#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 0.09 -3.72 0.00 -0.04 -1.26 -4.73 135.00 125.34 2b15 n PRO 11 Ca 0.00 0.14 -0.17 0.00 -0.04 0.00 0.00 63.50 63.43 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 -2.86 0.54 0.02 1.53 2.96 -1.26 -0.00 118.68 119.61 2b15 s LEU 12 Ca 0.13 0.10 0.02 0.00 -0.22 0.00 0.00 54.13 54.16 2b15 s LEU 12 Cb 0.13 -0.04 -0.01 0.00 0.50 0.00 0.00 46.19 46.77 2b15 s LEU 12 CO 0.34 -0.19 -0.08 -0.32 -1.32 0.00 0.00 176.35 174.78 2b15 s MET 13 N 1.66 0.57 -0.07 1.98 -2.45 -0.08 -4.42 119.30 116.49 2b15 s MET 13 Ca -0.02 -0.48 0.05 0.00 -1.25 0.00 0.00 55.69 54.00 2b15 s MET 13 Cb -0.12 -0.48 -0.01 0.00 1.25 0.00 0.00 34.83 35.47 2b15 s MET 13 CO -0.03 0.12 -0.24 0.08 1.05 0.00 0.00 175.02 175.99 2b15 s VAL 14 N -0.66 2.08 -0.04 10.11 1.01 -0.94 -0.87 120.40 131.09 2b15 s VAL 14 Ca -0.02 -1.04 0.03 0.00 0.00 0.00 0.00 61.98 60.95 2b15 s VAL 14 Cb -0.06 -1.76 0.00 0.00 0.00 0.00 0.00 36.38 34.56 2b15 s VAL 14 CO 0.00 0.57 -0.13 -0.75 0.00 0.00 0.00 175.10 174.79 2b15 s LYS 15 N 0.00 1.49 -0.06 2.72 2.20 -0.11 -0.71 119.74 125.28 2b15 s LYS 15 Ca -0.09 -0.46 0.02 0.00 -0.36 0.00 0.00 55.97 55.09 2b15 s LYS 15 Cb -0.15 -1.30 0.01 0.00 -1.51 0.00 0.00 37.83 34.88 2b15 s LYS 15 CO 0.05 0.15 -0.12 0.08 -0.36 0.00 0.00 175.35 175.15 2b15 s VAL 16 N 0.25 1.08 0.15 4.02 1.01 -0.02 -1.09 120.40 125.80 2b15 s VAL 16 Ca -0.06 -0.47 0.10 0.00 0.00 0.00 0.00 61.98 61.55 2b15 s VAL 16 Cb -0.12 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 2b15 s VAL 16 CO 0.02 0.34 -0.22 -0.76 0.00 0.00 0.00 175.10 174.48 2b15 s LEU 17 N 0.54 2.53 -0.27 3.92 1.43 -0.09 -1.17 118.68 125.56 2b15 s LEU 17 Ca -0.12 -0.70 -0.06 0.00 -1.03 0.00 0.00 54.13 52.22 2b15 s LEU 17 Cb -0.14 -1.35 -0.00 0.00 0.03 0.00 0.00 46.19 44.72 2b15 s LEU 17 CO 0.03 0.16 0.05 -0.62 0.23 0.00 0.00 176.35 176.20 2b15 s ASP 18 N -2.31 4.96 0.02 2.29 -1.08 0.98 -0.41 116.67 121.13 2b15 s ASP 18 Ca 0.18 -0.51 0.26 0.00 -0.52 0.00 0.00 52.55 51.96 2b15 s ASP 18 Cb -0.10 -1.86 0.73 0.00 -1.46 0.00 0.00 42.92 40.23 2b15 s ASP 18 CO 0.09 -0.11 1.58 0.00 0.52 0.00 0.00 175.17 177.24 2b15 n ALA 19 N 4.87 3.04 -0.04 3.66 0.00 0.26 -1.23 120.51 131.07 2b15 n ALA 19 Ca -0.16 -0.25 -0.20 0.00 0.00 0.00 0.00 53.44 52.83 2b15 n ALA 19 Cb 0.49 -1.25 -0.13 0.00 0.00 0.00 0.00 19.45 18.56 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 1.10 0.00 0.00 2.07 -1.94 -3.39 116.25 114.09 2b15 h VAL 20 Ca 0.00 -2.33 0.00 0.00 0.82 0.00 0.00 66.70 65.19 2b15 h VAL 20 Cb 0.54 2.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.97 2b15 h VAL 20 CO 0.00 0.58 -1.00 0.54 0.02 0.00 0.00 177.57 177.71 2b15 n ARG 21 N -4.15 0.27 -2.86 1.57 3.00 -1.25 -5.00 116.66 108.23 2b15 n ARG 21 Ca -0.25 -0.00 -0.11 0.00 -0.01 0.00 0.00 57.85 57.47 2b15 n ARG 21 Cb 0.78 -1.59 0.06 0.00 0.00 0.00 0.00 32.46 31.71 2b15 n ARG 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2b15 n GLY 22 N 1.38 -0.39 3.56 -0.13 0.00 -0.37 -5.03 105.19 104.21 2b15 n GLY 22 Ca 0.02 0.17 -0.09 0.00 0.00 0.00 0.00 46.02 46.13 2b15 n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2b15 s SER 23 N -3.56 -0.14 0.56 1.61 1.04 -1.04 -5.01 113.70 107.16 2b15 s SER 23 Ca 0.19 -0.76 -0.21 0.00 0.48 0.00 0.00 55.95 55.65 2b15 s SER 23 Cb -0.03 0.58 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 2b15 s SER 23 CO 0.53 -1.10 1.34 -2.84 0.98 0.00 0.00 173.24 172.15 2b15 s PRO 24 N -3.96 3.07 -0.50 4.02 0.02 -1.26 -0.01 135.00 136.38 2b15 s PRO 24 Ca 0.17 2.19 -0.22 0.00 0.02 0.00 0.00 61.00 63.16 2b15 s PRO 24 Cb -0.01 -2.20 0.04 0.00 0.02 0.00 0.00 34.50 32.36 2b15 s PRO 24 CO 0.04 -1.23 0.75 0.00 -0.33 0.00 0.00 177.00 176.24 2b15 s ALA 25 N -1.33 3.29 0.05 -1.55 0.00 -0.32 -4.56 121.76 117.35 2b15 s ALA 25 Ca 0.73 -1.36 -0.12 