#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iyb n MET 1 N 0.00 1.10 -1.33 2.89 1.56 -1.26 -4.91 117.12 115.18 2iyb n MET 1 Ca 0.00 0.20 -0.35 0.00 -0.27 0.00 0.00 57.70 57.28 2iyb n MET 1 Cb 0.00 -2.82 0.11 0.00 2.15 0.00 0.00 33.22 32.65 2iyb n MET 1 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 2iyb n SER 2 N 12.35 1.36 -4.70 6.12 7.64 -1.26 -4.94 113.62 130.20 2iyb n SER 2 Ca 0.41 0.67 -0.38 0.00 1.01 0.00 0.00 58.87 60.58 2iyb n SER 2 Cb 0.35 -1.52 0.05 0.00 -1.01 0.00 0.00 64.21 62.08 2iyb n SER 2 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2iyb n GLU 3 N -2.75 1.39 -3.35 1.43 1.02 -1.26 -4.87 120.64 112.25 2iyb n GLU 3 Ca 0.14 0.52 -0.38 0.00 -0.02 0.00 0.00 57.16 57.42 2iyb n GLU 3 Cb 0.50 -2.42 -0.07 0.00 -0.02 0.00 0.00 31.44 29.42 2iyb n GLU 3 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 2iyb s GLN 4 N -2.84 4.26 -0.18 3.49 -1.52 0.07 -4.84 119.66 118.09 2iyb s GLN 4 Ca 0.73 0.32 -0.24 0.00 -1.95 0.00 0.00 55.36 54.22 2iyb s GLN 4 Cb -0.42 -3.48 -0.02 0.00 -0.22 0.00 0.00 33.01 28.87 2iyb s GLN 4 CO 0.48 0.06 0.80 0.45 -0.25 0.00 0.00 175.29 176.83 2iyb s SER 5 N 0.81 6.90 0.00 5.90 0.15 -1.26 0.64 113.70 126.84 2iyb s SER 5 Ca 0.22 1.10 0.14 0.00 0.70 0.00 0.00 55.95 58.11 2iyb s SER 5 Cb -0.15 -2.44 -0.01 0.00 -1.71 0.00 0.00 66.02 61.72 2iyb s SER 5 CO 0.09 -0.39 0.76 2.30 1.20 0.00 0.00 173.24 177.19 2iyb n ILE 6 N 4.78 0.00 -3.49 6.45 -5.35 -0.52 -4.99 119.36 116.24 2iyb n ILE 6 Ca 0.04 -0.35 -0.15 0.00 -0.27 0.00 0.00 62.75 62.02 2iyb n ILE 6 Cb 0.49 1.16 -0.04 0.00 -1.74 0.00 0.00 39.64 39.50 2iyb n ILE 6 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2iyb s GLN 8 N -2.13 0.57 0.21 0.00 1.11 -1.26 -3.41 119.66 114.75 2iyb s GLN 8 Ca -0.05 -0.61 0.09 0.00 0.01 0.00 0.00 55.36 54.80 2iyb s GLN 8 Cb -0.00 -1.91 -0.04 0.00 -1.01 0.00 0.00 33.01 30.04 2iyb s GLN 8 CO 0.01 -0.80 -0.06 0.00 0.01 0.00 0.00 175.29 174.44 2iyb s ALA 9 N 1.84 3.03 -0.28 6.09 0.00 0.03 -4.91 121.76 127.55 2iyb s ALA 9 Ca 0.04 -1.53 -0.11 0.00 0.00 0.00 0.00 51.96 50.36 2iyb s ALA 9 Cb -0.17 -0.75 -0.05 0.00 0.00 0.00 0.00 23.12 22.15 2iyb s ALA 9 CO -0.17 0.40 0.19 1.03 0.00 0.00 0.00 175.76 177.21 2iyb s ARG 10 N -3.11 3.95 -0.03 0.00 0.52 -1.26 -0.23 118.95 118.79 2iyb s ARG 10 Ca 0.27 -0.32 -0.14 0.00 -0.52 0.00 0.00 55.73 55.02 2iyb s ARG 10 Cb -0.08 -3.66 0.02 0.00 0.52 0.00 0.00 34.95 31.76 2iyb s ARG 10 CO 0.17 -0.17 0.31 0.00 0.02 0.00 0.00 175.30 175.62 2iyb s ALA 11 N 1.75 -0.78 -0.34 2.13 0.00 -0.83 -1.65 121.76 122.04 2iyb s ALA 11 Ca 0.07 0.40 -0.23 0.00 0.00 0.00 0.00 51.96 52.19 2iyb s ALA 11 Cb -0.16 -0.01 0.00 0.00 0.00 0.00 0.00 23.12 22.96 2iyb s ALA 11 CO 0.11 -0.24 0.78 0.00 0.00 0.00 0.00 175.76 176.40 2iyb s ALA 12 N -1.12 3.48 -0.00 0.00 0.00 0.32 0.26 121.76 124.69 2iyb s ALA 12 Ca -0.12 -0.55 -0.29 0.00 0.00 0.00 0.00 51.96 51.00 2iyb s ALA 12 Cb -0.05 -3.32 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 2iyb s ALA 12 CO 0.04 -1.34 0.93 0.08 0.00 0.00 0.00 175.76 175.47 2iyb s VAL 13 N 3.01 4.88 0.14 0.00 1.01 -1.26 -1.51 120.40 126.67 2iyb s VAL 13 Ca 0.31 1.96 0.04 0.00 0.00 0.00 0.00 61.98 64.30 2iyb s VAL 13 Cb -0.14 -4.27 -0.04 0.00 0.00 0.00 0.00 36.38 31.93 2iyb s VAL 13 CO 0.15 0.19 -0.10 -0.04 0.00 0.00 0.00 175.10 175.29 2iyb s MET 14 N 0.91 1.02 0.16 2.72 -1.94 0.58 -1.35 119.30 121.40 2iyb s MET 14 Ca 0.49 -1.38 0.08 0.00 -1.71 0.00 0.00 55.69 53.17 2iyb s MET 14 Cb -0.21 -0.63 -0.04 0.00 2.01 0.00 0.00 34.83 35.97 2iyb s MET 14 CO 0.27 0.08 -0.17 0.14 -0.01 0.00 0.00 175.02 175.33 2iyb s VAL 15 N -3.09 1.68 -0.24 -6.03 -7.23 -0.04 0.28 120.40 105.74 2iyb s VAL 15 Ca 0.14 -1.88 -0.21 0.00 -1.81 0.00 0.00 61.98 58.22 2iyb s VAL 15 Cb 0.01 -1.77 