#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2iyb n SER 2 N 0.00 -7.07 -4.75 6.12 2.88 -1.26 -4.58 113.62 104.96 2iyb n SER 2 Ca 0.00 0.53 -0.41 0.00 -1.33 0.00 0.00 58.87 57.66 2iyb n SER 2 Cb 0.00 -3.69 -0.03 0.00 -0.75 0.00 0.00 64.21 59.74 2iyb n SER 2 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 2iyb s GLU 3 N -2.06 4.42 -0.28 -1.46 2.12 -1.26 -4.77 118.70 115.40 2iyb s GLU 3 Ca 0.19 2.07 -0.13 0.00 0.36 0.00 0.00 54.97 57.45 2iyb s GLU 3 Cb -0.03 -3.16 -0.04 0.00 0.26 0.00 0.00 34.13 31.16 2iyb s GLU 3 CO 0.66 -0.17 0.30 -0.65 -0.54 0.00 0.00 175.26 174.87 2iyb s GLN 4 N -0.79 3.93 -0.39 4.30 -1.52 -0.33 -4.88 119.66 119.98 2iyb s GLN 4 Ca 0.53 -0.16 -0.28 0.00 -1.95 0.00 0.00 55.36 53.49 2iyb s GLN 4 Cb -0.37 -3.68 0.02 0.00 -0.22 0.00 0.00 33.01 28.77 2iyb s GLN 4 CO 0.43 -0.27 1.06 0.45 -0.25 0.00 0.00 175.29 176.70 2iyb s SER 5 N 1.70 6.76 0.01 5.90 0.15 -1.26 0.55 113.70 127.50 2iyb s SER 5 Ca 0.11 0.71 0.23 0.00 0.70 0.00 0.00 55.95 57.70 2iyb s SER 5 Cb -0.16 -2.52 0.07 0.00 -1.71 0.00 0.00 66.02 61.70 2iyb s SER 5 CO 0.11 -1.01 1.09 2.30 1.20 0.00 0.00 173.24 176.93 2iyb n ILE 6 N 6.25 0.03 -3.58 6.45 -5.35 -0.15 -4.94 119.36 118.07 2iyb n ILE 6 Ca 0.11 -0.05 -0.16 0.00 -0.27 0.00 0.00 62.75 62.37 2iyb n ILE 6 Cb 0.48 0.58 -0.06 0.00 -1.74 0.00 0.00 39.64 38.90 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 -1.40 0.78 0.09 0.00 1.11 -1.26 -3.25 119.66 115.72 2iyb s GLN 8 Ca -0.11 -0.97 0.06 0.00 0.01 0.00 0.00 55.36 54.35 2iyb s GLN 8 Cb -0.01 -2.06 -0.04 0.00 -1.01 0.00 0.00 33.01 29.88 2iyb s GLN 8 CO 0.07 -0.90 -0.08 0.00 0.01 0.00 0.00 175.29 174.39 2iyb s ALA 9 N 1.63 3.02 -0.22 6.09 0.00 0.08 -4.91 121.76 127.44 2iyb s ALA 9 Ca 0.07 -1.20 -0.19 0.00 0.00 0.00 0.00 51.96 50.63 2iyb s ALA 9 Cb -0.17 -0.97 -0.03 0.00 0.00 0.00 0.00 23.12 21.95 2iyb s ALA 9 CO -0.21 0.65 0.57 1.03 0.00 0.00 0.00 175.76 177.80 2iyb s ARG 10 N -2.16 4.15 -0.06 0.00 0.52 -1.26 -0.07 118.95 120.07 2iyb s ARG 10 Ca 0.22 0.47 -0.24 0.00 -0.52 0.00 0.00 55.73 55.66 2iyb s ARG 10 Cb -0.11 -3.61 0.05 0.00 0.52 0.00 0.00 34.95 31.80 2iyb s ARG 10 CO 0.14 -0.27 0.53 0.00 0.02 0.00 0.00 175.30 175.72 2iyb s ALA 11 N 2.05 -1.37 -0.29 2.13 0.00 -0.65 -0.84 121.76 122.78 2iyb s ALA 11 Ca 0.25 1.02 -0.26 0.00 0.00 0.00 0.00 51.96 52.97 2iyb s ALA 11 Cb -0.16 -0.12 0.01 0.00 0.00 0.00 0.00 23.12 22.85 2iyb s ALA 11 CO 0.09 -0.32 0.92 0.00 0.00 0.00 0.00 175.76 176.46 2iyb s ALA 12 N -1.00 3.56 -0.09 0.00 0.00 -0.68 -0.10 121.76 123.45 2iyb s ALA 12 Ca -0.10 -0.18 -0.28 0.00 0.00 0.00 0.00 51.96 51.40 2iyb s ALA 12 Cb -0.02 -3.46 -0.02 0.00 0.00 0.00 0.00 23.12 19.62 2iyb s ALA 12 CO 0.07 -1.24 0.93 0.08 0.00 0.00 0.00 175.76 175.59 2iyb s VAL 13 N 3.21 4.85 0.15 0.00 1.01 -1.26 -1.59 120.40 126.78 2iyb s VAL 13 Ca 0.39 1.89 0.10 0.00 0.00 0.00 0.00 61.98 64.35 2iyb s VAL 13 Cb -0.14 -4.25 -0.04 0.00 0.00 0.00 0.00 36.38 31.96 2iyb s VAL 13 CO 0.12 0.07 -0.19 -0.04 0.00 0.00 0.00 175.10 175.06 2iyb s MET 14 N 1.71 1.73 0.02 2.72 -1.94 0.48 -0.30 119.30 123.72 2iyb s MET 14 Ca 0.46 -1.32 0.07 0.00 -1.71 0.00 0.00 55.69 53.19 2iyb s MET 14 Cb -0.18 -2.03 -0.02 0.00 2.01 0.00 0.00 34.83 34.61 2iyb s MET 14 CO 0.19 0.44 -0.20 0.14 -0.01 0.00 0.00 175.02 175.58 2iyb s VAL 15 N -1.41 1.58 -0.15 -6.03 -7.23 0.48 -0.70 120.40 106.94 2iyb s VAL 15 Ca 0.20 -1.05 -0.26 0.00 -1.81 0.00 0.00 61.98 59.07 2iyb s VAL 15 Cb -0.09 -1.35 -0.02 0.00 0.56 0.00 0.00 36.38 35.48 2iyb s VAL 15 CO 0.11 0.28 0.84 -0.47 -0.31 0.00 0.00 175.10 175.54 2iyb s TYR 16 N -0.67 3.45 -0.89 2.82 5.04 -0.36 -0.73 117.35 126.01 2iyb s TYR 