0.00 0.00 0.00 0.00 51.96 51.21 2b15 s ALA 25 Cb -0.40 -3.48 -0.06 0.00 0.00 0.00 0.00 23.12 19.19 2b15 s ALA 25 CO 0.46 -2.07 0.40 0.42 0.00 0.00 0.00 175.76 174.97 2b15 s ILE 26 N 3.19 5.07 -1.31 0.00 1.01 -1.26 -4.32 121.20 123.58 2b15 s ILE 26 Ca 0.24 0.60 -0.00 0.00 0.00 0.00 0.00 60.65 61.48 2b15 s ILE 26 Cb -0.15 -3.66 0.00 0.00 0.01 0.00 0.00 42.46 38.66 2b15 s ILE 26 CO 0.17 0.40 0.07 -3.20 0.00 0.00 0.00 174.94 172.38 2b15 n ASN 27 N 1.26 -4.73 -4.70 3.58 5.15 -0.07 -4.94 115.26 110.80 2b15 n ASN 27 Ca -0.10 -0.04 -0.41 0.00 -0.60 0.00 0.00 54.58 53.43 2b15 n ASN 27 Cb 0.52 -3.82 -0.04 0.00 -0.53 0.00 0.00 39.78 35.91 2b15 n ASN 27 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2b15 s VAL 28 N -2.81 4.97 0.25 3.44 1.01 -1.26 -4.73 120.40 121.25 2b15 s VAL 28 Ca 0.03 1.61 -0.30 0.00 0.00 0.00 0.00 61.98 63.32 2b15 s VAL 28 Cb -0.01 -4.12 -0.09 0.00 0.00 0.00 0.00 36.38 32.16 2b15 s VAL 28 CO 0.04 0.17 1.09 0.00 0.00 0.00 0.00 175.10 176.40 2b15 s ALA 29 N 1.26 3.39 -0.06 5.51 0.00 -1.26 -0.93 121.76 129.67 2b15 s ALA 29 Ca 0.40 0.86 0.01 0.00 0.00 0.00 0.00 51.96 53.23 2b15 s ALA 29 Cb -0.18 -3.33 0.02 0.00 0.00 0.00 0.00 23.12 19.63 2b15 s ALA 29 CO 0.18 -0.15 -0.06 0.08 0.00 0.00 0.00 175.76 175.81 2b15 s VAL 30 N -0.87 0.71 -0.10 0.00 1.01 -0.17 -0.83 120.40 120.15 2b15 s VAL 30 Ca 0.46 -0.19 0.04 0.00 0.00 0.00 0.00 61.98 62.29 2b15 s VAL 30 Cb -0.31 -0.72 -0.00 0.00 0.00 0.00 0.00 36.38 35.35 2b15 s VAL 30 CO 0.39 0.28 -0.23 -1.00 0.00 0.00 0.00 175.10 174.53 2b15 s HIS 31 N 1.12 2.58 -0.05 5.22 3.76 -0.14 -1.47 115.29 126.30 2b15 s HIS 31 Ca -0.07 -1.01 0.01 0.00 -0.15 0.00 0.00 55.06 53.84 2b15 s HIS 31 Cb -0.14 -1.72 -0.03 0.00 1.11 0.00 0.00 32.58 31.80 2b15 s HIS 31 CO -0.01 -0.40 -0.06 0.08 -0.85 0.00 0.00 174.74 173.50 2b15 s VAL 32 N 0.32 3.72 0.10 -0.90 1.01 0.21 -0.00 120.40 124.85 2b15 s VAL 32 Ca -0.18 -0.55 0.05 0.00 0.00 0.00 0.00 61.98 61.31 2b15 s VAL 32 Cb -0.18 -2.55 -0.03 0.00 0.00 0.00 0.00 36.38 33.62 2b15 s VAL 32 CO 0.09 0.55 -0.14 -0.36 0.00 0.00 0.00 175.10 175.23 2b15 s PHE 33 N -0.86 1.30 -0.04 5.22 0.40 0.29 -0.89 117.98 123.39 2b15 s PHE 33 Ca 0.14 -0.52 0.06 0.00 -0.60 0.00 0.00 56.93 56.01 2b15 s PHE 33 Cb -0.11 -0.71 -0.02 0.00 0.51 0.00 0.00 43.02 42.70 2b15 s PHE 33 CO 0.03 0.09 -0.23 0.50 0.70 0.00 0.00 175.22 176.31 2b15 s ARG 34 N -2.24 2.36 0.01 0.44 3.52 -0.16 -1.06 118.95 121.81 2b15 s ARG 34 Ca 0.04 -0.87 -0.30 0.00 -0.13 0.00 0.00 55.73 54.46 2b15 s ARG 34 Cb -0.07 -2.16 -0.04 0.00 -1.56 0.00 0.00 34.95 31.12 2b15 s ARG 34 CO 0.02 0.51 1.14 0.21 -0.81 0.00 0.00 175.30 176.37 2b15 s LYS 35 N -0.46 4.44 0.61 5.12 2.20 0.05 -1.39 119.74 130.30 2b15 s LYS 35 Ca 0.05 1.64 -0.01 0.00 -0.36 0.00 0.00 55.97 57.30 2b15 s LYS 35 Cb -0.11 -3.44 0.05 0.00 -1.51 0.00 0.00 37.83 32.82 2b15 s LYS 35 CO 0.01 -0.27 0.86 0.00 -0.36 0.00 0.00 175.35 175.59 2b15 s ALA 36 N 1.42 3.73 0.31 3.13 0.00 0.46 -4.74 121.76 126.07 2b15 s ALA 36 Ca 0.56 -1.32 0.03 0.00 0.00 0.00 0.00 51.96 51.22 2b15 s ALA 36 Cb -0.26 -2.16 0.61 0.00 0.00 0.00 0.00 23.12 21.31 2b15 s ALA 36 CO 0.26 -0.97 1.89 0.00 0.00 0.00 0.00 175.76 176.94 2b15 h ALA 37 N -0.15 1.59 -0.08 0.00 0.00 -1.95 0.26 119.26 118.93 2b15 h ALA 37 Ca -0.41 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.49 2b15 h ALA 37 Cb 1.30 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.86 2b15 h ALA 37 CO 0.52 0.23 0.00 -0.40 0.00 0.00 0.00 179.25 179.59 2b15 n ASP 38 N -4.53 0.63 0.00 0.00 5.75 -1.26 -4.86 116.55 112.28 2b15 n ASP 38 Ca 0.15 -2.02 0.00 0.00 -0.01 0.00 0.00 54.79 52.91 2b15 n ASP 38 Cb 0.29 -0.14 0.00 0.00 -1.03 0.00 0.00 41.12 40.24 2b15 n ASP 38 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 2b15 n ASP 39 N -0.21 -0.04 -4.88 -1.12 9.92 0.08 -5.03 116.55 115.28 2b15 n ASP 39 Ca 0.03 0.00 -0.30 0.00 -0.53 0.00 0.00 54.79 53.99 2b15 n ASP 39 Cb 0.12 -0.01 -0.02 0.00 -0.64 0.00 0.00 41.12 40.57 2b15 n ASP 39 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 2b15 s THR 40 N -3.76 4.77 -0.20 -3.53 -4.23 -1.26 -4.74 115.64 102.69 2b15 s THR 40 Ca 0.00 0.65 -0.20 0.00 -1.18 0.00 0.00 61.69 60.96 2b15 s THR 40 Cb 0.00 -3.77 -0.03 0.00 1.34 0.00 0.00 72.50 70.04 2b15 s THR 40 CO 0.00 -0.68 0.57 0.26 -0.54 0.00 0.00 174.62 174.23 2b15 s TRP 41 N -2.57 3.37 -0.11 3.99 0.52 -1.26 -0.41 118.94 122.47 2b15 s TRP 41 Ca 0.52 0.84 -0.01 0.00 0.02 0.00 0.00 56.10 57.48 2b15 s TRP 41 Cb -0.10 -2.73 -0.03 0.00 -1.15 0.00 0.00 33.47 29.46 2b15 s TRP 41 CO 0.37 -0.13 -0.08 -1.21 0.02 0.00 0.00 176.95 175.92 2b15 s GLU 42 N 1.76 3.22 0.27 4.98 2.02 -0.49 -4.92 118.70 125.53 2b15 s GLU 42 Ca 0.26 -0.58 -0.29 0.00 0.02 0.00 0.00 54.97 54.38 2b15 s GLU 42 Cb -0.16 -2.70 -0.14 0.00 0.10 0.00 0.00 34.13 31.23 2b15 s GLU 42 CO 0.10 0.41 1.05 -2.30 0.02 0.00 0.00 175.26 174.53 2b15 n PRO 43 N 3.00 1.33 0.00 0.39 -0.02 -1.26 -0.99 135.00 137.45 2b15 n PRO 43 Ca -0.18 0.47 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 2b15 n PRO 43 Cb 0.53 -1.87 0.00 0.00 -0.02 0.00 0.00 33.50 32.14 2b15 n PRO 43 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 2b15 n PHE 44 N 0.52 0.00 -3.53 6.00 7.35 -0.07 -4.74 117.46 122.98 2b15 n PHE 44 Ca 0.11 0.00 -0.09 0.00 -0.76 0.00 0.00 57.45 56.71 2b15 n PHE 44 Cb 0.31 0.08 -0.03 0.00 0.35 0.00 0.00 39.48 40.19 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 -1.82 -1.88 0.27 3.13 0.00 -1.01 -5.00 121.76 115.46 2b15 s ALA 45 Ca 0.00 1.26 -0.21 0.00 0.00 0.00 0.00 51.96 53.01 2b15 s ALA 45 Cb 0.00 -0.01 0.02 0.00 0.00 0.00 0.00 23.12 23.13 2b15 s ALA 45 CO 0.00 -0.54 0.69 -1.54 0.00 0.00 0.00 175.76 174.37 2b15 s SER 46 N -1.96 -0.28 0.00 0.00 1.04 -1.26 0.65 113.70 111.89 2b15 s SER 46 Ca 0.02 -0.58 0.00 0.00 0.48 0.00 0.00 55.95 55.88 2b15 s SER 46 Cb -0.01 0.71 0.00 0.00 0.10 0.00 0.00 66.02 66.82 2b15 s SER 46 CO -0.05 -1.30 0.00 0.61 0.98 0.00 0.00 173.24 173.48 2b15 n GLY 47 N -0.45 -1.18 3.13 7.32 0.00 -0.54 -4.97 105.19 108.50 2b15 n GLY 47 Ca -0.05 -0.85 -0.23 0.00 0.00 0.00 0.00 46.02 44.90 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 -0.31 1.17 0.55 1.61 1.02 -1.26 -0.99 119.74 121.52 2b15 s LYS 48 Ca 0.00 -0.58 -0.21 0.00 0.02 0.00 0.00 55.97 55.20 2b15 s LYS 48 Cb 0.00 -1.14 -0.05 0.00 -0.52 0.00 0.00 37.83 36.12 2b15 s LYS 48 CO 0.00 0.31 1.26 0.95 -0.92 0.00 0.00 175.35 176.95 2b15 s THR 49 N -0.44 2.48 0.57 2.17 -4.23 -0.11 -4.78 115.64 111.30 2b15 s THR 49 Ca 0.05 0.33 -0.09 0.00 -1.18 0.00 0.00 61.69 60.81 2b15 s THR 49 Cb -0.06 -3.15 0.13 0.00 1.34 0.00 0.00 72.50 70.75 2b15 s THR 49 CO -0.00 -0.03 0.78 -1.54 -0.54 0.00 0.00 174.62 173.29 2b15 n SER 50 N -1.17 0.16 0.34 3.99 3.41 0.13 -0.90 113.62 119.59 2b15 n SER 50 Ca 0.11 -1.35 0.23 0.00 -0.26 0.00 0.00 58.87 57.60 2b15 n SER 50 Cb 0.47 -0.59 1.21 0.00 -0.26 0.00 0.00 64.21 65.04 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 -0.05 4.33 3.07 -1.94 0.87 114.58 120.86 2b15 h GLU 51 Ca -0.25 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.61 2b15 h GLU 51 Cb 0.72 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.63 2b15 h GLU 51 CO 0.19 0.00 0.00 -1.13 -1.40 0.00 0.00 179.01 176.67 2b15 n SER 52 N -3.08 1.81 0.00 1.42 3.41 -1.26 -4.81 113.62 111.11 2b15 n SER 52 Ca -0.03 -1.62 0.00 0.00 -0.26 0.00 0.00 58.87 56.96 2b15 n SER 52 Cb 0.08 -0.02 0.00 0.00 -0.26 0.00 0.00 64.21 64.01 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 1.21 0.55 3.68 5.00 0.00 0.30 -4.77 105.19 111.15 2b15 n GLY 53 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.03 2.50 -0.24 1.61 2.02 -1.26 -0.84 