85 CO 0.01 -0.81 0.99 -2.16 1.20 0.00 0.00 173.24 172.47 2b15 s PRO 86 N 1.42 1.87 -0.12 5.44 0.04 -1.26 -5.00 135.00 137.40 2b15 s PRO 86 Ca 0.05 -0.74 -0.27 0.00 0.04 0.00 0.00 61.00 60.08 2b15 s PRO 86 Cb -0.28 -2.27 -0.27 0.00 0.04 0.00 0.00 34.50 31.73 2b15 s PRO 86 CO 0.01 -1.35 0.79 0.35 0.04 0.00 0.00 177.00 176.84 2b15 h PHE 87 N -0.55 0.14 -3.59 0.56 3.57 -1.39 -3.48 116.94 112.21 2b15 h PHE 87 Ca -0.41 -0.10 -0.51 0.00 3.53 0.00 0.00 57.97 60.48 2b15 h PHE 87 Cb 1.28 -0.01 -0.03 0.00 2.79 0.00 0.00 35.95 39.99 2b15 h PHE 87 CO -0.05 1.09 0.00 -1.01 -2.23 0.00 0.00 178.31 176.10 2b15 s HIS 88 N -2.27 3.40 0.05 0.41 3.76 -1.26 -4.99 115.29 114.39 2b15 s HIS 88 Ca -0.18 1.04 -0.18 0.00 -0.15 0.00 0.00 55.06 55.59 2b15 s HIS 88 Cb -0.02 -2.40 -0.14 0.00 1.11 0.00 0.00 32.58 31.13 2b15 s HIS 88 CO 0.72 0.15 1.31 0.93 -0.85 0.00 0.00 174.74 177.01 2b15 h GLU 89 N 2.28 0.49 -2.90 1.40 4.39 -1.98 -3.36 114.58 114.91 2b15 h GLU 89 Ca -0.47 -0.31 0.05 0.00 0.34 0.00 0.00 59.36 58.96 2b15 h GLU 89 Cb 1.17 0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 29.83 2b15 h GLU 89 CO 0.67 0.91 0.30 -3.38 -1.16 0.00 0.00 179.01 176.35 2b15 s HIS 90 N -4.07 -0.02 -0.14 4.33 -3.43 -1.26 -2.98 115.29 107.73 2b15 s HIS 90 Ca -0.13 -0.53 -0.03 0.00 -0.80 0.00 0.00 55.06 53.57 2b15 s HIS 90 Cb 0.06 0.77 -0.03 0.00 -1.43 0.00 0.00 32.58 31.95 2b15 s HIS 90 CO 0.80 -1.34 -0.05 0.00 -2.00 0.00 0.00 174.74 172.15 2b15 s ALA 91 N -2.96 2.99 -0.08 -1.38 0.00 0.00 -4.87 121.76 115.46 2b15 s ALA 91 Ca 0.14 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.31 2b15 s ALA 91 Cb -0.05 -1.48 -0.01 0.00 0.00 0.00 0.00 23.12 21.58 2b15 s ALA 91 CO 0.09 0.30 -0.22 -1.21 0.00 0.00 0.00 175.76 174.71 2b15 s GLU 92 N 0.10 2.86 -0.20 0.00 8.01 -1.26 -0.26 118.70 127.95 2b15 s GLU 92 Ca -0.01 -0.85 0.01 0.00 0.01 0.00 0.00 54.97 54.13 2b15 s GLU 92 Cb -0.14 -2.30 0.05 0.00 -4.31 0.00 0.00 34.13 27.43 2b15 s GLU 92 CO 0.03 0.30 -0.10 0.08 0.01 0.00 0.00 175.26 175.58 2b15 s VAL 93 N 0.07 1.64 -0.12 2.63 1.01 0.27 -4.97 120.40 120.93 2b15 s VAL 93 Ca -0.10 -1.05 0.03 0.00 0.00 0.00 0.00 61.98 60.86 2b15 s VAL 93 Cb -0.15 -1.74 0.00 0.00 0.00 0.00 0.00 36.38 34.49 2b15 s VAL 93 CO 0.06 0.13 -0.22 -0.69 0.00 0.00 0.00 175.10 174.37 2b15 s VAL 94 N 1.39 2.14 0.02 2.92 1.01 -1.26 -0.75 120.40 125.87 2b15 s VAL 94 Ca -0.02 -0.97 -0.25 0.00 0.00 0.00 0.00 61.98 60.74 2b15 s VAL 94 Cb -0.17 -1.84 0.06 0.00 0.00 0.00 0.00 36.38 34.43 2b15 s VAL 94 CO -0.08 0.55 0.56 0.72 0.00 0.00 0.00 175.10 176.86 2b15 s PHE 95 N 0.58 -0.49 0.02 5.22 -0.71 -0.51 -5.00 117.98 117.10 2b15 s PHE 95 Ca -0.13 0.67 -0.25 0.00 -1.04 0.00 0.00 56.93 56.18 2b15 s PHE 95 Cb -0.17 0.36 -0.05 0.00 -1.21 0.00 0.00 43.02 41.96 2b15 s PHE 95 CO 0.03 -0.63 0.78 0.99 -1.34 0.00 0.00 175.22 175.06 2b15 s THR 96 N -2.04 4.79 0.09 -4.49 2.01 -1.26 -0.51 115.64 114.23 2b15 s THR 96 Ca -0.07 1.65 0.10 0.00 0.31 0.00 0.00 61.69 63.68 2b15 s THR 96 Cb -0.01 -4.13 -0.03 0.00 0.01 0.00 0.00 72.50 68.34 2b15 s THR 96 CO 0.02 0.32 -0.26 0.00 -0.69 0.00 0.00 174.62 174.01 2b15 s ALA 97 N 0.20 2.33 -1.63 7.40 0.00 -0.08 -4.79 121.76 125.20 2b15 s ALA 97 Ca 0.40 -1.38 0.00 0.00 0.00 0.00 0.00 51.96 50.98 2b15 s ALA 97 Cb -0.20 -0.43 0.00 0.00 0.00 0.00 0.00 23.12 22.49 2b15 s ALA 97 CO 0.23 0.54 0.00 0.09 0.00 0.00 0.00 175.76 176.62 2b15 n ASN 98 N 1.31 -4.91 0.21 0.00 3.02 -1.26 -2.45 115.26 111.18 2b15 n ASN 98 Ca -0.17 0.30 0.15 0.00 -0.03 0.00 0.00 54.58 54.82 2b15 n ASN 98 Cb 0.52 -3.87 0.54 0.00 -0.61 0.00 0.00 39.78 36.36 2b15 n ASN 98 CO 0.00 0.00 0.00 -0.78 -2.62 0.00 0.00 177.26 173.86 2b15 h ASP 99 N 0.00 0.00 -0.30 6.41 1.82 -1.92 -2.63 116.42 119.80 2b15 h ASP 99 Ca -0.34 0.00 -0.21 0.00 -0.39 0.00 0.00 57.03 56.09 2b15 h ASP 99 Cb 1.11 0.00 -0.16 0.00 0.68 0.00 0.00 39.33 40.96 2b15 h ASP 99 CO 0.48 0.00 -0.54 -1.20 -1.61 0.00 0.00 179.24 176.37 2b15 n SER 100 N -2.78 2.95 0.00 2.28 7.64 -1.26 -5.08 113.62 117.37 2b15 n SER 100 Ca 0.02 -3.84 0.00 0.00 1.01 0.00 0.00 58.87 56.05 2b15 n SER 100 Cb 0.32 -0.49 0.00 0.00 -1.01 0.00 0.00 64.21 63.04 2b15 n SER 100 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2b15 n GLY 101 N -0.98 0.62 3.75 0.23 0.00 -0.99 -4.98 105.19 102.83 2b15 n GLY 101 Ca 0.29 -1.90 -0.41 0.00 0.00 0.00 0.00 46.02 44.01 2b15 n