16 Ca 0.07 1.30 -0.21 0.00 -2.44 0.00 0.00 57.07 55.80 2iyb s TYR 16 Cb -0.08 -3.01 0.10 0.00 0.35 0.00 0.00 41.96 39.31 2iyb s TYR 16 CO 0.01 -0.20 1.17 0.34 -1.34 0.00 0.00 175.55 175.53 2iyb s ASP 17 N 1.11 6.50 0.29 4.32 -1.08 0.27 -4.70 116.67 123.38 2iyb s ASP 17 Ca 0.40 -1.67 0.04 0.00 -0.52 0.00 0.00 52.55 50.79 2iyb s ASP 17 Cb -0.17 -2.44 0.70 0.00 -1.46 0.00 0.00 42.92 39.55 2iyb s ASP 17 CO 0.14 -1.25 1.73 0.44 0.52 0.00 0.00 175.17 176.75 2iyb h ASP 18 N 9.21 0.52 -0.27 -0.34 3.32 -1.94 -0.77 116.42 126.15 2iyb h ASP 18 Ca 0.07 0.12 -0.16 0.00 0.02 0.00 0.00 57.03 57.08 2iyb h ASP 18 Cb 1.03 0.05 -0.01 0.00 0.22 0.00 0.00 39.33 40.63 2iyb h ASP 18 CO 1.19 0.12 -0.43 0.00 -1.72 0.00 0.00 179.24 178.41 2iyb h ALA 19 N 1.66 0.63 -0.17 3.45 0.00 -1.94 -3.11 119.26 119.78 2iyb h ALA 19 Ca 0.55 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2iyb h ALA 19 Cb 0.95 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.63 2iyb h ALA 19 CO -0.45 0.67 0.00 0.09 0.00 0.00 0.00 179.25 179.56 2iyb n ASN 20 N -4.04 2.81 -3.75 0.00 3.02 -0.99 -4.98 115.26 107.34 2iyb n ASN 20 Ca -0.02 -1.90 -0.33 0.00 -0.03 0.00 0.00 54.58 52.30 2iyb n ASN 20 Cb 0.56 -0.10 0.03 0.00 -0.61 0.00 0.00 39.78 39.66 2iyb n ASN 20 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2iyb n LYS 21 N 1.13 -1.02 -3.66 3.52 4.76 -0.33 -4.97 118.16 117.59 2iyb n LYS 21 Ca 0.17 0.45 -0.14 0.00 -2.87 0.00 0.00 58.31 55.93 2iyb n LYS 21 Cb 0.54 -3.65 -0.08 0.00 -1.84 0.00 0.00 35.03 30.00 2iyb n LYS 21 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2iyb s LYS 22 N -6.05 0.73 0.08 1.97 2.20 -1.04 -5.02 119.74 112.60 2iyb s LYS 22 Ca 0.41 0.88 -0.29 0.00 -0.36 0.00 0.00 55.97 56.60 2iyb s LYS 22 Cb -0.17 0.35 -0.05 0.00 -1.51 0.00 0.00 37.83 36.45 2iyb s LYS 22 CO 0.89 -0.09 0.93 -1.58 -0.36 0.00 0.00 175.35 175.14 2iyb s TRP 23 N 0.35 3.77 0.20 4.03 0.52 -1.26 0.98 118.94 127.52 2iyb s TRP 23 Ca -0.00 1.73 0.08 0.00 0.02 0.00 0.00 56.10 57.92 2iyb s TRP 23 Cb -0.04 -3.03 -0.05 0.00 -1.15 0.00 0.00 33.47 29.20 2iyb s TRP 23 CO 0.01 0.17 -0.15 0.14 0.02 0.00 0.00 176.95 177.13 2iyb s VAL 24 N 0.21 1.76 0.25 4.03 -7.23 0.09 -4.90 120.40 114.62 2iyb s VAL 24 Ca 0.47 -2.18 -0.30 0.00 -1.81 0.00 0.00 61.98 58.16 2iyb s VAL 24 Cb -0.22 -2.02 -0.10 0.00 0.56 0.00 0.00 36.38 34.60 2iyb s VAL 24 CO 0.28 -0.55 1.39 -2.84 -0.31 0.00 0.00 175.10 173.07 2iyb s PRO 25 N -3.52 4.31 0.42 4.82 0.02 -1.26 -0.39 135.00 139.41 2iyb s PRO 25 Ca 0.22 2.23 -0.25 0.00 0.02 0.00 0.00 61.00 63.21 2iyb s PRO 25 Cb -0.02 -3.13 -0.08 0.00 0.02 0.00 0.00 34.50 31.30 2iyb s PRO 25 CO 0.07 -0.34 1.32 0.00 -0.33 0.00 0.00 177.00 177.72 2iyb s ALA 26 N -0.14 3.22 0.00 -1.55 0.00 0.59 -2.76 121.76 121.12 2iyb s ALA 26 Ca 0.57 1.27 0.00 0.00 0.00 0.00 0.00 51.96 53.80 2iyb s ALA 26 Cb -0.40 -3.51 0.00 0.00 0.00 0.00 0.00 23.12 19.21 2iyb s ALA 26 CO 0.43 -0.92 0.00 0.41 0.00 0.00 0.00 175.76 175.69 2iyb n GLY 27 N 0.64 1.31 0.00 0.00 0.00 -1.26 -3.98 105.19 101.90 2iyb n GLY 27 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 3.34 3.21 -0.02 0.00 -1.11 -5.06 105.19 103.55 2iyb n GLY 28 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.87 2.29 0.96 1.61 1.04 -1.26 -4.89 113.70 112.58 2iyb s SER 29 Ca 0.00 -0.42 -0.12 0.00 0.48 0.00 0.00 55.95 55.89 2iyb s SER 29 Cb 0.00 -0.22 0.12 0.00 0.10 0.00 0.00 66.02 66.02 2iyb s SER 29 CO 0.00 0.19 0.84 0.35 0.98 0.00 0.00 173.24 175.60 2iyb n THR 30 N 2.27 0.00 0.00 2.02 -2.24 -1.26 -4.70 114.28 110.36 2iyb n THR 30 Ca -0.16 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2iyb n THR 30 Cb 0.53 -0.85 0.00 0.00 -2.10 0.00 0.00 70.33 67.91 2iyb n THR 30 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2iyb n GLY 31 N 0.82 3.90 3.80 3.38 0.00 -1.26 -5.09 105.19 110.74 2iyb n GLY 31 Ca 0.09 -1.51 -0.35 0.00 0.00 0.00 0.00 46.02 44.26 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 -1.74 3.22 0.26 1.61 0.08 -1.26 -4.52 117.98 115.63 2iyb s PHE 32 Ca 0.00 1.62 0.10 0.00 0.12 0.00 0.00 56.93 58.78 2iyb s PHE 32 Cb 0.00 -3.00 -0.05 0.00 -0.57 0.00 0.00 43.02 39.40 2iyb s PHE 32 CO 0.00 -0.46 -0.08 -1.12 -0.10 0.00 0.00 175.22 173.46 2iyb s SER 33 N -1.91 4.20 -0.28 1.36 0.01 0.86 -1.73 113.70 116.21 2iyb s SER 33 Ca 0.62 -0.77 -0.17 0.00 1.31 0.00 0.00 55.95 56.94 2iyb s SER 33 Cb -0.16 -0.65 -0.03 0.00 0.21 0.00 0.00 66.02 65.40 2iyb s SER 33 CO 0.20 0.02 0.46 -0.60 0.41 0.00 0.00 173.24 173.73 2iyb s ARG 34 N -3.53 3.95 -0.20 12.44 3.52 -0.32 -1.64 118.95 133.17 2iyb s ARG 34 Ca 0.30 0.11 -0.04 0.00 -0.13 0.00 0.00 55.73 55.97 2iyb s ARG 34 Cb -0.06 -3.69 -0.02 0.00 -1.56 0.00 0.00 34.95 29.62 2iyb s ARG 34 CO 0.18 -0.39 -0.04 0.08 -0.81 0.00 0.00 175.30 174.32 2iyb s VAL 35 N 2.24 3.54 0.22 7.11 1.01 0.89 -1.28 120.40 134.12 2iyb s VAL 35 Ca 0.18 -0.45 0.08 0.00 0.00 0.00 0.00 61.98 61.79 2iyb s VAL 35 Cb -0.16 -2.59 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 2iyb s VAL 35 CO 0.10 0.44 0.02 -1.00 0.00 0.00 0.00 175.10 174.67 2iyb s HIS 36 N 1.10 2.83 -0.25 5.22 0.09 0.79 -0.74 115.29 124.33 2iyb s HIS 36 Ca 0.01 -0.16 -0.08 0.00 -0.00 0.00 0.00 55.06 54.84 2iyb s HIS 36 Cb -0.15 -1.32 -0.03 0.00 -0.00 0.00 0.00 32.58 31.09 2iyb s HIS 36 CO -0.00 0.55 0.08 0.42 -0.00 0.00 0.00 174.74 175.79 2iyb s ILE 37 N -1.99 4.41 -0.16 0.60 1.01 -1.20 -1.91 121.20 121.96 2iyb s ILE 37 Ca 0.30 -0.14 -0.10 0.00 0.00 0.00 0.00 60.65 60.71 2iyb s ILE 37 Cb -0.08 -3.06 -0.05 0.00 0.01 0.00 0.00 42.46 39.28 2iyb s ILE 37 CO 0.20 0.34 0.16 -0.31 0.00 0.00 0.00 174.94 175.33 2iyb s TYR 38 N 1.55 3.49 -0.29 3.97 2.02 -0.24 -0.98 117.35 126.87 2iyb s TYR 38 Ca 0.06 0.45 -0.03 0.00 -0.37 0.00 0.00 57.07 57.18 2iyb s TYR 38 Cb -0.15 -2.11 0.04 0.00 -0.40 0.00 0.00 41.96 39.33 2iyb s TYR 38 CO 0.04 0.44 0.01 -1.58 -1.57 0.00 0.00 175.55 172.89 2iyb s HIS 39 N -0.13 3.19 -0.64 2.71 5.65 0.19 -1.38 115.29 124.88 2iyb s HIS 39 Ca 0.12 -1.61 -0.27 0.00 0.25 0.00 0.00 55.06 53.55 2iyb s HIS 39 Cb -0.12 -2.14 0.03 0.00 -1.18 0.00 0.00 32.58 29.18 2iyb s HIS 39 CO 0.01 -0.74 1.18 -1.58 -0.65 0.00 0.00 174.74 172.95 2iyb s HIS 40 N 1.32 2.52 -0.01 3.88 2.46 0.12 -1.19 115.29 124.40 2iyb s HIS 40 Ca -0.02 0.12 0.18 0.00 0.47 0.00 0.00 55.06 55.81 2iyb s HIS 40 Cb -0.19 -4.49 0.42 0.00 -0.13 0.00 0.00 32.58 28.20 2iyb s HIS 40 CO -0.01 -1.74 1.61 1.79 -2.47 0.00 0.00 174.74 173.92 2iyb h THR 41 N 6.08 0.80 0.41 0.89 1.35 -1.84 0.24 112.91 120.84 2iyb h THR 41 Ca -0.26 -1.79 -0.02 0.00 -0.55 0.00 0.00 66.41 63.79 2iyb h THR 41 Cb 1.06 2.15 0.00 0.00 -1.73 0.00 0.00 68.15 69.63 2iyb h THR 41 CO 1.21 0.40 -0.20 1.23 -0.25 0.00 0.00 175.52 177.91 2iyb h GLY 42 N 2.80 -0.58 1.42 5.82 0.00 -1.90 -3.31 103.07 107.33 2iyb h GLY 42 Ca -0.00 0.21 0.00 0.00 0.00 0.00 0.00 47.33 47.54 2iyb h GLY 42 CO 0.05 -0.21 -0.41 0.70 0.00 0.00 0.00 176.54 176.67 2iyb n ASN 43 N -5.27 0.69 -3.44 0.19 3.02 -1.10 -4.95 115.26 104.39 2iyb n ASN 43 Ca -0.11 0.24 -0.21 0.00 -0.03 0.00 0.00 54.58 54.47 2iyb n ASN 43 Cb 0.27 -0.13 0.08 0.00 -0.61 0.00 0.00 39.78 39.38 2iyb n ASN 43 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2iyb n ASN 44 N -2.09 -5.00 -4.55 6.41 5.15 0.82 -5.03 115.26 110.97 2iyb n ASN 44 Ca 0.04 -0.54 -0.25 0.00 -0.60 0.00 0.00 54.58 53.23 