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 2iyb s VAL 15 CO 0.01 -0.36 0.67 -0.47 -0.31 0.00 0.00 175.10 174.64 2iyb s TYR 16 N -2.13 3.31 -0.51 2.82 5.04 -1.09 -0.25 117.35 124.55 2iyb s TYR 16 Ca 0.14 0.92 -0.20 0.00 -2.44 0.00 0.00 57.07 55.49 2iyb s TYR 16 Cb -0.05 -2.88 0.05 0.00 0.35 0.00 0.00 41.96 39.43 2iyb s TYR 16 CO 0.06 -0.30 0.68 0.34 -1.34 0.00 0.00 175.55 174.99 2iyb s ASP 17 N 1.37 6.26 0.18 4.32 2.15 0.16 -4.75 116.67 126.35 2iyb s ASP 17 Ca 0.29 -0.74 -0.09 0.00 0.43 0.00 0.00 52.55 52.44 2iyb s ASP 17 Cb -0.16 -2.32 0.06 0.00 -0.30 0.00 0.00 42.92 40.21 2iyb s ASP 17 CO 0.09 -0.94 1.62 0.44 -0.17 0.00 0.00 175.17 176.21 2iyb h ASP 18 N 9.04 1.05 0.53 -0.34 3.32 -1.95 0.26 116.42 128.32 2iyb h ASP 18 Ca -0.27 -0.32 -0.07 0.00 0.02 0.00 0.00 57.03 56.39 2iyb h ASP 18 Cb 1.09 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 2iyb h ASP 18 CO 0.98 1.13 -0.32 0.00 -1.72 0.00 0.00 179.24 179.30 2iyb h ALA 19 N 0.97 1.23 -0.38 3.45 0.00 -1.95 -1.94 119.26 120.64 2iyb h ALA 19 Ca 0.16 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2iyb h ALA 19 Cb 0.63 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2iyb h ALA 19 CO 0.04 0.40 0.00 0.09 0.00 0.00 0.00 179.25 179.78 2iyb n ASN 20 N -3.81 3.26 -3.98 0.00 3.02 -1.16 -5.01 115.26 107.59 2iyb n ASN 20 Ca -0.01 -2.19 -0.27 0.00 -0.03 0.00 0.00 54.58 52.08 2iyb n ASN 20 Cb 0.40 -0.32 -0.08 0.00 -0.61 0.00 0.00 39.78 39.18 2iyb n ASN 20 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2iyb n LYS 21 N 0.46 -0.92 -4.08 3.52 0.00 0.82 -4.92 118.16 113.03 2iyb n LYS 21 Ca 0.15 0.08 -0.10 0.00 -0.00 0.00 0.00 58.31 58.43 2iyb n LYS 21 Cb 0.54 -3.06 -0.07 0.00 -0.00 0.00 0.00 35.03 32.43 2iyb n LYS 21 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.40 175.81 2iyb s LYS 22 N -6.49 1.42 0.20 -1.58 -2.85 -0.63 -5.00 119.74 104.82 2iyb s LYS 22 Ca 0.11 -1.42 -0.23 0.00 -1.00 0.00 0.00 55.97 53.44 2iyb s LYS 22 Cb -0.07 0.39 -0.08 0.00 -2.06 0.00 0.00 37.83 36.01 2iyb s LYS 22 CO 0.82 -0.55 0.76 -1.58 0.10 0.00 0.00 175.35 174.90 2iyb s TRP 23 N -4.05 3.78 0.10 1.78 0.52 -1.26 0.35 118.94 120.15 2iyb s TRP 23 Ca 0.29 1.53 0.02 0.00 0.02 0.00 0.00 56.10 57.97 2iyb s TRP 23 Cb 0.02 -2.71 -0.04 0.00 -1.15 0.00 0.00 33.47 29.60 2iyb s TRP 23 CO 0.11 0.42 -0.08 0.14 0.02 0.00 0.00 176.95 177.55 2iyb s VAL 24 N -1.35 0.78 0.28 4.03 -7.23 0.65 -4.86 120.40 112.71 2iyb s VAL 24 Ca 0.40 -1.81 -0.29 0.00 -1.81 0.00 0.00 61.98 58.47 2iyb s VAL 24 Cb -0.20 -1.53 -0.10 0.00 0.56 0.00 0.00 36.38 35.11 2iyb s VAL 24 CO 0.23 -0.75 1.35 -2.84 -0.31 0.00 0.00 175.10 172.79 2iyb s PRO 25 N -3.39 4.34 0.28 4.82 0.02 -1.26 -0.86 135.00 138.93 2iyb s PRO 25 Ca 0.09 2.21 -0.29 0.00 0.02 0.00 0.00 61.00 63.03 2iyb s PRO 25 Cb 0.02 -3.11 -0.10 0.00 0.02 0.00 0.00 34.50 31.33 2iyb s PRO 25 CO -0.03 -0.28 1.21 0.00 -0.33 0.00 0.00 177.00 177.58 2iyb s ALA 26 N -0.51 3.46 0.00 -1.55 0.00 -0.46 -2.85 121.76 119.86 2iyb s ALA 26 Ca 0.54 1.07 0.00 0.00 0.00 0.00 0.00 51.96 53.57 2iyb s ALA 26 Cb -0.40 -3.41 0.00 0.00 0.00 0.00 0.00 23.12 19.31 2iyb s ALA 26 CO 0.47 -0.41 0.00 0.41 0.00 0.00 0.00 175.76 176.23 2iyb n GLY 27 N 1.29 1.17 1.69 0.00 0.00 -1.26 -4.06 105.19 104.02 2iyb n GLY 27 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2iyb n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2iyb n GLY 28 N -2.00 0.82 2.95 -0.02 0.00 -1.13 -5.05 105.19 100.75 2iyb n GLY 28 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2iyb n GLY 28 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2iyb s SER 29 N -3.01 0.19 0.85 1.61 1.04 -1.26 -4.96 113.70 108.17 2iyb s SER 29 Ca 0.00 -0.35 -0.11 0.00 0.48 0.00 0.00 55.95 55.98 2iyb s SER 29 Cb 0.00 0.07 0.11 0.00 0.10 