118.70 122.46 2b15 s GLU 54 Ca 0.00 -0.93 -0.00 0.00 0.02 0.00 0.00 54.97 54.06 2b15 s GLU 54 Cb 0.00 -2.48 0.07 0.00 0.10 0.00 0.00 34.13 31.82 2b15 s GLU 54 CO 0.00 0.51 -0.02 -1.17 0.02 0.00 0.00 175.26 174.60 2b15 s LEU 55 N -2.54 2.33 0.32 1.80 2.96 0.12 -0.69 118.68 122.98 2b15 s LEU 55 Ca 0.26 -1.18 0.08 0.00 -0.22 0.00 0.00 54.13 53.06 2b15 s LEU 55 Cb -0.11 -1.04 -0.03 0.00 0.50 0.00 0.00 46.19 45.51 2b15 s LEU 55 CO 0.18 -0.27 0.26 -1.00 -1.32 0.00 0.00 176.35 174.20 2b15 s HIS 56 N 1.49 2.90 -0.88 5.38 3.76 -1.26 -2.22 115.29 124.47 2b15 s HIS 56 Ca -0.03 -0.29 0.00 0.00 -0.15 0.00 0.00 55.06 54.60 2b15 s HIS 56 Cb -0.18 -1.72 0.00 0.00 1.11 0.00 0.00 32.58 31.79 2b15 s HIS 56 CO -0.08 0.25 0.00 0.41 -0.85 0.00 0.00 174.74 174.47 2b15 n GLY 57 N -1.32 0.43 0.26 -2.22 0.00 -1.26 -4.93 105.19 96.15 2b15 n GLY 57 Ca -0.03 -0.54 -0.06 0.00 0.00 0.00 0.00 46.02 45.39 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 0.68 -8.26 0.99 3.38 -1.85 -3.47 115.31 106.78 2b15 h LEU 58 Ca -0.21 -0.24 -0.12 0.00 0.09 0.00 0.00 57.88 57.41 2b15 h LEU 58 Cb 0.94 -0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.45 2b15 h LEU 58 CO 0.27 0.89 -0.00 0.28 0.09 0.00 0.00 178.44 179.97 2b15 s THR 59 N -4.58 0.00 0.31 0.22 -1.32 -1.26 -4.80 115.64 104.21 2b15 s THR 59 Ca -0.08 -1.33 0.10 0.00 -1.21 0.00 0.00 61.69 59.16 2b15 s THR 59 Cb 0.13 -2.54 -0.05 0.00 -1.51 0.00 0.00 72.50 68.53 2b15 s THR 59 CO 0.82 0.00 -0.02 0.42 -2.21 0.00 0.00 174.62 173.63 2b15 s THR 60 N -3.16 2.82 0.25 5.08 -4.23 -1.26 -4.50 115.64 110.64 2b15 s THR 60 Ca 0.22 -2.02 -0.03 0.00 -1.18 0.00 0.00 61.69 58.68 2b15 s THR 60 Cb -0.02 -2.73 0.22 0.00 1.34 0.00 0.00 72.50 71.31 2b15 s THR 60 CO 0.14 -0.28 1.79 1.05 -0.54 0.00 0.00 174.62 176.78 2b15 h GLU 61 N 1.89 0.69 -0.79 3.99 9.09 -1.97 -1.73 114.58 125.75 2b15 h GLU 61 Ca -0.43 -0.04 0.01 0.00 0.05 0.00 0.00 59.36 58.95 2b15 h GLU 61 Cb 1.25 -0.15 -0.04 0.00 -1.65 0.00 0.00 28.75 28.16 2b15 h GLU 61 CO 0.64 0.45 0.53 1.49 0.05 0.00 0.00 179.01 182.17 2b15 h GLU 62 N 0.71 1.04 0.00 1.06 4.81 -2.04 -3.07 114.58 117.09 2b15 h GLU 62 Ca 0.42 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.47 2b15 h GLU 62 Cb 0.48 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 2b15 h GLU 62 CO -0.30 0.69 -0.75 0.93 -0.73 0.00 0.00 179.01 178.86 2b15 h GLU 63 N 1.07 0.00 -3.65 1.92 3.07 -1.85 -3.40 114.58 111.75 2b15 h GLU 63 Ca 0.29 0.00 -0.76 0.00 -0.50 0.00 0.00 59.36 58.40 2b15 h GLU 63 Cb -0.12 0.00 -0.16 0.00 -0.84 0.00 0.00 28.75 27.63 2b15 h GLU 63 CO -0.06 0.42 1.92 0.34 -1.40 0.00 0.00 179.01 180.23 2b15 n PHE 64 N -3.12 3.18 -2.05 4.33 7.35 -0.69 -4.97 117.46 121.49 2b15 n PHE 64 Ca -0.01 -2.86 -0.28 0.00 -0.76 0.00 0.00 57.45 53.55 2b15 n PHE 64 Cb 0.75 -1.96 0.07 0.00 0.35 0.00 0.00 39.48 38.69 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 0.47 2.51 0.46 -2.13 -7.23 -1.26 -4.96 120.40 108.26 2b15 s VAL 65 Ca 0.40 -0.02 -0.24 0.00 -1.81 0.00 0.00 61.98 60.31 2b15 s VAL 65 Cb 0.08 -3.12 -0.09 0.00 0.56 0.00 0.00 36.38 33.81 2b15 s VAL 65 CO 0.01 -0.15 1.24 -0.62 -0.31 0.00 0.00 175.10 175.26 2b15 n GLU 66 N -3.06 1.76 -3.79 4.82 1.02 -1.26 -4.87 120.64 115.26 2b15 n GLU 66 Ca 0.07 0.63 0.00 0.00 -0.02 0.00 0.00 57.16 57.85 2b15 n GLU 66 Cb 0.60 -2.37 0.00 0.00 -0.02 0.00 0.00 31.44 29.65 2b15 n GLU 66 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2b15 n GLY 67 N 0.87 -2.25 3.65 0.62 0.00 -1.18 -4.97 105.19 101.93 2b15 n GLY 67 Ca 0.08 -1.23 -0.35 0.00 0.00 0.00 0.00 46.02 44.52 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 -2.26 4.99 0.13 -0.61 1.01 -1.26 -0.79 121.20 122.40 2b15 s ILE 68 Ca 0.00 0.04 0.11 0.00 0.00 0.00 0.00 60.65 60.80 2b15 s ILE 68 Cb 0.00 -3.27 -0.04 0.00 0.01 0.00 0.00 42.46 39.16 2b15 s ILE 