2iyb n ASN 44 Cb 0.43 -4.90 -0.10 0.00 -0.53 0.00 0.00 39.78 34.68 2iyb n ASN 44 CO 0.00 0.00 0.00 0.42 1.40 0.00 0.00 177.26 179.08 2iyb s THR 45 N -3.32 2.40 0.06 -0.44 -4.23 -1.00 -4.93 115.64 104.17 2iyb s THR 45 Ca 0.40 -2.19 0.04 0.00 -1.18 0.00 0.00 61.69 58.76 2iyb s THR 45 Cb -0.18 -2.62 -0.03 0.00 1.34 0.00 0.00 72.50 71.02 2iyb s THR 45 CO 0.70 -0.24 -0.12 -0.36 -0.54 0.00 0.00 174.62 174.06 2iyb s PHE 46 N -2.56 1.01 0.05 3.99 0.08 -1.26 -0.70 117.98 118.59 2iyb s PHE 46 Ca 0.32 -0.47 -0.08 0.00 0.12 0.00 0.00 56.93 56.82 2iyb s PHE 46 Cb 0.00 -0.58 -0.00 0.00 -0.57 0.00 0.00 43.02 41.87 2iyb s PHE 46 CO 0.17 0.01 0.17 -0.98 -0.10 0.00 0.00 175.22 174.48 2iyb s ARG 47 N -1.66 0.72 -0.20 0.44 1.70 -0.48 -0.69 118.95 118.78 2iyb s ARG 47 Ca -0.05 -0.77 -0.15 0.00 -0.47 0.00 0.00 55.73 54.29 2iyb s ARG 47 Cb -0.10 0.29 -0.04 0.00 -0.57 0.00 0.00 34.95 34.53 2iyb s ARG 47 CO 0.02 -0.21 0.38 0.08 -1.08 0.00 0.00 175.30 174.49 2iyb s VAL 48 N -3.00 5.22 -0.14 4.99 1.01 -0.13 -1.08 120.40 127.27 2iyb s VAL 48 Ca -0.02 0.67 0.00 0.00 0.00 0.00 0.00 61.98 62.64 2iyb s VAL 48 Cb 0.01 -3.71 0.02 0.00 0.00 0.00 0.00 36.38 32.70 2iyb s VAL 48 CO -0.06 0.27 -0.12 -0.69 0.00 0.00 0.00 175.10 174.50 2iyb s VAL 49 N 1.19 1.41 -0.11 2.92 1.01 -0.80 -1.62 120.40 124.40 2iyb s VAL 49 Ca 0.18 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.65 2iyb s VAL 49 Cb -0.14 -1.35 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 2iyb s VAL 49 CO 0.07 0.43 -0.17 -0.83 0.00 0.00 0.00 175.10 174.61 2iyb s GLY 50 N 1.52 1.46 -0.08 4.51 0.00 0.13 -0.15 107.32 114.71 2iyb s GLY 50 Ca 0.04 -0.93 -0.01 0.00 0.00 0.00 0.00 44.72 43.82 2iyb s GLY 50 CO -0.10 -0.30 -0.01 -1.60 0.00 0.00 0.00 173.10 171.10 2iyb s ARG 51 N 0.24 0.73 0.16 2.90 3.52 -0.41 -0.77 118.95 125.32 2iyb s ARG 51 Ca -0.11 0.03 -0.33 0.00 -0.13 0.00 0.00 55.73 55.18 2iyb s ARG 51 Cb -0.16 -1.12 -0.16 0.00 -1.56 0.00 0.00 34.95 31.95 2iyb s ARG 51 CO 0.06 -0.32 1.16 1.63 -0.81 0.00 0.00 175.30 177.02 2iyb n LYS 52 N 5.12 1.11 -0.03 5.12 4.76 0.47 -1.17 118.16 133.53 2iyb n LYS 52 Ca -0.08 0.40 -0.13 0.00 -2.87 0.00 0.00 58.31 55.63 2iyb n LYS 52 Cb 0.50 -1.89 -0.00 0.00 -1.84 0.00 0.00 35.03 31.79 2iyb n LYS 52 CO 0.00 0.00 0.00 0.82 -1.37 0.00 0.00 177.40 176.85 2iyb h ILE 53 N 2.68 1.30 0.03 -0.18 2.04 -1.66 -1.93 117.51 119.79 2iyb h ILE 53 Ca -0.43 -1.81 -0.00 0.00 1.00 0.00 0.00 64.86 63.62 2iyb h ILE 53 Cb 1.35 1.75 0.00 0.00 -0.74 0.00 0.00 36.82 39.17 2iyb h ILE 53 CO 0.70 0.57 -0.02 -0.61 0.00 0.00 0.00 178.15 178.80 2iyb h GLN 54 N 0.54 -0.04 -0.28 2.37 5.75 -1.90 -3.40 115.11 118.14 2iyb h GLN 54 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 2iyb h GLN 54 Cb 1.17 0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.73 2iyb h GLN 54 CO 0.12 -0.03 0.00 -0.40 -2.65 0.00 0.00 178.83 175.87 2iyb n ASP 55 N -2.19 2.81 -0.34 -0.69 5.68 -1.26 -4.99 116.55 115.56 2iyb n ASP 55 Ca -0.01 -1.84 -0.04 0.00 -0.50 0.00 0.00 54.79 52.39 2iyb n ASP 55 Cb 0.02 -0.18 -0.02 0.00 -1.14 0.00 0.00 41.12 39.80 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 0.81 0.00 -2.07 2.11 8.25 -0.72 -4.97 115.22 118.62 2iyb n HIS 56 Ca 0.12 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.16 2iyb n HIS 56 Cb 0.43 -1.32 -0.03 0.00 1.12 0.00 0.00 29.99 30.19 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 -1.81 4.27 -0.32 -0.41 0.74 -1.26 -4.49 119.66 116.38 2iyb s GLN 57 Ca 0.00 2.19 -0.29 0.00 0.05 0.00 0.00 55.36 57.31 2iyb s GLN 57 Cb 0.00 -3.27 0.00 0.00 1.10 0.00 0.00 33.01 30.84 2iyb s GLN 57 CO 0.00 -0.53 1.34 0.08 -0.55 0.00 0.00 175.29 175.63 