0.00 0.00 66.02 66.29 2iyb s SER 29 CO 0.00 -0.20 1.11 0.42 0.98 0.00 0.00 173.24 175.54 2iyb s THR 30 N -1.00 2.76 0.00 2.02 -4.23 -1.26 -4.66 115.64 109.27 2iyb s THR 30 Ca -0.11 0.25 0.00 0.00 -1.18 0.00 0.00 61.69 60.65 2iyb s THR 30 Cb -0.07 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.21 2iyb s THR 30 CO -0.01 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.36 2iyb n GLY 31 N -0.65 4.26 3.78 3.99 0.00 -1.26 -5.10 105.19 110.20 2iyb n GLY 31 Ca 0.09 -1.29 -0.37 0.00 0.00 0.00 0.00 46.02 44.46 2iyb n GLY 31 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2iyb s PHE 32 N -1.28 3.18 0.25 1.61 0.08 -1.26 -4.53 117.98 116.02 2iyb s PHE 32 Ca 0.00 1.62 0.10 0.00 0.12 0.00 0.00 56.93 58.76 2iyb s PHE 32 Cb 0.00 -3.19 -0.04 0.00 -0.57 0.00 0.00 43.02 39.22 2iyb s PHE 32 CO 0.00 -0.84 -0.04 -1.12 -0.10 0.00 0.00 175.22 173.12 2iyb s SER 33 N -1.51 4.40 -0.20 1.36 0.01 0.14 -1.50 113.70 116.41 2iyb s SER 33 Ca 0.59 -0.67 -0.19 0.00 1.31 0.00 0.00 55.95 57.00 2iyb s SER 33 Cb -0.24 -0.77 -0.03 0.00 0.21 0.00 0.00 66.02 65.19 2iyb s SER 33 CO 0.29 0.03 0.54 -0.60 0.41 0.00 0.00 173.24 173.91 2iyb s ARG 34 N -3.48 4.20 -0.17 12.44 3.52 0.62 -1.96 118.95 134.12 2iyb s ARG 34 Ca 0.30 0.45 0.00 0.00 -0.13 0.00 0.00 55.73 56.35 2iyb s ARG 34 Cb -0.07 -3.56 0.01 0.00 -1.56 0.00 0.00 34.95 29.77 2iyb s ARG 34 CO 0.18 -0.16 -0.16 0.08 -0.81 0.00 0.00 175.30 174.44 2iyb s VAL 35 N 1.65 2.52 0.18 7.11 1.01 0.69 -0.68 120.40 132.89 2iyb s VAL 35 Ca 0.25 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.50 2iyb s VAL 35 Cb -0.15 -2.07 -0.04 0.00 0.00 0.00 0.00 36.38 34.11 2iyb s VAL 35 CO 0.10 0.51 0.00 -1.00 0.00 0.00 0.00 175.10 174.71 2iyb s HIS 36 N 1.07 2.83 -0.33 5.22 0.09 0.79 -0.79 115.29 124.17 2iyb s HIS 36 Ca -0.01 -0.15 -0.11 0.00 -0.00 0.00 0.00 55.06 54.80 2iyb s HIS 36 Cb -0.14 -1.36 -0.01 0.00 -0.00 0.00 0.00 32.58 31.07 2iyb s HIS 36 CO -0.05 0.53 0.19 0.42 -0.00 0.00 0.00 174.74 175.83 2iyb s ILE 37 N -1.80 4.90 -0.04 0.60 1.01 -1.22 -1.40 121.20 123.25 2iyb s ILE 37 Ca 0.28 -0.36 -0.18 0.00 0.00 0.00 0.00 60.65 60.38 2iyb s ILE 37 Cb -0.09 -3.52 -0.05 0.00 0.01 0.00 0.00 42.46 38.81 2iyb s ILE 37 CO 0.19 0.01 0.51 -0.31 0.00 0.00 0.00 174.94 175.34 2iyb s TYR 38 N 1.66 3.65 -0.26 3.97 2.02 0.29 -1.44 117.35 127.24 2iyb s TYR 38 Ca 0.05 1.05 0.00 0.00 -0.37 0.00 0.00 57.07 57.81 2iyb s TYR 38 Cb -0.17 -2.51 0.04 0.00 -0.40 0.00 0.00 41.96 38.92 2iyb s TYR 38 CO 0.08 0.38 -0.08 -1.58 -1.57 0.00 0.00 175.55 172.78 2iyb s HIS 39 N -0.19 3.14 -0.80 2.71 5.65 0.21 -1.56 115.29 124.45 2iyb s HIS 39 Ca 0.27 -1.88 -0.26 0.00 0.25 0.00 0.00 55.06 53.45 2iyb s HIS 39 Cb -0.17 -2.01 0.04 0.00 -1.18 0.00 0.00 32.58 29.25 2iyb s HIS 39 CO 0.14 -0.80 1.31 -1.58 -0.65 0.00 0.00 174.74 173.15 2iyb s HIS 40 N 1.23 2.35 0.42 3.88 2.46 0.51 -0.75 115.29 125.39 2iyb s HIS 40 Ca -0.03 -0.25 0.26 0.00 0.47 0.00 0.00 55.06 55.51 2iyb s HIS 40 Cb -0.18 -4.63 1.40 0.00 -0.13 0.00 0.00 32.58 29.04 2iyb s HIS 40 CO -0.05 -2.03 2.07 1.79 -2.47 0.00 0.00 174.74 174.05 2iyb h THR 41 N 6.19 0.63 -0.17 0.89 1.35 -1.89 0.29 112.91 120.20 2iyb h THR 41 Ca -0.17 -0.53 0.00 0.00 -0.55 0.00 0.00 66.41 65.15 2iyb h THR 41 Cb 1.04 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 68.79 2iyb h THR 41 CO 1.31 0.12 0.11 1.23 -0.25 0.00 0.00 175.52 178.04 2iyb h GLY 42 N 0.80 0.24 -0.16 5.82 0.00 -1.93 -3.33 103.07 104.51 2iyb h GLY 42 Ca -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 47.33 47.23 2iyb h GLY 42 CO 0.02 0.09 -0.53 0.70 0.00 0.00 0.00 176.54 176.82 2iyb n ASN 43 N -4.96 0.83 -3.59 0.19 5.03 -1.00 -5.00 115.26 106.76 2iyb n ASN 43 Ca -0.04 -0.91 -0.20 0.00 0.87 0.00 0.00 54.58 54.30 2iyb n ASN 43 Cb 0.04 0.87 0.06 