GLY 101 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2b15 s PRO 102 N -1.98 4.15 0.20 1.61 0.04 -1.26 -4.24 135.00 133.52 2b15 s PRO 102 Ca 0.00 2.52 0.02 0.00 0.04 0.00 0.00 61.00 63.58 2b15 s PRO 102 Cb 0.00 -3.04 -0.05 0.00 0.04 0.00 0.00 34.50 31.45 2b15 s PRO 102 CO 0.00 -0.58 0.01 1.03 0.04 0.00 0.00 177.00 177.50 2b15 s ARG 103 N -0.54 1.22 -0.19 4.56 1.81 -1.26 -4.68 118.95 119.86 2b15 s ARG 103 Ca 0.62 -1.60 -0.09 0.00 -1.72 0.00 0.00 55.73 52.94 2b15 s ARG 103 Cb -0.46 -0.39 -0.05 0.00 -0.45 0.00 0.00 34.95 33.60 2b15 s ARG 103 CO 0.48 -0.13 0.10 1.03 -0.68 0.00 0.00 175.30 176.09 2b15 s ARG 104 N -3.91 4.04 -0.14 3.54 3.00 0.17 -4.84 118.95 120.82 2b15 s ARG 104 Ca 0.27 -0.27 0.01 0.00 0.00 0.00 0.00 55.73 55.74 2b15 s ARG 104 Cb 0.06 -3.31 0.00 0.00 0.00 0.00 0.00 34.95 31.70 2b15 s ARG 104 CO 0.07 0.32 -0.18 0.71 0.00 0.00 0.00 175.30 176.21 2b15 s TYR 105 N 0.27 2.72 -0.23 -0.53 1.51 0.48 -1.26 117.35 120.31 2b15 s TYR 105 Ca 0.06 -1.08 -0.06 0.00 -1.01 0.00 0.00 57.07 54.98 2b15 s TYR 105 Cb -0.12 -1.84 -0.03 0.00 -0.11 0.00 0.00 41.96 39.87 2b15 s TYR 105 CO -0.01 -0.47 0.04 0.99 -1.11 0.00 0.00 175.55 174.99 2b15 s THR 106 N 0.70 4.11 -0.29 -0.71 2.01 -0.19 -0.76 115.64 120.50 2b15 s THR 106 Ca -0.08 -0.24 -0.10 0.00 0.31 0.00 0.00 61.69 61.57 2b15 s THR 106 Cb -0.16 -2.90 -0.02 0.00 0.01 0.00 0.00 72.50 69.43 2b15 s THR 106 CO 0.01 0.38 0.15 -0.63 -0.69 0.00 0.00 174.62 173.84 2b15 s ILE 107 N 1.41 4.79 0.07 1.82 -1.09 0.03 -1.09 121.20 127.13 2b15 s ILE 107 Ca 0.05 -0.19 0.06 0.00 -2.23 0.00 0.00 60.65 58.34 2b15 s ILE 107 Cb -0.15 -3.36 -0.04 0.00 -1.58 0.00 0.00 42.46 37.34 2b15 s ILE 107 CO 0.02 0.16 -0.11 0.00 -1.23 0.00 0.00 174.94 173.79 2b15 s ALA 108 N 1.66 2.89 -0.00 9.38 0.00 -0.48 -0.88 121.76 134.33 2b15 s ALA 108 Ca 0.06 -1.18 -0.00 0.00 0.00 0.00 0.00 51.96 50.84 2b15 s ALA 108 Cb -0.16 -0.92 0.00 0.00 0.00 0.00 0.00 23.12 22.04 2b15 s ALA 108 CO 0.07 0.62 0.01 0.00 0.00 0.00 0.00 175.76 176.46 2b15 s ALA 109 N -1.10 0.01 -0.21 0.00 0.00 -0.34 -1.69 121.76 118.44 2b15 s ALA 109 Ca 0.19 0.05 -0.01 0.00 0.00 0.00 0.00 51.96 52.18 2b15 s ALA 109 Cb -0.11 -0.04 