2iyb s VAL 58 N 1.35 4.07 -0.29 1.34 1.01 -1.26 -0.39 120.40 126.23 2iyb s VAL 58 Ca 0.67 1.19 0.15 0.00 0.00 0.00 0.00 61.98 63.99 2iyb s VAL 58 Cb -0.39 -4.15 -0.20 0.00 0.00 0.00 0.00 36.38 31.64 2iyb s VAL 58 CO 0.30 -0.53 0.44 1.33 0.00 0.00 0.00 175.10 176.65 2iyb n VAL 59 N 6.40 0.00 -3.78 2.92 0.24 0.05 -4.93 118.33 119.23 2iyb n VAL 59 Ca 0.15 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.34 62.05 2iyb n VAL 59 Cb 0.47 0.50 -0.14 0.00 -1.47 0.00 0.00 33.84 33.20 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 -2.76 -0.03 -0.40 1.34 2.07 -1.17 -4.27 121.20 115.97 2iyb s ILE 60 Ca -0.01 0.12 0.05 0.00 -1.41 0.00 0.00 60.65 59.40 2iyb s ILE 60 Cb 0.10 -0.22 0.17 0.00 0.13 0.00 0.00 42.46 42.64 2iyb s ILE 60 CO 0.61 0.05 0.49 0.21 -1.91 0.00 0.00 174.94 174.39 2iyb s ASN 61 N 0.78 0.01 -0.01 4.50 2.47 -1.24 -0.70 114.94 120.75 2iyb s ASN 61 Ca -0.06 -1.39 -0.02 0.00 0.42 0.00 0.00 52.86 51.81 2iyb s ASN 61 Cb -0.08 1.12 0.00 0.00 -1.45 0.00 0.00 41.25 40.84 2iyb s ASN 61 CO -0.04 -0.20 0.05 0.00 -3.72 0.00 0.00 177.10 173.19 2iyb n ALA 63 N 2.74 1.20 -3.09 0.00 0.00 -1.26 -0.96 120.51 119.14 2iyb n ALA 63 Ca -0.14 0.01 -0.45 0.00 0.00 0.00 0.00 53.44 52.86 2iyb n ALA 63 Cb 0.59 -2.33 -0.06 0.00 0.00 0.00 0.00 19.45 17.65 2iyb n ALA 63 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2iyb s ILE 64 N -1.37 5.19 0.63 0.00 1.01 0.14 -4.76 121.20 122.04 2iyb s ILE 64 Ca 0.82 -1.26 -0.12 0.00 0.00 0.00 0.00 60.65 60.09 2iyb s ILE 64 Cb -0.38 -4.26 -0.03 0.00 0.01 0.00 0.00 42.46 37.80 2iyb s ILE 64 CO 0.41 -0.76 1.04 -2.16 0.00 0.00 0.00 174.94 173.47 2iyb s PRO 65 N 1.70 3.39 0.61 2.79 0.04 -1.26 -4.53 135.00 137.74 2iyb s PRO 65 Ca 0.04 0.89 0.37 0.00 0.04 0.00 0.00 61.00 62.34 2iyb s PRO 65 Cb -0.27 -2.05 1.97 0.00 0.04 0.00 0.00 34.50 34.19 2iyb s PRO 65 CO 0.05 -0.74 2.24 1.57 0.04 0.00 0.00 177.00 180.16 2iyb h LYS 66 N -0.23 0.00 -0.66 4.56 2.10 -1.96 -2.40 116.57 117.99 2iyb h LYS 66 Ca -0.45 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.20 2iyb h LYS 66 Cb 1.20 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.53 2iyb h LYS 66 CO 0.60 0.02 0.00 0.41 -2.00 0.00 0.00 179.45 178.48 2iyb n GLY 67 N -0.87 2.63 3.73 0.07 0.00 -1.26 -4.84 105.19 104.65 2iyb n GLY 67 Ca -0.02 -0.83 -0.42 0.00 0.00 0.00 0.00 46.02 44.75 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 1.10 4.20 -4.28 0.99 0.00 -0.91 -4.97 117.00 113.13 2iyb n LEU 68 Ca 0.25 1.10 -0.41 0.00 0.00 0.00 0.00 56.01 56.95 2iyb n LEU 68 Cb 0.88 -1.59 -0.09 0.00 0.00 0.00 0.00 43.42 42.62 2iyb n LEU 68 CO 0.24 0.19 -0.08 -0.54 0.00 0.00 0.00 177.39 177.20 2iyb s LYS 69 N 0.40 2.66 -0.45 1.96 3.01 -1.26 -5.04 119.74 121.01 2iyb s LYS 69 Ca 0.70 -1.47 -0.21 0.00 -1.01 0.00 0.00 55.97 53.98 2iyb s LYS 69 Cb -0.50 -3.85 0.03 0.00 -1.01 0.00 0.00 37.83 32.50 2iyb s LYS 69 CO 0.40 -0.99 0.68 -0.47 0.51 0.00 0.00 175.35 175.48 2iyb s TYR 70 N 1.45 3.03 -0.49 3.18 5.04 -1.26 -4.30 117.35 124.00 2iyb s TYR 70 Ca 0.03 -0.07 -0.18 0.00 -2.44 0.00 0.00 57.07 54.42 2iyb s TYR 70 Cb -0.23 -3.46 0.06 0.00 0.35 0.00 0.00 41.96 38.68 2iyb s TYR 70 CO 0.03 -0.94 0.54 1.21 -1.34 0.00 0.00 175.55 175.05 2iyb s ASN 71 N 2.14 6.20 -1.34 4.32 2.47 0.62 -4.98 114.94 124.37 2iyb s ASN 71 Ca 0.24 -1.06 -0.14 0.00 0.42 0.00 0.00 52.86 52.31 2iyb s ASN 71 Cb -0.14 -2.25 0.09 0.00 -1.45 0.00 0.00 41.25 37.50 2iyb s ASN 71 CO 0.19 -0.80 1.90 0.00 -3.72 0.00 0.00 177.10 174.67 2iyb n GLN 72 N 5.81 3.18 -0.06 0.43 6.02 -1.26 -0.98 117.38 130.52 2iyb n GLN 72 Ca -0.09 -3.17 -0.10 0.00 -0.01 0.00 0.00 57.00 53.63 2iyb n GLN 72 Cb 0.45 -3.24 -0.03 