0.00 -1.02 0.00 0.00 39.78 39.72 2iyb n ASN 43 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 2iyb n ASN 44 N -1.02 -1.97 -4.60 6.41 3.02 0.99 -5.03 115.26 113.06 2iyb n ASN 44 Ca 0.03 -0.72 -0.28 0.00 -0.03 0.00 0.00 54.58 53.59 2iyb n ASN 44 Cb 0.22 -4.57 -0.09 0.00 -0.61 0.00 0.00 39.78 34.73 2iyb n ASN 44 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2iyb s THR 45 N -3.50 3.42 0.06 3.41 -4.23 -1.15 -4.83 115.64 108.82 2iyb s THR 45 Ca 0.06 -1.41 0.04 0.00 -1.18 0.00 0.00 61.69 59.20 2iyb s THR 45 Cb -0.03 -2.65 -0.03 0.00 1.34 0.00 0.00 72.50 71.13 2iyb s THR 45 CO 0.77 -0.00 -0.12 -0.36 -0.54 0.00 0.00 174.62 174.37 2iyb s PHE 46 N -1.48 1.05 0.02 3.99 0.08 -1.26 -0.36 117.98 120.01 2iyb s PHE 46 Ca 0.24 -0.48 -0.10 0.00 0.12 0.00 0.00 56.93 56.71 2iyb s PHE 46 Cb -0.10 -0.60 0.01 0.00 -0.57 0.00 0.00 43.02 41.76 2iyb s PHE 46 CO 0.15 0.01 0.20 -0.98 -0.10 0.00 0.00 175.22 174.51 2iyb s ARG 47 N -1.73 0.62 -0.17 0.44 1.70 -0.60 -1.21 118.95 118.00 2iyb s ARG 47 Ca -0.04 -0.47 -0.22 0.00 -0.47 0.00 0.00 55.73 54.53 2iyb s ARG 47 Cb -0.10 0.26 -0.03 0.00 -0.57 0.00 0.00 34.95 34.52 2iyb s ARG 47 CO 0.02 -0.17 0.65 0.08 -1.08 0.00 0.00 175.30 174.80 2iyb s VAL 48 N -1.94 5.02 -0.11 4.99 1.01 0.14 -0.55 120.40 128.96 2iyb s VAL 48 Ca -0.10 1.26 0.01 0.00 0.00 0.00 0.00 61.98 63.15 2iyb s VAL 48 Cb -0.04 -3.97 0.02 0.00 0.00 0.00 0.00 36.38 32.39 2iyb s VAL 48 CO -0.00 0.14 -0.13 -0.69 0.00 0.00 0.00 175.10 174.41 2iyb s VAL 49 N 1.65 1.39 -0.10 2.92 1.01 -0.49 -0.44 120.40 126.34 2iyb s VAL 49 Ca 0.31 -0.56 0.02 0.00 0.00 0.00 0.00 61.98 61.76 2iyb s VAL 49 Cb -0.16 -1.30 0.01 0.00 0.00 0.00 0.00 36.38 34.93 2iyb s VAL 49 CO 0.12 0.42 -0.17 -0.83 0.00 0.00 0.00 175.10 174.64 2iyb s GLY 50 N 1.20 1.08 -0.10 4.51 0.00 -0.77 -0.15 107.32 113.09 2iyb s GLY 50 Ca -0.03 -0.75 0.02 0.00 0.00 0.00 0.00 44.72 43.96 2iyb s GLY 50 CO -0.04 0.07 -0.17 0.50 0.00 0.00 0.00 173.10 173.46 2iyb s ARG 51 N 0.77 2.34 0.22 2.90 0.52 0.14 -1.16 118.95 124.68 2iyb s ARG 51 Ca -0.11 -0.62 -0.32 0.00 -0.52 0.00 0.00 55.73 54.17 2iyb s ARG 51 Cb -0.16 -1.91 -0.14 0.00 0.52 0.00 0.00 34.95 33.26 2iyb s ARG 51 CO 0.02 0.01 1.35 1.17 0.02 0.00 0.00 175.30 177.87 2iyb n LYS 52 N 3.97 1.80 -0.23 3.54 3.00 0.40 -0.27 118.16 130.37 2iyb n LYS 52 Ca -0.20 0.64 -0.07 0.00 -0.00 0.00 0.00 58.31 58.68 2iyb n LYS 52 Cb 0.52 -2.26 0.06 0.00 0.00 0.00 0.00 35.03 33.34 2iyb n LYS 52 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 2iyb h ILE 53 N 2.98 1.26 -0.13 3.15 2.04 -1.58 0.36 117.51 125.59 2iyb h ILE 53 Ca -0.45 -1.03 -0.02 0.00 1.00 0.00 0.00 64.86 64.37 2iyb h ILE 53 Cb 1.29 0.63 -0.00 0.00 -0.74 0.00 0.00 36.82 38.00 2iyb h ILE 53 CO 0.75 0.39 0.00 -0.61 0.00 0.00 0.00 178.15 178.68 2iyb h GLN 54 N 1.02 0.22 0.00 2.37 4.15 -1.91 -3.39 115.11 117.58 2iyb h GLN 54 Ca 0.20 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.55 2iyb h GLN 54 Cb 0.43 -0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.10 2iyb h GLN 54 CO 0.01 0.45 0.00 -0.40 -1.93 0.00 0.00 178.83 176.96 2iyb n ASP 55 N -4.79 0.88 -2.15 -0.69 5.68 -1.23 -5.02 116.55 109.23 2iyb n ASP 55 Ca -0.06 -1.38 -0.17 0.00 -0.50 0.00 0.00 54.79 52.68 2iyb n ASP 55 Cb 0.20 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.15 2iyb n ASP 55 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 2iyb n HIS 56 N -0.19 -0.88 -1.89 2.11 8.25 0.13 -4.94 115.22 117.80 2iyb n HIS 56 Ca 0.00 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.04 2iyb n HIS 56 Cb 0.32 -3.35 -0.03 0.00 1.12 0.00 0.00 29.99 28.04 2iyb n HIS 56 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2iyb s GLN 57 N -4.58 4.20 -0.34 -0.41 0.74 -1.26 -4.50 119.66 113.50 2iyb s GLN 57 Ca 0.00 2.41 -0.29 