68 CO 0.00 0.43 -0.27 -0.31 0.00 0.00 0.00 174.94 174.79 2b15 s TYR 69 N 0.55 2.30 -0.10 3.97 1.51 0.12 -0.77 117.35 124.93 2b15 s TYR 69 Ca 0.05 -0.38 0.03 0.00 -1.01 0.00 0.00 57.07 55.76 2b15 s TYR 69 Cb -0.12 -1.25 0.01 0.00 -0.11 0.00 0.00 41.96 40.49 2b15 s TYR 69 CO 0.01 0.33 -0.19 0.21 -1.11 0.00 0.00 175.55 174.80 2b15 s LYS 70 N -2.04 2.55 -0.28 -0.62 2.20 -0.22 -1.31 119.74 120.01 2b15 s LYS 70 Ca 0.14 -0.69 -0.06 0.00 -0.36 0.00 0.00 55.97 55.00 2b15 s LYS 70 Cb -0.10 -2.03 0.01 0.00 -1.51 0.00 0.00 37.83 34.19 2b15 s LYS 70 CO 0.06 0.05 0.05 0.08 -0.36 0.00 0.00 175.35 175.22 2b15 s VAL 71 N 0.67 3.78 -0.22 4.02 1.01 0.10 -0.55 120.40 129.21 2b15 s VAL 71 Ca -0.12 -0.67 -0.07 0.00 0.00 0.00 0.00 61.98 61.11 2b15 s VAL 71 Cb -0.16 -2.91 -0.03 0.00 0.00 0.00 0.00 36.38 33.28 2b15 s VAL 71 CO 0.03 0.15 0.05 -1.61 0.00 0.00 0.00 175.10 173.73 2b15 s GLU 72 N 1.48 3.73 -0.22 2.72 2.02 1.00 -0.68 118.70 128.75 2b15 s GLU 72 Ca 0.03 -0.45 -0.06 0.00 0.02 0.00 0.00 54.97 54.51 2b15 s GLU 72 Cb -0.17 -3.24 -0.02 0.00 0.10 0.00 0.00 34.13 30.80 2b15 s GLU 72 CO 0.01 -0.03 0.02 0.42 0.02 0.00 0.00 175.26 175.71 2b15 s ILE 73 N 1.16 4.04 -1.33 -1.63 1.01 0.36 -0.97 121.20 123.86 2b15 s ILE 73 Ca 0.04 -0.27 -0.13 0.00 0.00 0.00 0.00 60.65 60.29 2b15 s ILE 73 Cb -0.14 -2.86 0.11 0.00 0.01 0.00 0.00 42.46 39.58 2b15 s ILE 73 CO 0.03 0.39 1.87 0.47 0.00 0.00 0.00 174.94 177.71 2b15 n ASP 74 N 4.56 4.72 0.02 3.58 8.00 -0.01 -1.13 116.55 136.28 2b15 n ASP 74 Ca -0.17 -2.97 -0.03 0.00 0.71 0.00 0.00 54.79 52.33 2b15 n ASP 74 Cb 0.51 -1.60 0.20 0.00 -0.02 0.00 0.00 41.12 40.21 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 4.35 1.27 -0.26 -3.53 1.35 -1.87 -3.09 112.91 111.12 2b15 h THR 75 Ca 0.44 -1.27 -0.00 0.00 -0.55 0.00 0.00 66.41 65.03 2b15 h THR 75 Cb 0.73 1.35 -0.01 0.00 -1.73 0.00 0.00 68.15 68.49 2b15 h THR 75 CO 1.60 0.40 0.16 0.50 -0.25 0.00 0.00 175.52 177.93 2b15 h LYS 76 N 0.42 0.35 -0.31 4.72 3.64 -1.70 -1.58 116.57 122.11 2b15 h LYS 76 Ca 0.06 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.36 2b15 h LYS 76 Cb 0.67 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.40 2b15 h LYS 76 CO 0.05 0.27 -0.02 0.77 -2.27 0.00 0.00 179.45 178.25 2b15 h SER 77 N 0.33 0.46 0.24 4.20 0.02 -1.84 -0.98 113.55 115.99 2b15 h SER 77 Ca 0.09 -0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2b15 h SER 77 Cb 0.01 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.42 2b15 h SER 77 CO -0.02 0.55 -0.18 0.22 -1.14 0.00 0.00 176.83 176.26 2b15 h TYR 78 N 0.47 -0.47 -0.48 3.45 3.20 -1.30 -1.37 116.97 120.47 2b15 h TYR 78 Ca 0.10 -0.00 -0.09 0.00 3.14 0.00 0.00 58.73 61.87 2b15 h TYR 78 Cb 0.35 0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.77 2b15 h TYR 78 CO 0.01 -0.28 -0.08 -1.49 -1.64 0.00 0.00 178.16 174.68 2b15 h TRP 79 N -0.43 0.93 -0.87 -3.82 4.06 -1.12 -2.82 115.95 111.88 2b15 h TRP 79 Ca -0.02 -0.17 -0.01 0.00 2.06 0.00 0.00 58.89 60.75 2b15 h TRP 79 Cb 0.38 -0.24 -0.04 0.00 -1.00 0.00 0.00 29.16 28.25 2b15 h TRP 79 CO -0.11 0.89 0.49 0.87 -3.56 0.00 0.00 178.44 177.02 2b15 h LYS 80 N 0.78 1.21 0.00 0.49 1.57 -1.01 -0.77 116.57 118.82 2b15 h LYS 80 Ca 0.13 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 2b15 h LYS 80 Cb 0.58 -0.24 -0.00 0.00 0.08 0.00 0.00 32.23 32.64 2b15 h LYS 80 CO 0.04 0.87 -0.06 0.00 -0.57 0.00 0.00 179.45 179.73 2b15 h ALA 81 N 1.32 1.06 -0.16 3.86 0.00 -1.00 -1.53 119.26 122.81 2b15 h ALA 81 Ca 0.31 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.16 2b15 h ALA 81 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2b15 h ALA 81 CO -0.05 0.07 0.00 1.28 0.00 0.00 0.00 179.25 180.55 2b15 n LEU 82 N -3.25 2.47 -0.89 0.00 4.77 -0.68 -4.95 117.00 114.48 2b15 n LEU 82 Ca -0.01 -0.95 -0.09 0.00 -0.03 0.00 0.00 