0.00 1.02 0.00 0.00 30.24 28.43 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 6.58 0.30 -1.79 -1.58 0.00 -1.87 -3.44 119.26 117.45 2iyb h ALA 73 Ca 0.46 -0.07 -0.53 0.00 0.00 0.00 0.00 54.91 54.77 2iyb h ALA 73 Cb 0.74 -0.09 -0.13 0.00 0.00 0.00 0.00 17.79 18.30 2iyb h ALA 73 CO 1.62 -0.16 -0.53 0.95 0.00 0.00 0.00 179.25 181.12 2iyb s THR 74 N -5.79 0.64 0.49 0.00 -4.23 -0.41 -5.00 115.64 101.34 2iyb s THR 74 Ca -0.13 -2.00 0.16 0.00 -1.18 0.00 0.00 61.69 58.53 2iyb s THR 74 Cb 0.08 -2.43 0.23 0.00 1.34 0.00 0.00 72.50 71.72 2iyb s THR 74 CO 0.71 0.00 2.08 0.06 -0.54 0.00 0.00 174.62 176.93 2iyb h GLN 75 N 1.89 0.00 0.00 3.99 -0.00 -2.00 -3.19 115.11 115.80 2iyb h GLN 75 Ca -0.36 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.29 2iyb h GLN 75 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.75 2iyb h GLN 75 CO 0.58 0.08 0.00 0.25 -0.00 0.00 0.00 178.83 179.74 2iyb n THR 76 N -4.42 0.00 -4.02 1.86 -2.24 -1.26 -4.76 114.28 99.44 2iyb n THR 76 Ca -0.03 -0.48 -0.31 0.00 -2.27 0.00 0.00 64.05 60.96 2iyb n THR 76 Cb 0.16 1.04 -0.16 0.00 -2.10 0.00 0.00 70.33 69.27 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 -0.17 2.68 0.18 4.78 5.36 -1.21 -0.21 117.98 129.40 2iyb s PHE 77 Ca 0.00 -1.80 0.09 0.00 -0.96 0.00 0.00 56.93 54.26 2iyb s PHE 77 Cb 0.00 -1.74 -0.04 0.00 -0.34 0.00 0.00 43.02 40.90 2iyb s PHE 77 CO 0.00 -0.79 -0.10 -1.01 -1.46 0.00 0.00 175.22 171.86 2iyb s HIS 78 N 1.31 2.62 0.06 10.12 3.76 -0.77 -1.28 115.29 131.11 2iyb s HIS 78 Ca -0.03 -0.23 -0.16 0.00 -0.15 0.00 0.00 55.06 54.50 2iyb s HIS 78 Cb -0.17 -1.28 0.03 0.00 1.11 0.00 0.00 32.58 32.27 2iyb s HIS 78 CO -0.08 0.52 0.37 1.14 -0.85 0.00 0.00 174.74 175.84 2iyb s GLN 79 N -2.86 0.90 -0.01 1.40 -2.07 -0.16 0.38 119.66 117.24 2iyb s GLN 79 Ca 0.25 -0.49 -0.23 0.00 -1.82 0.00 0.00 55.36 53.07 2iyb s GLN 79 Cb -0.09 0.40 0.05 0.00 -1.09 0.00 0.00 33.01 32.28 2iyb s GLN 79 CO 0.15 -0.31 0.51 1.67 -1.32 0.00 0.00 175.29 175.99 2iyb s TRP 80 N -2.76 -0.43 0.06 9.60 -2.14 -0.64 -0.28 118.94 122.35 2iyb s TRP 80 Ca -0.04 0.65 -0.27 0.00 2.66 0.00 0.00 56.10 59.11 2iyb s TRP 80 Cb -0.00 0.28 -0.05 0.00 -3.10 0.00 0.00 33.47 30.60 2iyb s TRP 80 CO -0.04 -0.55 0.84 0.50 -2.66 0.00 0.00 176.95 175.04 2iyb s ARG 81 N -1.60 4.56 -0.37 3.25 3.52 -1.26 -1.35 118.95 125.70 2iyb s ARG 81 Ca -0.10 1.20 0.01 0.00 -0.13 0.00 0.00 55.73 56.71 2iyb s ARG 81 Cb -0.02 -3.38 0.11 0.00 -1.56 0.00 0.00 34.95 30.11 2iyb s ARG 81 CO 0.05 0.23 0.14 0.34 -0.81 0.00 0.00 175.30 175.25 2iyb s ASP 82 N 0.06 4.10 1.67 -2.12 2.15 0.20 -4.74 116.67 117.99 2iyb s ASP 82 Ca 0.42 -2.14 0.00 0.00 0.43 0.00 0.00 52.55 51.25 2iyb s ASP 82 Cb -0.21 -1.14 0.00 0.00 -0.30 0.00 0.00 42.92 41.27 2iyb s ASP 82 CO 0.25 -0.35 0.00 0.00 -0.17 0.00 0.00 175.17 174.90 2iyb n ALA 83 N 4.21 0.00 1.03 3.66 0.00 -1.26 -1.56 120.51 126.59 2iyb n ALA 83 Ca 0.03 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.59 2iyb n ALA 83 Cb 0.39 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.96 2iyb n ALA 83 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39 2iyb n ARG 84 N 0.00 2.22 -4.95 0.00 0.00 -1.26 -4.95 116.66 107.73 2iyb n ARG 84 Ca 0.00 -1.81 -0.32 0.00 -0.00 0.00 0.00 57.85 55.71 2iyb n ARG 84 Cb 0.00 -1.46 -0.14 0.00 -0.00 0.00 0.00 32.46 30.86 2iyb n ARG 84 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 2iyb s GLN 85 N -2.03 2.62 -0.32 2.89 0.74 -0.60 -5.08 119.66 117.87 2iyb s GLN 85 Ca 0.28 -0.74 -0.05 0.00 0.05 0.00 0.00 55.36 54.90 2iyb s GLN 85 Cb 0.20 -2.37 0.04 0.00 1.10 0.00 0.00 33.01 31.98 2iyb s GLN 85 CO 0.32 0.53 0.08 0.08 -0.55 0.00 0.00 