0.00 0.05 0.00 0.00 55.36 57.53 2iyb s GLN 57 Cb 0.00 -3.16 0.01 0.00 1.10 0.00 0.00 33.01 30.96 2iyb s GLN 57 CO 0.00 -0.64 1.16 0.08 -0.55 0.00 0.00 175.29 175.34 2iyb s VAL 58 N 1.23 4.34 -0.33 1.34 1.01 -1.26 -0.45 120.40 126.27 2iyb s VAL 58 Ca 0.71 1.51 0.13 0.00 0.00 0.00 0.00 61.98 64.33 2iyb s VAL 58 Cb -0.45 -4.36 -0.17 0.00 0.00 0.00 0.00 36.38 31.40 2iyb s VAL 58 CO 0.31 -0.57 0.42 1.33 0.00 0.00 0.00 175.10 176.60 2iyb n VAL 59 N 6.14 0.00 -3.80 2.92 0.24 -0.31 -4.95 118.33 118.58 2iyb n VAL 59 Ca 0.13 -0.25 -0.13 0.00 -2.04 0.00 0.00 64.34 62.06 2iyb n VAL 59 Cb 0.47 0.63 -0.13 0.00 -1.47 0.00 0.00 33.84 33.35 2iyb n VAL 59 CO 0.00 0.00 0.00 -0.51 -2.14 0.00 0.00 176.83 174.18 2iyb s ILE 60 N -2.53 -0.01 -0.42 1.34 2.07 -1.22 -4.38 121.20 116.05 2iyb s ILE 60 Ca 0.00 0.05 0.04 0.00 -1.41 0.00 0.00 60.65 59.33 2iyb s ILE 60 Cb 0.09 -0.25 0.17 0.00 0.13 0.00 0.00 42.46 42.60 2iyb s ILE 60 CO 0.53 0.02 0.44 0.21 -1.91 0.00 0.00 174.94 174.23 2iyb s ASN 61 N 0.39 0.72 -0.16 4.50 2.47 -1.24 -1.85 114.94 119.77 2iyb s ASN 61 Ca -0.03 -2.30 0.01 0.00 0.42 0.00 0.00 52.86 50.97 2iyb s ASN 61 Cb -0.04 0.41 0.02 0.00 -1.45 0.00 0.00 41.25 40.19 2iyb s ASN 61 CO -0.02 -0.17 -0.17 0.00 -3.72 0.00 0.00 177.10 173.02 2iyb s ALA 63 N 1.36 2.93 -0.42 0.00 0.00 -1.26 0.28 121.76 124.65 2iyb s ALA 63 Ca 0.04 1.09 -0.10 0.00 0.00 0.00 0.00 51.96 52.99 2iyb s ALA 63 Cb -0.13 -3.45 0.07 0.00 0.00 0.00 0.00 23.12 19.61 2iyb s ALA 63 CO -0.11 -0.92 0.28 0.42 0.00 0.00 0.00 175.76 175.42 2iyb s ILE 64 N -1.44 4.40 0.52 0.00 1.01 -0.35 -4.83 121.20 120.51 2iyb s ILE 64 Ca 0.66 -1.32 -0.16 0.00 0.00 0.00 0.00 60.65 59.83 2iyb s ILE 64 Cb -0.33 -3.67 -0.07 0.00 0.01 0.00 0.00 42.46 38.39 2iyb s ILE 64 CO 0.40 -0.50 0.99 -2.16 0.00 0.00 0.00 174.94 173.67 2iyb s PRO 65 N 1.47 3.88 0.07 2.79 0.04 -1.26 -4.54 135.00 137.45 2iyb s PRO 65 Ca 0.03 0.99 -0.36 0.00 0.04 0.00 0.00 61.00 61.69 2iyb s PRO 65 Cb -0.23 -2.12 -0.16 0.00 0.04 0.00 0.00 34.50 32.03 2iyb s PRO 65 CO 0.03 -0.33 1.42 1.17 0.04 0.00 0.00 177.00 179.33 2iyb n LYS 66 N -1.62 1.33 -0.83 4.56 4.81 -1.26 -2.00 118.16 123.15 2iyb n LYS 66 Ca 0.07 0.48 0.00 0.00 -0.87 0.00 0.00 58.31 57.99 2iyb n LYS 66 Cb 0.54 -2.15 0.00 0.00 0.02 0.00 0.00 35.03 33.44 2iyb n LYS 66 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2iyb n GLY 67 N 2.81 0.52 3.69 3.14 0.00 -1.26 -5.01 105.19 109.08 2iyb n GLY 67 Ca 0.19 -0.60 -0.44 0.00 0.00 0.00 0.00 46.02 45.17 2iyb n GLY 67 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2iyb n LEU 68 N 0.00 3.66 -4.45 0.99 0.00 -0.85 -4.93 117.00 111.42 2iyb n LEU 68 Ca 0.00 1.03 -0.43 0.00 0.00 0.00 0.00 56.01 56.61 2iyb n LEU 68 Cb 0.00 -1.49 -0.04 0.00 0.00 0.00 0.00 43.42 41.89 2iyb n LEU 68 CO 0.00 0.00 0.68 -0.54 0.00 0.00 0.00 177.39 177.53 2iyb s LYS 69 N 1.95 3.12 -0.42 1.96 3.01 -1.26 -5.01 119.74 123.09 2iyb s LYS 69 Ca 0.81 -0.86 -0.20 0.00 -1.01 0.00 0.00 55.97 54.70 2iyb s LYS 69 Cb -0.58 -4.21 0.02 0.00 -1.01 0.00 0.00 37.83 32.05 2iyb s LYS 69 CO 0.38 -1.72 0.62 -0.47 0.51 0.00 0.00 175.35 174.67 2iyb s TYR 70 N 3.79 3.09 -0.43 3.18 5.04 -1.26 -4.54 117.35 126.21 2iyb s TYR 70 Ca 0.21 0.01 -0.16 0.00 -2.44 0.00 0.00 57.07 54.69 2iyb s TYR 70 Cb -0.18 -3.26 0.04 0.00 0.35 0.00 0.00 41.96 38.90 2iyb s TYR 70 CO 0.10 -0.80 0.37 1.21 -1.34 0.00 0.00 175.55 175.09 2iyb s ASN 71 N 1.94 6.14 -1.29 4.32 2.47 0.34 -4.98 114.94 123.89 2iyb s ASN 71 Ca 0.22 -0.97 -0.12 0.00 0.42 0.00 0.00 52.86 52.41 2iyb s ASN 71 Cb -0.14 -2.19 0.13 0.00 -1.45 0.00 0.00 41.25 37.60 2iyb s ASN 71 CO 0.18 -0.55 1.80 0.00 -3.72 0.00 0.00 177.10 174.80 2iyb n GLN 72 N 5.31 3.37 0.20 0.43 6.02 -1.26 -0.22 117.38 131.22 2iyb n GLN 72 Ca -0.10 -3.43 -0.15 0.00 -0.01 