56.01 54.93 2b15 n LEU 82 Cb 0.27 -0.10 -0.02 0.00 -2.33 0.00 0.00 43.42 41.24 2b15 n LEU 82 CO 0.27 0.48 -0.10 0.61 -1.33 0.00 0.00 177.39 177.32 2b15 n GLY 83 N 1.30 0.44 3.34 -0.72 0.00 -0.58 -5.03 105.19 103.94 2b15 n GLY 83 Ca 0.17 -0.56 -0.32 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.40 2.60 -0.35 -0.61 1.01 -0.38 -5.02 121.20 116.04 2b15 s ILE 84 Ca 0.00 -0.85 -0.29 0.00 0.00 0.00 0.00 60.65 59.51 2b15 s ILE 84 Cb 0.00 -2.02 0.01 0.00 0.01 0.00 0.00 42.46 40.46 2b15 s ILE 84 CO 0.00 0.56 1.16 -0.55 0.00 0.00 0.00 174.94 176.10 2b15 s SER 85 N -0.02 6.79 0.30 3.58 0.15 -1.26 -3.83 113.70 119.40 2b15 s SER 85 Ca -0.06 0.98 0.04 0.00 0.70 0.00 0.00 55.95 57.61 2b15 s SER 85 Cb -0.15 -2.54 -0.03 0.00 -1.71 0.00 0.00 66.02 61.60 2b15 s SER 85 CO 0.05 -1.02 0.44 -2.16 1.20 0.00 0.00 173.24 171.75 2b15 s PRO 86 N 3.98 3.38 -0.20 5.44 0.04 -1.26 -4.83 135.00 141.54 2b15 s PRO 86 Ca 0.49 -0.67 -0.20 0.00 0.04 0.00 0.00 61.00 60.66 2b15 s PRO 86 Cb -0.12 -2.80 -0.16 0.00 0.04 0.00 0.00 34.50 31.45 2b15 s PRO 86 CO 0.21 0.26 0.15 0.35 0.04 0.00 0.00 177.00 178.00 2b15 h PHE 87 N 0.97 0.00 -3.91 0.56 3.57 -1.45 -3.49 116.94 113.20 2b15 h PHE 87 Ca -0.50 0.00 -0.47 0.00 3.53 0.00 0.00 57.97 60.53 2b15 h PHE 87 Cb 1.23 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.96 2b15 h PHE 87 CO 0.46 1.25 0.22 -1.01 -2.23 0.00 0.00 178.31 177.01 2b15 s HIS 88 N -2.34 3.37 0.12 0.41 3.76 -1.26 -4.98 115.29 114.37 2b15 s HIS 88 Ca -0.27 1.37 -0.13 0.00 -0.15 0.00 0.00 55.06 55.88 2b15 s HIS 88 Cb 0.05 -2.67 -0.07 0.00 1.11 0.00 0.00 32.58 31.01 2b15 s HIS 88 CO 0.53 -0.07 1.45 0.93 -0.85 0.00 0.00 174.74 176.72 2b15 h GLU 89 N 1.81 0.79 -2.52 1.40 4.39 -1.98 -3.36 114.58 115.12 2b15 h GLU 89 Ca -0.48 -0.41 0.15 0.00 0.34 0.00 0.00 59.36 58.95 2b15 h GLU 89 Cb 1.18 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 29.78 2b15 h GLU 89 CO 0.63 1.04 0.44 -3.38 -1.16 0.00 0.00 179.01 176.58 2b15 s HIS 90 N -4.39 -0.10 -0.09 4.33 -3.43 -1.26 -3.16 115.29 107.19 2b15 s HIS 90 Ca -0.12 -0.27 -0.04 0.00 -0.80 0.00 0.00 55.06 53.84 2b15 s HIS 90 Cb 0.10 0.67 -0.04 0.00 -1.43 0.00 0.00 32.58 31.88 2b15 s HIS 90 CO 0.85 -0.96 0.07 0.00 -2.00 0.00 0.00 174.74 172.70 2b15 s ALA 91 N -3.21 3.56 -0.05 -1.38 0.00 -0.29 -4.88 121.76 115.51 2b15 s ALA 91 Ca 0.13 -0.75 0.04 0.00 0.00 0.00 0.00 51.96 51.38 2b15 s ALA 91 Cb -0.03 -1.68 -0.00 0.00 0.00 0.00 0.00 23.12 21.41 2b15 s ALA 91 CO 0.04 0.62 -0.17 -1.21 0.00 0.00 0.00 175.76 175.04 2b15 s GLU 92 N -1.07 1.82 -0.14 0.00 2.02 -1.26 -0.48 118.70 119.58 2b15 s GLU 92 Ca 0.15 -0.61 0.01 0.00 0.02 0.00 0.00 54.97 54.54 2b15 s GLU 92 Cb -0.12 -1.57 0.02 0.00 0.10 0.00 0.00 34.13 32.57 2b15 s GLU 92 CO 0.05 0.23 -0.15 0.08 0.02 0.00 0.00 175.26 175.49 2b15 s VAL 93 N 0.07 1.61 -0.11 2.63 1.01 0.14 -4.96 120.40 120.79 2b15 s VAL 93 Ca -0.05 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.29 2b15 s VAL 93 Cb -0.12 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.77 2b15 s VAL 93 CO 0.02 0.47 -0.19 -0.69 0.00 0.00 0.00 175.10 174.71 2b15 s VAL 94 N 1.37 1.77 0.10 2.92 1.01 -1.26 0.01 120.40 126.32 2b15 s VAL 94 Ca 0.03 -0.82 -0.18 0.00 0.00 0.00 0.00 61.98 61.00 2b15 s VAL 94 Cb -0.13 -1.58 0.04 0.00 0.00 0.00 0.00 36.38 34.71 2b15 s VAL 94 CO -0.09 0.50 0.45 0.72 0.00 0.00 0.00 175.10 176.68 2b15 s PHE 95 N 0.77 -0.30 -0.16 5.22 -0.71 -0.43 -5.00 117.98 117.37 2b15 s PHE 95 Ca -0.10 0.11 -0.14 0.00 -1.04 0.00 0.00 56.93 55.77 2b15 s PHE 95 Cb -0.16 0.31 -0.05 0.00 -1.21 0.00 0.00 43.02 41.91 2b15 s PHE 95 CO 0.01 -0.69 0.29 0.99 -1.34 0.00 0.00 175.22 174.48 2b15 s THR 96 N -3.31 5.31 -0.12 -4.49 2.01 -1.26 -0.70 115.64 113.08 2b15 s THR 96 Ca -0.00 0.54 -0.22 0.00 0.31 0.00 0.00 61.69 62.32 2b15 s THR 96 Cb 0.01 