175.29 175.74 2iyb s VAL 86 N -0.48 3.60 0.27 1.34 1.01 -1.26 0.61 120.40 125.49 2iyb s VAL 86 Ca 0.06 -1.15 -0.16 0.00 0.00 0.00 0.00 61.98 60.74 2iyb s VAL 86 Cb -0.12 -3.02 -0.08 0.00 0.00 0.00 0.00 36.38 33.15 2iyb s VAL 86 CO 0.02 -0.13 0.70 -0.31 0.00 0.00 0.00 175.10 175.38 2iyb s TYR 87 N 1.38 3.47 0.05 5.22 2.02 -0.46 -1.22 117.35 127.81 2iyb s TYR 87 Ca -0.02 1.22 0.03 0.00 -0.37 0.00 0.00 57.07 57.93 2iyb s TYR 87 Cb -0.19 -2.52 -0.03 0.00 -0.40 0.00 0.00 41.96 38.82 2iyb s TYR 87 CO 0.02 0.20 -0.09 0.20 -1.57 0.00 0.00 175.55 174.31 2iyb s GLY 88 N -2.07 0.57 -0.19 0.71 0.00 0.12 -1.63 107.32 104.83 2iyb s GLY 88 Ca 0.49 -0.81 0.01 0.00 0.00 0.00 0.00 44.72 44.41 2iyb s GLY 88 CO 0.19 -0.86 -0.09 1.08 0.00 0.00 0.00 173.10 173.42 2iyb s LEU 89 N -1.62 2.15 -0.83 0.66 1.43 0.16 -0.39 118.68 120.25 2iyb s LEU 89 Ca -0.09 -0.85 -0.16 0.00 -1.03 0.00 0.00 54.13 52.00 2iyb s LEU 89 Cb -0.10 -1.16 0.17 0.00 0.03 0.00 0.00 46.19 45.13 2iyb s LEU 89 CO 0.01 -0.16 0.88 0.21 0.23 0.00 0.00 176.35 177.52 2iyb s ASN 90 N 1.45 6.63 0.55 2.29 2.47 -0.62 -1.84 114.94 125.87 2iyb s ASN 90 Ca -0.01 -2.29 -0.19 0.00 0.42 0.00 0.00 52.86 50.78 2iyb s ASN 90 Cb -0.16 -2.29 -0.05 0.00 -1.45 0.00 0.00 41.25 37.30 2iyb s ASN 90 CO -0.08 -0.82 1.15 -0.36 -3.72 0.00 0.00 177.10 173.28 2iyb s PHE 91 N 1.38 2.60 0.36 0.43 0.08 0.71 -1.69 117.98 121.85 2iyb s PHE 91 Ca 0.22 1.53 0.06 0.00 0.12 0.00 0.00 56.93 58.86 2iyb s PHE 91 Cb -0.10 -3.35 0.70 0.00 -0.57 0.00 0.00 43.02 39.69 2iyb s PHE 91 CO -0.07 -1.75 1.92 0.78 -0.10 0.00 0.00 175.22 176.00 2iyb h GLY 92 N 1.17 0.51 0.00 4.36 0.00 -1.31 -3.47 103.07 104.33 2iyb h GLY 92 Ca -0.50 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 46.55 2iyb h GLY 92 CO 0.57 0.26 0.00 -1.14 0.00 0.00 0.00 176.54 176.22 2iyb n SER 93 N -4.32 0.00 0.00 0.19 3.41 -1.26 -5.02 113.62 106.62 2iyb n SER 93 Ca 0.01 -0.56 0.00 0.00 -0.26 0.00 0.00 58.87 58.07 2iyb n SER 93 Cb 0.21 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.16 2iyb n SER 93 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2iyb n LYS 94 N 0.00 0.00 0.00 4.33 3.00 -1.26 -2.49 118.16 121.74 2iyb n LYS 94 Ca 0.00 0.45 0.00 0.00 -0.00 0.00 0.00 58.31 58.76 2iyb n LYS 94 Cb 0.00 -0.94 0.00 0.00 0.00 0.00 0.00 35.03 34.09 2iyb n LYS 94 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 2iyb n GLU 95 N -1.97 0.00 -0.31 1.64 0.00 -1.26 0.12 120.64 118.86 2iyb n GLU 95 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 57.16 57.32 2iyb n GLU 95 Cb 0.00 0.00 0.34 0.00 0.00 0.00 0.00 31.44 31.78 2iyb n GLU 95 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.13 176.69 2iyb h ASP 96 N 0.00 0.08 -0.53 4.31 3.32 -1.89 0.27 116.42 121.98 2iyb h ASP 96 Ca 0.00 0.21 -0.02 0.00 0.02 0.00 0.00 57.03 57.24 2iyb h ASP 96 Cb 0.00 0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 2iyb h ASP 96 CO 0.00 -0.18 0.25 0.00 -1.72 0.00 0.00 179.24 177.59 2iyb h ALA 97 N 1.82 0.68 -0.40 3.45 0.00 -0.05 -2.26 119.26 122.51 2iyb h ALA 97 Ca 0.61 -0.13 -0.09 0.00 0.00 0.00 0.00 54.91 55.30 2iyb h ALA 97 Cb 1.29 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 2iyb h ALA 97 CO -0.67 0.25 -0.12 -0.91 0.00 0.00 0.00 179.25 177.80 2iyb h ASN 98 N 0.71 0.80 0.04 0.00 2.35 0.32 -0.53 115.58 119.27 2iyb h ASN 98 Ca 0.18 -0.37 -0.11 0.00 -0.55 0.00 0.00 56.30 55.45 2iyb h ASN 98 Cb 0.12 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 38.26 2iyb h ASN 98 CO -0.02 0.99 -0.33 -0.37 -1.65 0.00 0.00 177.43 176.05 2iyb h VAL 99 N 0.61 1.29 0.08 2.81 -1.51 -1.20 -1.22 116.25 117.10 2iyb h VAL 99 Ca 0.10 -1.41 -0.00 0.00 -1.23 0.00 0.00 