0.00 0.00 57.00 53.31 2iyb n GLN 72 Cb 0.46 -3.09 -0.07 0.00 1.02 0.00 0.00 30.24 28.56 2iyb n GLN 72 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2iyb h ALA 73 N 6.41 -0.55 -0.48 -1.58 0.00 -1.77 -3.44 119.26 117.84 2iyb h ALA 73 Ca 0.41 -0.09 -0.67 0.00 0.00 0.00 0.00 54.91 54.56 2iyb h ALA 73 Cb 0.73 0.34 -0.13 0.00 0.00 0.00 0.00 17.79 18.73 2iyb h ALA 73 CO 1.54 -0.83 -0.51 0.95 0.00 0.00 0.00 179.25 180.39 2iyb s THR 74 N -6.07 1.08 0.39 0.00 -4.23 -0.17 -4.99 115.64 101.64 2iyb s THR 74 Ca -0.16 -2.00 0.31 0.00 -1.18 0.00 0.00 61.69 58.66 2iyb s THR 74 Cb 0.06 -2.17 0.34 0.00 1.34 0.00 0.00 72.50 72.07 2iyb s THR 74 CO 0.64 0.00 2.10 0.06 -0.54 0.00 0.00 174.62 176.88 2iyb h GLN 75 N 1.39 0.00 0.00 3.99 -0.00 -2.01 -3.13 115.11 115.35 2iyb h GLN 75 Ca -0.43 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.22 2iyb h GLN 75 Cb 1.31 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.79 2iyb h GLN 75 CO 0.72 0.08 0.00 0.25 -0.00 0.00 0.00 178.83 179.88 2iyb n THR 76 N -3.43 0.07 -3.84 1.86 -2.24 -1.26 -4.63 114.28 100.80 2iyb n THR 76 Ca -0.01 -0.48 -0.28 0.00 -2.27 0.00 0.00 64.05 61.00 2iyb n THR 76 Cb 0.23 1.07 -0.16 0.00 -2.10 0.00 0.00 70.33 69.37 2iyb n THR 76 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2iyb s PHE 77 N -0.07 1.62 0.15 4.78 5.36 -1.18 -0.34 117.98 128.30 2iyb s PHE 77 Ca 0.00 -1.17 0.08 0.00 -0.96 0.00 0.00 56.93 54.89 2iyb s PHE 77 Cb 0.00 -1.27 -0.04 0.00 -0.34 0.00 0.00 43.02 41.37 2iyb s PHE 77 CO 0.00 -0.65 -0.11 -1.01 -1.46 0.00 0.00 175.22 171.99 2iyb s HIS 78 N 1.66 2.65 0.11 10.12 3.76 -0.90 -1.00 115.29 131.70 2iyb s HIS 78 Ca -0.02 -0.21 -0.10 0.00 -0.15 0.00 0.00 55.06 54.58 2iyb s HIS 78 Cb -0.17 -1.33 0.00 0.00 1.11 0.00 0.00 32.58 32.19 2iyb s HIS 78 CO -0.07 0.47 0.26 1.14 -0.85 0.00 0.00 174.74 175.69 2iyb s GLN 79 N -2.59 0.96 0.23 1.40 -2.07 0.69 -0.85 119.66 117.44 2iyb s GLN 79 Ca 0.23 -0.95 -0.19 0.00 -1.82 0.00 0.00 55.36 52.63 2iyb s GLN 79 Cb -0.10 0.38 0.03 0.00 -1.09 0.00 0.00 33.01 32.23 2iyb s GLN 79 CO 0.14 -0.33 0.60 1.67 -1.32 0.00 0.00 175.29 176.05 2iyb s TRP 80 N -3.87 -0.13 0.16 9.60 -2.14 -0.92 -0.50 118.94 121.13 2iyb s TRP 80 Ca 0.07 -0.24 0.05 0.00 2.66 0.00 0.00 56.10 58.64 2iyb s TRP 80 Cb 0.04 0.50 -0.04 0.00 -3.10 0.00 0.00 33.47 30.87 2iyb s TRP 80 CO -0.09 -1.04 -0.11 -0.98 -2.66 0.00 0.00 176.95 172.08 2iyb s ARG 81 N -3.89 1.11 0.06 3.25 1.70 -1.26 -0.51 118.95 119.41 2iyb s ARG 81 Ca 0.11 -1.48 0.00 0.00 -0.47 0.00 0.00 55.73 53.89 2iyb s ARG 81 Cb -0.03 -0.71 -0.00 0.00 -0.57 0.00 0.00 34.95 33.64 2iyb s ARG 81 CO 0.01 0.09 0.00 -0.40 -1.08 0.00 0.00 175.30 173.92 2iyb n ASP 82 N -0.23 2.00 0.25 -2.89 5.68 0.01 -4.89 116.55 116.48 2iyb n ASP 82 Ca -0.10 -1.25 0.10 0.00 -0.50 0.00 0.00 54.79 53.04 2iyb n ASP 82 Cb 0.61 0.05 0.69 0.00 -1.14 0.00 0.00 41.12 41.33 2iyb n ASP 82 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2iyb h ALA 83 N 1.04 1.95 -1.15 2.12 0.00 -2.05 -3.30 119.26 117.87 2iyb h ALA 83 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 2iyb h ALA 83 Cb 0.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 2iyb h ALA 83 CO 0.08 -0.05 0.00 0.54 0.00 0.00 0.00 179.25 179.82 2iyb n ARG 84 N -4.40 0.00 -4.27 0.00 3.00 -1.26 -5.05 116.66 104.67 2iyb n ARG 84 Ca -0.02 0.24 -0.23 0.00 -0.01 0.00 0.00 57.85 57.83 2iyb n ARG 84 Cb 0.13 -0.70 -0.07 0.00 0.00 0.00 0.00 32.46 31.81 2iyb n ARG 84 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2iyb s GLN 85 N -0.62 2.26 -0.24 5.56 -0.21 -1.24 -5.11 119.66 120.06 2iyb s GLN 85 Ca 0.00 -1.50 -0.10 0.00 0.02 0.00 0.00 55.36 53.78 2iyb s GLN 85 Cb 0.00 -2.12 -0.05 0.00 1.00 0.00 0.00 33.01 31.84 2iyb s GLN 85 CO 0.00 0.29 0.15 0.08 -2.12 0.00 0.00 175.29 