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 2b15 s THR 96 CO -0.09 0.39 0.65 0.00 -0.69 0.00 0.00 174.62 174.89 2b15 s ALA 97 N 0.43 3.42 -0.04 7.40 0.00 0.03 -4.97 121.76 128.04 2b15 s ALA 97 Ca 0.16 -0.03 0.05 0.00 0.00 0.00 0.00 51.96 52.15 2b15 s ALA 97 Cb -0.13 -2.93 -0.01 0.00 0.00 0.00 0.00 23.12 20.05 2b15 s ALA 97 CO 0.04 -0.24 -0.21 -0.80 0.00 0.00 0.00 175.76 174.55 2b15 s ASN 98 N 0.89 2.51 -1.39 0.00 0.02 -1.26 -3.08 114.94 112.64 2b15 s ASN 98 Ca 0.33 -0.41 -0.09 0.00 -1.02 0.00 0.00 52.86 51.68 2b15 s ASN 98 Cb -0.17 -0.56 0.08 0.00 0.02 0.00 0.00 41.25 40.62 2b15 s ASN 98 CO 0.14 0.21 2.29 0.47 0.02 0.00 0.00 177.10 180.24 2b15 n ASP 99 N 2.90 6.39 -3.96 -1.22 8.00 -1.26 -4.83 116.55 122.58 2b15 n ASP 99 Ca -0.17 -2.97 -0.43 0.00 0.71 0.00 0.00 54.79 51.93 2b15 n ASP 99 Cb 0.53 -1.49 0.01 0.00 -0.02 0.00 0.00 41.12 40.14 2b15 n ASP 99 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2b15 n SER 100 N 3.61 6.08 -0.34 -2.24 3.41 -1.26 -4.96 113.62 117.91 2b15 n SER 100 Ca 0.56 -3.34 0.01 0.00 -0.26 0.00 0.00 58.87 55.84 2b15 n SER 100 Cb 0.31 -1.33 -0.00 0.00 -0.26 0.00 0.00 64.21 62.93 2b15 n SER 100 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2b15 n GLY 101 N 1.71 -1.78 3.69 5.00 0.00 -1.26 -5.71 105.19 106.83 2b15 n GLY 101 Ca 0.30 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.59 2b15 n GLY 101 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 2b15 s PRO 102 N -0.17 4.29 -0.09 1.61 0.02 -1.26 -5.01 135.00 134.39 2b15 s PRO 102 Ca 0.00 1.94 -0.07 0.00 0.02 0.00 0.00 61.00 62.89 2b15 s PRO 102 Cb 0.00 -3.56 0.03 0.00 0.02 0.00 0.00 34.50 30.98 2b15 s PRO 102 CO 0.00 -0.56 0.22 1.03 -0.33 0.00 0.00 177.00 177.36 2b15 s ARG 103 N 2.35 0.24 -0.07 5.54 3.00 -1.26 -4.16 118.95 124.60 2b15 s ARG 103 Ca 0.63 0.35 0.02 0.00 0.00 0.00 0.00 55.73 56.73 2b15 s ARG 103 Cb -0.31 0.07 -0.03 0.00 0.00 0.00 0.00 34.95 34.68 2b15 s ARG 103 CO 0.26 -0.06 -0.11 0.50 0.00 0.00 0.00 175.30 175.89 2b15 s ARG 104 N 0.38 2.72 -0.22 3.54 6.06 0.26 -4.84 118.95 126.85 2b15 s ARG 104 Ca -0.02 -0.62 -0.04 0.00 -2.50 0.00 0.00 55.73 52.55 2b15 s ARG 104 Cb -0.04 -2.51 -0.01 0.00 0.06 0.00 0.00 34.95 32.45 2b15 s ARG 104 CO -0.02 0.59 -0.04 0.71 -2.50 0.00 0.00 175.30 174.05 2b15 s TYR 105 N -0.64 2.96 -0.23 5.12 1.51 1.00 -1.41 117.35 125.66 2b15 s TYR 105 Ca 0.09 -0.89 -0.05 0.00 -1.01 0.00 0.00 57.07 55.22 2b15 s TYR 105 Cb -0.11 -2.10 -0.01 0.00 -0.11 0.00 0.00 41.96 39.63 2b15 s TYR 105 CO 0.01 -0.51 -0.00 0.99 -1.11 0.00 0.00 175.55 174.93 2b15 s THR 106 N 1.40 3.65 -0.33 -0.71 2.01 0.25 -0.91 115.64 121.00 2b15 s THR 106 Ca 0.05 -0.44 -0.12 0.00 0.31 0.00 0.00 61.69 61.49 2b15 s THR 106 Cb -0.14 -2.70 -0.02 0.00 0.01 0.00 0.00 72.50 69.65 2b15 s THR 106 CO -0.03 0.37 0.22 -0.63 -0.69 0.00 0.00 174.62 173.86 2b15 s ILE 107 N 1.51 5.15 0.08 1.82 -1.09 -0.05 -0.75 121.20 127.88 2b15 s ILE 107 Ca 0.06 -0.22 0.06 0.00 -2.23 0.00 0.00 60.65 58.31 2b15 s ILE 107 Cb -0.15 -3.63 -0.04 0.00 -1.58 0.00 0.00 42.46 37.07 2b15 s ILE 107 CO -0.01 0.03 -0.08 0.00 -1.23 0.00 0.00 174.94 173.65 2b15 s ALA 108 N 1.70 3.00 -0.00 9.38 0.00 -0.50 -0.93 121.76 134.42 2b15 s ALA 108 Ca 0.06 -1.17 0.00 0.00 0.00 0.00 0.00 51.96 50.85 2b15 s ALA 108 Cb -0.17 -0.98 0.00 0.00 0.00 0.00 0.00 23.12 21.97 2b15 s ALA 108 CO 0.10 0.64 0.00 0.00 0.00 0.00 0.00 175.76 176.50 2b15 s ALA 109 N -1.17 0.01 -0.24 0.00 0.00 -0.25 -1.48 121.76 118.64 2b15 s ALA 109 Ca 0.21 0.02 -0.02 0.00 0.00 0.00 0.00 51.96 52.17 2b15 s ALA 109 Cb -0.11 -0.02 0.02 0.00 0.00 0.00 0.00 23.12 23.01 2b15 s ALA 109 CO 0.13 -0.01 -0.07 -1.17 0.00 0.00 0.00 175.76 174.64 2b15 s LEU 110 N 0.07 3.03 -0.14 0.00 2.96 0.41 -0.92 118.68 124.09 2b15 s LEU 110 Ca -0.01 -0.76 -0.06 0.00 -0.22 0.00 0.00 54.13 