0.01 0.00 0.00 0.00 0.00 23.12 22.98 2b15 s ALA 109 CO 0.10 -0.02 -0.11 -1.17 0.00 0.00 0.00 175.76 174.57 2b15 s LEU 110 N 0.15 2.64 -0.11 0.00 2.96 0.13 -0.81 118.68 123.63 2b15 s LEU 110 Ca -0.01 -0.58 -0.03 0.00 -0.22 0.00 0.00 54.13 53.29 2b15 s LEU 110 Cb -0.02 -1.62 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 2b15 s LEU 110 CO -0.00 -0.03 -0.00 -0.76 -1.32 0.00 0.00 176.35 174.23 2b15 s LEU 111 N 1.38 3.51 0.18 -0.68 1.43 0.13 -1.58 118.68 123.05 2b15 s LEU 111 Ca 0.04 0.06 0.05 0.00 -1.03 0.00 0.00 54.13 53.25 2b15 s LEU 111 Cb -0.14 -1.82 -0.05 0.00 0.03 0.00 0.00 46.19 44.21 2b15 s LEU 111 CO -0.07 0.30 -0.08 -0.44 0.23 0.00 0.00 176.35 176.29 2b15 s SER 112 N -0.41 1.93 0.33 2.29 0.01 0.06 -0.93 113.70 116.97 2b15 s SER 112 Ca 0.08 -1.07 0.06 0.00 1.31 0.00 0.00 55.95 56.32 2b15 s SER 112 Cb -0.12 -0.03 0.71 0.00 0.21 0.00 0.00 66.02 66.79 2b15 s SER 112 CO 0.02 -0.36 1.87 -0.65 0.41 0.00 0.00 173.24 174.53 2b15 h PRO 113 N 2.66 0.79 -0.22 12.44 0.11 -1.99 -2.86 132.00 142.92 2b15 h PRO 113 Ca -0.37 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.69 2b15 h PRO 113 Cb 1.20 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2b15 h PRO 113 CO 0.64 0.53 0.00 0.66 -0.21 0.00 0.00 178.00 179.61 2b15 n TYR 114 N -4.57 0.53 -3.48 0.65 4.02 -1.26 -0.93 117.16 112.12 2b15 n TYR 114 Ca 0.17 -0.71 -0.15 0.00 -0.01 0.00 0.00 57.90 57.21 2b15 n TYR 114 Cb 0.40 -0.16 -0.04 0.00 -0.02 0.00 0.00 39.34 39.52 2b15 n TYR 114 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2b15 s SER 115 N -1.59 -0.61 0.09 7.72 0.15 -1.08 -4.93 113.70 113.45 2b15 s SER 115 Ca 0.28 0.39 -0.13 0.00 0.70 0.00 0.00 55.95 57.19 2b15 s SER 115 Cb 0.21 0.56 0.02 0.00 -1.71 0.00 0.00 66.02 65.10 2b15 s SER 115 CO 0.09 -0.76 0.31 -0.72 1.20 0.00 0.00 173.24 173.36 2b15 s TYR 116 N -2.34 -0.08 0.18 3.44 1.13 -1.26 -0.76 117.35 117.65 2b15 s TYR 116 Ca -0.05 -0.22 0.10 0.00 -1.41 0.00 0.00 57.07 55.48 2b15 s TYR 116 Cb -0.00 0.12 -0.04 0.00 -1.10 0.00 0.00 41.96 40.94 2b15 s TYR 116 CO -0.01 -0.60 -0.20 -1.54 -2.51 0.00 0.00 175.55 170.69 2b15 s SER 117 N -2.62 2.97 -0.05 -0.18 1.04 -0.62 -4.97 113.70 109.28 