173.69 2iyb s VAL 86 N -2.37 5.25 -0.04 1.09 1.01 -1.26 -0.81 120.40 123.26 2iyb s VAL 86 Ca 0.33 0.14 -0.07 0.00 0.00 0.00 0.00 61.98 62.38 2iyb s VAL 86 Cb -0.05 -3.44 -0.04 0.00 0.00 0.00 0.00 36.38 32.84 2iyb s VAL 86 CO 0.20 0.35 0.22 -0.31 0.00 0.00 0.00 175.10 175.57 2iyb s TYR 87 N 1.06 3.60 0.04 5.22 2.02 0.33 -2.67 117.35 126.95 2iyb s TYR 87 Ca 0.07 0.57 0.07 0.00 -0.37 0.00 0.00 57.07 57.41 2iyb s TYR 87 Cb -0.14 -1.98 -0.02 0.00 -0.40 0.00 0.00 41.96 39.42 2iyb s TYR 87 CO 0.04 0.67 -0.19 0.20 -1.57 0.00 0.00 175.55 174.70 2iyb s GLY 88 N -1.43 1.03 -0.19 0.71 0.00 0.14 -2.17 107.32 105.40 2iyb s GLY 88 Ca 0.23 -0.99 0.01 0.00 0.00 0.00 0.00 44.72 43.97 2iyb s GLY 88 CO 0.12 -0.93 -0.16 1.08 0.00 0.00 0.00 173.10 173.21 2iyb s LEU 89 N -1.16 2.32 -0.60 0.66 1.43 -0.03 -0.30 118.68 121.00 2iyb s LEU 89 Ca 0.06 -0.80 -0.12 0.00 -1.03 0.00 0.00 54.13 52.24 2iyb s LEU 89 Cb -0.08 -1.41 0.15 0.00 0.03 0.00 0.00 46.19 44.88 2iyb s LEU 89 CO 0.02 -0.07 0.52 0.21 0.23 0.00 0.00 176.35 177.26 2iyb s ASN 90 N 1.30 6.12 0.61 2.29 2.47 -0.57 -2.11 114.94 125.05 2iyb s ASN 90 Ca 0.01 -2.15 -0.15 0.00 0.42 0.00 0.00 52.86 50.99 2iyb s ASN 90 Cb -0.15 -2.12 -0.03 0.00 -1.45 0.00 0.00 41.25 37.50 2iyb s ASN 90 CO -0.10 -0.69 1.06 -0.36 -3.72 0.00 0.00 177.10 173.28 2iyb s PHE 91 N 1.01 3.00 -0.09 0.43 0.08 0.53 -0.52 117.98 122.42 2iyb s PHE 91 Ca 0.09 1.50 0.30 0.00 0.12 0.00 0.00 56.93 58.94 2iyb s PHE 91 Cb -0.23 -2.99 1.04 0.00 -0.57 0.00 0.00 43.02 40.27 2iyb s PHE 91 CO -0.02 -1.14 1.86 0.78 -0.10 0.00 0.00 175.22 176.60 2iyb h GLY 92 N 0.25 0.00 -2.32 4.36 0.00 -1.63 -3.47 103.07 100.27 2iyb h GLY 92 Ca -0.46 0.00 0.16 0.00 0.00 0.00 0.00 47.33 47.03 2iyb h GLY 92 CO 0.57 0.00 0.45 -1.35 0.00 0.00 0.00 176.54 176.21 2iyb s SER 93 N -5.79 -0.19 0.43 0.19 1.04 -1.26 -5.02 113.70 103.09 2iyb s SER 93 Ca 0.03 -0.42 0.14 0.00 0.48 0.00 0.00 55.95 56.17 2iyb s SER 93 Cb 0.08 0.52 0.94 0.00 0.10 0.00 0.00 66.02 67.66 2iyb s SER 93 CO 0.58 -0.96 1.96 0.11 0.98 0.00 0.00 173.24 175.91 2iyb h LYS 94 N 2.00 0.02 -0.16 4.02 1.57 -1.91 -2.60 116.57 119.52 2iyb h LYS 94 Ca -0.23 -0.01 -0.08 0.00 -1.87 0.00 0.00 60.65 58.47 2iyb h LYS 94 Cb 1.23 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.54 2iyb h LYS 94 CO 0.25 0.23 -0.20 1.49 -0.57 0.00 0.00 179.45 180.65 2iyb h GLU 95 N 0.02 0.42 -0.70 3.15 4.81 -1.96 -1.39 114.58 118.94 2iyb h GLU 95 Ca 0.00 -0.24 0.09 0.00 -0.13 0.00 0.00 59.36 59.08 2iyb h GLU 95 Cb 0.37 0.01 -0.07 0.00 0.63 0.00 0.00 28.75 29.70 2iyb h GLU 95 CO 0.03 0.81 0.36 -0.44 -0.73 0.00 0.00 179.01 179.03 2iyb h ASP 96 N 0.06 0.48 -0.24 1.04 3.32 -1.89 -1.18 116.42 118.00 2iyb h ASP 96 Ca 0.02 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 2iyb h ASP 96 Cb 0.75 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.26 2iyb h ASP 96 CO 0.05 0.28 0.03 0.00 -1.72 0.00 0.00 179.24 177.88 2iyb h ALA 97 N 1.41 0.32 -0.27 3.45 0.00 -1.39 -1.79 119.26 120.99 2iyb h ALA 97 Ca 0.34 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 2iyb h ALA 97 Cb 0.33 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2iyb h ALA 97 CO -0.25 0.01 -0.39 -0.91 0.00 0.00 0.00 179.25 177.71 2iyb h ASN 98 N 0.21 0.67 -0.70 0.00 2.35 -1.11 -0.77 115.58 116.23 2iyb h ASN 98 Ca 0.07 -0.29 -0.07 0.00 -0.55 0.00 0.00 56.30 55.46 2iyb h ASN 98 Cb 0.34 -0.19 -0.03 0.00 0.05 0.00 0.00 38.32 38.49 2iyb h ASN 98 CO 0.01 0.98 0.17 0.58 -1.65 0.00 0.00 177.43 177.52 2iyb h VAL 99 N 0.52 1.26 -0.22 2.81 2.07 -1.16 -1.46 116.25 120.08 2iyb h VAL 99 Ca 0.05 -0.96 -0.13 0.00 0.82 0.00 0.00 66.70 66.48 2iyb h VAL 99 Cb 0.90 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2iyb h VAL 99 CO 0.08 0.37 -0.36 0.15 0.02 0.00 0.00 177.57 177.83 