53.08 2b15 s LEU 110 Cb -0.01 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.98 2b15 s LEU 110 CO -0.00 -0.10 0.07 -0.76 -1.32 0.00 0.00 176.35 174.24 2b15 s LEU 111 N 1.35 3.94 0.21 -0.68 1.43 0.45 -1.51 118.68 123.87 2b15 s LEU 111 Ca 0.02 0.21 0.05 0.00 -1.03 0.00 0.00 54.13 53.38 2b15 s LEU 111 Cb -0.16 -1.96 -0.05 0.00 0.03 0.00 0.00 46.19 44.05 2b15 s LEU 111 CO -0.05 0.29 -0.06 -0.44 0.23 0.00 0.00 176.35 176.32 2b15 s SER 112 N -0.33 2.11 0.31 2.29 0.01 0.26 -0.58 113.70 117.77 2b15 s SER 112 Ca 0.09 -1.12 0.01 0.00 1.31 0.00 0.00 55.95 56.24 2b15 s SER 112 Cb -0.12 -0.05 0.56 0.00 0.21 0.00 0.00 66.02 66.62 2b15 s SER 112 CO 0.02 -0.37 1.92 -0.65 0.41 0.00 0.00 173.24 174.56 2b15 h PRO 113 N 2.54 0.96 -0.23 12.44 0.11 -1.99 -2.98 132.00 142.85 2b15 h PRO 113 Ca -0.38 -0.06 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2b15 h PRO 113 Cb 1.22 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 32.11 2b15 h PRO 113 CO 0.64 0.63 0.00 0.66 -0.21 0.00 0.00 178.00 179.73 2b15 n TYR 114 N -4.49 0.47 -3.52 0.65 4.02 -1.26 -1.06 117.16 111.97 2b15 n TYR 114 Ca 0.13 -0.65 -0.15 0.00 -0.01 0.00 0.00 57.90 57.22 2b15 n TYR 114 Cb 0.20 -0.12 -0.05 0.00 -0.02 0.00 0.00 39.34 39.35 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 -1.44 -0.54 0.03 7.72 0.15 -1.12 -4.96 113.70 113.53 2b15 s SER 115 Ca 0.25 0.32 -0.12 0.00 0.70 0.00 0.00 55.95 57.09 2b15 s SER 115 Cb 0.18 0.53 0.02 0.00 -1.71 0.00 0.00 66.02 65.03 2b15 s SER 115 CO 0.10 -0.74 0.27 -0.72 1.20 0.00 0.00 173.24 173.35 2b15 s TYR 116 N -2.30 -0.07 0.11 3.44 1.13 -1.26 -0.57 117.35 117.82 2b15 s TYR 116 Ca -0.06 -0.04 0.08 0.00 -1.41 0.00 0.00 57.07 55.64 2b15 s TYR 116 Cb -0.01 0.05 -0.04 0.00 -1.10 0.00 0.00 41.96 40.87 2b15 s TYR 116 CO -0.00 -0.45 -0.12 -1.54 -2.51 0.00 0.00 175.55 170.93 2b15 s SER 117 N -1.87 4.24 -0.00 -0.18 1.04 -0.57 -4.97 113.70 111.39 2b15 s SER 117 Ca -0.07 -0.44 -0.03 0.00 0.48 0.00 0.00 55.95 55.89 2b15 s SER 117 Cb -0.02 -0.75 -0.00 0.00 0.10 0.00 0.00 66.02 65.34 2b15 s SER 117 CO -0.02 0.18 0.06 0.28 0.98 0.00 0.00 173.24 174.72 2b15 s THR 118 N -1.19 0.06 0.12 2.02 -1.32 -1.26 -0.45 115.64 113.61 2b15 s THR 118 Ca 0.20 -0.47 -0.06 0.00 -1.21 0.00 0.00 61.69 60.15 2b15 s THR 118 Cb -0.11 -0.24 -0.02 0.00 -1.51 0.00 0.00 72.50 70.62 2b15 s THR 118 CO 0.12 -0.26 0.16 0.28 -2.21 0.00 0.00 174.62 172.71 2b15 s THR 119 N -0.81 0.12 -0.09 5.08 -1.32 -0.55 -5.01 115.64 113.07 2b15 s THR 119 Ca -0.09 -1.51 0.03 0.00 -1.21 0.00 0.00 61.69 58.91 2b15 s THR 119 Cb -0.05 -1.69 -0.02 0.00 -1.51 0.00 0.00 72.50 69.23 2b15 s THR 119 CO 0.00 -0.55 -0.18 0.00 -2.21 0.00 0.00 174.62 171.68 2b15 s ALA 120 N -3.95 2.47 -0.26 11.08 0.00 -1.26 -1.40 121.76 128.43 2b15 s ALA 120 Ca 0.13 -0.96 -0.02 0.00 0.00 0.00 0.00 51.96 51.11 2b15 s ALA 120 Cb 0.05 -0.97 0.03 0.00 0.00 0.00 0.00 23.12 22.24 2b15 s ALA 120 CO -0.04 0.38 -0.04 0.08 0.00 0.00 0.00 175.76 176.14 2b15 s VAL 121 N -0.07 2.98 -0.23 0.00 1.01 0.07 -4.98 120.40 119.18 2b15 s VAL 121 Ca -0.04 -1.09 -0.00 0.00 0.00 0.00 0.00 61.98 60.84 2b15 s VAL 121 Cb -0.14 -2.56 0.03 0.00 0.00 0.00 0.00 36.38 33.70 2b15 s VAL 121 CO 0.04 0.11 -0.10 -0.69 0.00 0.00 0.00 175.10 174.46 2b15 s VAL 122 N 1.32 2.60 0.21 2.92 1.01 -1.26 -0.59 120.40 126.61 2b15 s VAL 122 Ca -0.01 -1.08 0.03 0.00 0.00 0.00 0.00 61.98 60.92 2b15 s VAL 122 Cb -0.17 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.86 2b15 s VAL 122 CO -0.03 0.25 -0.00 0.42 0.00 0.00 0.00 175.10 175.74 2b15 s THR 123 N 1.29 0.88 -0.87 3.92 -4.23 -0.50 -4.91 115.64 111.23 2b15 s THR 123 Ca 0.00 -2.01 0.07 0.00 -1.18 0.00 0.00 61.69 58.57 2b15 s THR 123 Cb -0.16 -2.24 0.05 0.00 1.34 0.00 0.00 72.50 71.49 2b15 s THR 123 CO -0.06 -0.39 0.72 -3.20 -0.54 0.00 0.00 174.62 171.15