2b15 s SER 117 Ca 0.01 -0.87 -0.08 0.00 0.48 0.00 0.00 55.95 55.49 2b15 s SER 117 Cb 0.02 -0.20 0.01 0.00 0.10 0.00 0.00 66.02 65.96 2b15 s SER 117 CO -0.09 0.02 0.20 0.28 0.98 0.00 0.00 173.24 174.63 2b15 s THR 118 N -1.94 0.03 0.13 2.02 -1.32 -1.26 -0.70 115.64 112.60 2b15 s THR 118 Ca 0.18 -0.27 -0.03 0.00 -1.21 0.00 0.00 61.69 60.37 2b15 s THR 118 Cb -0.06 -0.38 -0.03 0.00 -1.51 0.00 0.00 72.50 70.52 2b15 s THR 118 CO 0.08 -0.15 0.09 0.28 -2.21 0.00 0.00 174.62 172.72 2b15 s THR 119 N -0.51 0.11 -0.01 5.08 -1.32 -0.68 -5.00 115.64 113.31 2b15 s THR 119 Ca -0.06 -1.79 0.06 0.00 -1.21 0.00 0.00 61.69 58.68 2b15 s THR 119 Cb -0.04 -1.95 -0.02 0.00 -1.51 0.00 0.00 72.50 68.99 2b15 s THR 119 CO 0.01 -0.48 -0.18 0.00 -2.21 0.00 0.00 174.62 171.76 2b15 s ALA 120 N -4.02 1.52 -0.21 11.08 0.00 -1.26 -1.39 121.76 127.48 2b15 s ALA 120 Ca 0.21 -0.80 -0.03 0.00 0.00 0.00 0.00 51.96 51.34 2b15 s ALA 120 Cb 0.07 -0.37 -0.00 0.00 0.00 0.00 0.00 23.12 22.81 2b15 s ALA 120 CO 0.00 0.37 -0.08 0.08 0.00 0.00 0.00 175.76 176.12 2b15 s VAL 121 N -0.47 3.04 -0.16 0.00 1.01 -0.25 -4.98 120.40 118.59 2b15 s VAL 121 Ca 0.07 -0.61 0.02 0.00 0.00 0.00 0.00 61.98 61.46 2b15 s VAL 121 Cb -0.07 -2.36 0.02 0.00 0.00 0.00 0.00 36.38 33.96 2b15 s VAL 121 CO -0.00 0.46 -0.21 -0.69 0.00 0.00 0.00 175.10 174.65 2b15 s VAL 122 N 1.37 2.06 0.25 2.92 1.01 -1.26 -1.03 120.40 125.73 2b15 s VAL 122 Ca 0.05 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.14 2b15 s VAL 122 Cb -0.14 -1.84 -0.05 0.00 0.00 0.00 0.00 36.38 34.35 2b15 s VAL 122 CO -0.05 0.54 -0.09 0.42 0.00 0.00 0.00 175.10 175.93 2b15 s THR 123 N 1.06 1.67 -0.19 3.92 -4.23 -0.39 -4.96 115.64 112.52 2b15 s THR 123 Ca -0.01 -2.16 -0.00 0.00 -1.18 0.00 0.00 61.69 58.34 2b15 s THR 123 Cb -0.14 -2.31 0.01 0.00 1.34 0.00 0.00 72.50 71.40 2b15 s THR 123 CO -0.08 -0.40 -0.16 0.21 -0.54 0.00 0.00 174.62 173.66 2b15 s ASN 124 N -3.40 3.45 0.00 3.99 3.04 -1.26 -0.65 114.94 120.11 2b15 s ASN 124 Ca 0.27 -0.57 0.21 0.00 0.04 0.00 0.00 52.86 52.81 2b15 s ASN 124 Cb 0.02 -1.55 1.25 0.00 -1.54 0.00 0.00 41.25 39.44 2b15 s ASN 124 CO 0.10 0.00 1.64 -0.81 -3.04 0.00 0.00 177.10 174.99