2iyb h PHE 100 N 1.05 0.78 -0.72 1.57 3.57 -1.09 -2.75 116.94 119.35 2iyb h PHE 100 Ca 0.22 -0.27 -0.02 0.00 3.53 0.00 0.00 57.97 61.43 2iyb h PHE 100 Cb 0.37 -0.15 -0.03 0.00 2.79 0.00 0.00 35.95 38.92 2iyb h PHE 100 CO 0.03 1.02 0.38 0.00 -2.23 0.00 0.00 178.31 177.51 2iyb h ALA 101 N 0.63 0.92 -0.88 2.41 0.00 -1.07 0.23 119.26 121.49 2iyb h ALA 101 Ca 0.02 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 2iyb h ALA 101 Cb 0.95 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.41 2iyb h ALA 101 CO 0.08 0.44 0.49 0.77 0.00 0.00 0.00 179.25 181.03 2iyb h SER 102 N 0.99 1.10 -0.21 0.00 0.02 -1.27 -0.61 113.55 113.57 2iyb h SER 102 Ca 0.25 -0.10 -0.12 0.00 -0.84 0.00 0.00 61.79 60.98 2iyb h SER 102 Cb 0.05 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.30 2iyb h SER 102 CO -0.04 0.88 -0.27 0.00 -1.14 0.00 0.00 176.83 176.26 2iyb h ALA 103 N 1.26 0.89 -0.74 3.77 0.00 -1.11 -1.18 119.26 122.16 2iyb h ALA 103 Ca 0.31 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2iyb h ALA 103 Cb 0.02 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 2iyb h ALA 103 CO -0.05 0.63 0.27 1.98 0.00 0.00 0.00 179.25 182.08 2iyb h MET 104 N 0.60 1.11 -0.23 0.00 -1.53 -0.50 -0.20 114.93 114.19 2iyb h MET 104 Ca 0.08 -0.21 -0.15 0.00 -3.44 0.00 0.00 59.70 55.97 2iyb h MET 104 Cb 0.77 -0.17 -0.01 0.00 -0.55 0.00 0.00 31.60 31.64 2iyb h MET 104 CO 0.06 0.92 -0.47 0.52 0.14 0.00 0.00 176.91 178.09 2iyb h MET 105 N 1.07 0.61 -0.28 0.39 2.86 -0.95 -0.91 114.93 117.71 2iyb h MET 105 Ca 0.24 -0.34 -0.01 0.00 -2.06 0.00 0.00 59.70 57.53 2iyb h MET 105 Cb 0.24 0.02 -0.01 0.00 0.06 0.00 0.00 31.60 31.91 2iyb h MET 105 CO -0.02 0.95 0.14 1.25 1.06 0.00 0.00 176.91 180.29 2iyb h HIS 106 N 0.48 0.40 -0.17 -0.22 -0.00 -1.00 0.20 115.15 114.85 2iyb h HIS 106 Ca 0.03 -0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.43 2iyb h HIS 106 Cb 1.00 -0.13 -0.05 0.00 -0.00 0.00 0.00 27.41 28.23 2iyb h HIS 106 CO 0.04 0.36 -0.18 0.00 -0.00 0.00 0.00 177.93 178.16 2iyb h ALA 107 N 1.00 -0.08 -0.33 5.26 0.00 -0.84 -1.94 119.26 122.33 2iyb h ALA 107 Ca 0.10 0.06 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2iyb h ALA 107 Cb 0.11 0.36 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 2iyb h ALA 107 CO -0.01 -0.62 0.10 -0.07 0.00 0.00 0.00 179.25 178.65 2iyb h LEU 108 N -0.21 0.43 -0.07 0.00 3.38 -1.01 -0.19 115.31 117.64 2iyb h LEU 108 Ca 0.11 -0.05 0.03 0.00 0.09 0.00 0.00 57.88 58.06 2iyb h LEU 108 Cb 0.37 -0.11 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2iyb h LEU 108 CO -0.29 0.43 -0.14 -0.08 0.09 0.00 0.00 178.44 178.45 2iyb h GLU 109 N 0.47 -0.20 -0.60 1.13 4.81 0.01 -0.33 114.58 119.89 2iyb h GLU 109 Ca 0.11 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.27 2iyb h GLU 109 Cb 0.16 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.56 2iyb h GLU 109 CO -0.01 -0.13 0.01 0.28 -0.73 0.00 0.00 179.01 178.43 2iyb h VAL 110 N -0.20 1.27 0.00 0.32 2.07 -0.79 -2.84 116.25 116.07 2iyb h VAL 110 Ca 0.07 -1.13 -0.08 0.00 0.82 0.00 0.00 66.70 66.38 2iyb h VAL 110 Cb 0.31 0.81 -0.01 0.00 -1.52 0.00 0.00 31.29 30.87 2iyb h VAL 110 CO -0.19 0.41 -0.37 -0.07 0.02 0.00 0.00 177.57 177.36 2iyb h LEU 111 N 0.94 0.00 -1.99 2.57 3.38 -0.91 -2.72 115.31 116.58 2iyb h LEU 111 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 2iyb h LEU 111 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 2iyb h LEU 111 CO 0.03 0.37 0.00 0.59 0.09 0.00 0.00 178.44 179.52 2iyb n ASN 112 N -3.93 2.90 -0.16 -0.43 3.02 -0.15 -4.79 115.26 111.72 2iyb n ASN 112 Ca -0.02 -1.98 0.15 0.00 -0.03 0.00 0.00 54.58 52.71 2iyb n ASN 112 Cb 0.43 -0.34 0.81 0.00 -0.61 0.00 0.00 39.78 40.06 2iyb n ASN 112 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40