66.70 64.16 2iyb h VAL 99 Cb 0.65 1.50 0.00 0.00 -2.13 0.00 0.00 31.29 31.31 2iyb h VAL 99 CO 0.04 0.44 -0.04 0.15 -1.23 0.00 0.00 177.57 176.93 2iyb h PHE 100 N 0.36 -0.10 -0.92 5.19 3.57 -1.30 -2.62 116.94 121.11 2iyb h PHE 100 Ca 0.04 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.65 2iyb h PHE 100 Cb 0.76 0.03 -0.07 0.00 2.79 0.00 0.00 35.95 39.47 2iyb h PHE 100 CO 0.02 0.39 0.59 0.00 -2.23 0.00 0.00 178.31 177.08 2iyb h ALA 101 N 0.17 1.63 -0.48 2.41 0.00 -1.08 0.50 119.26 122.40 2iyb h ALA 101 Ca -0.01 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 2iyb h ALA 101 Cb 0.53 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 2iyb h ALA 101 CO 0.02 0.17 0.17 1.03 0.00 0.00 0.00 179.25 180.64 2iyb h SER 102 N 0.90 0.68 -0.00 0.00 0.87 -1.25 0.08 113.55 114.83 2iyb h SER 102 Ca 0.44 -0.19 -0.13 0.00 -1.23 0.00 0.00 61.79 60.68 2iyb h SER 102 Cb 0.46 -0.18 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 2iyb h SER 102 CO -0.20 0.68 -0.41 0.00 -0.53 0.00 0.00 176.83 176.37 2iyb h ALA 103 N 1.02 0.88 -0.22 6.23 0.00 -0.90 -1.44 119.26 124.82 2iyb h ALA 103 Ca 0.16 -0.44 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2iyb h ALA 103 Cb 0.23 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 2iyb h ALA 103 CO -0.01 0.64 0.14 1.98 0.00 0.00 0.00 179.25 182.00 2iyb h MET 104 N 0.43 0.29 -0.67 0.00 -1.53 -0.78 -0.07 114.93 112.60 2iyb h MET 104 Ca 0.04 -0.02 0.04 0.00 -3.44 0.00 0.00 59.70 56.32 2iyb h MET 104 Cb 0.90 -0.06 -0.05 0.00 -0.55 0.00 0.00 31.60 31.84 2iyb h MET 104 CO 0.08 0.21 0.40 1.98 0.14 0.00 0.00 176.91 179.72 2iyb h MET 105 N 0.28 0.74 -0.28 0.39 4.05 -0.83 -0.52 114.93 118.76 2iyb h MET 105 Ca 0.08 -0.04 -0.02 0.00 -0.28 0.00 0.00 59.70 59.44 2iyb h MET 105 Cb -0.01 -0.17 -0.01 0.00 -0.80 0.00 0.00 31.60 30.61 2iyb h MET 105 CO -0.02 0.49 0.11 1.25 0.23 0.00 0.00 176.91 178.97 2iyb h HIS 106 N 0.76 0.42 -0.62 1.39 -0.00 -1.06 -0.51 115.15 115.53 2iyb h HIS 106 Ca 0.29 -0.03 0.02 0.00 -0.00 0.00 0.00 60.37 60.65 2iyb h HIS 106 Cb 0.10 -0.13 -0.04 0.00 -0.00 0.00 0.00 27.41 27.35 2iyb h HIS 106 CO -0.06 0.42 0.39 0.00 -0.00 0.00 0.00 177.93 178.68 2iyb h ALA 107 N 0.96 0.80 -0.24 5.26 0.00 -0.62 -0.94 119.26 124.48 2iyb h ALA 107 Ca 0.09 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 2iyb h ALA 107 Cb 0.18 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2iyb h ALA 107 CO -0.01 0.16 -0.44 -0.07 0.00 0.00 0.00 179.25 178.89 2iyb h LEU 108 N 0.78 0.64 -0.59 0.00 3.38 -1.03 -1.76 115.31 116.74 2iyb h LEU 108 Ca 0.24 -0.30 0.06 0.00 0.09 0.00 0.00 57.88 57.97 2iyb h LEU 108 Cb -0.02 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.50 2iyb h LEU 108 CO -0.09 0.99 0.30 -0.08 0.09 0.00 0.00 178.44 179.65 2iyb h GLU 109 N 0.48 0.54 -0.22 1.13 4.81 -0.76 -2.05 114.58 118.50 2iyb h GLU 109 Ca 0.03 -0.03 -0.04 0.00 -0.13 0.00 0.00 59.36 59.19 2iyb h GLU 109 Cb 0.96 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.21 2iyb h GLU 109 CO 0.09 0.36 -0.02 0.28 -0.73 0.00 0.00 179.01 178.99 2iyb h VAL 110 N 0.56 1.27 0.00 0.32 2.07 -0.95 -3.11 116.25 116.40 2iyb h VAL 110 Ca 0.27 -0.95 -0.05 0.00 0.82 0.00 0.00 66.70 66.78 2iyb h VAL 110 Cb 0.19 1.45 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 2iyb h VAL 110 CO -0.19 0.29 -0.25 -0.07 0.02 0.00 0.00 177.57 177.37 2iyb h LEU 111 N 0.16 0.00 -2.10 2.57 3.38 -1.22 -3.06 115.31 115.04 2iyb h LEU 111 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 2iyb h LEU 111 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 2iyb h LEU 111 CO 0.02 0.25 0.00 0.59 0.09 0.00 0.00 178.44 179.39 2iyb n ASN 112 N -3.90 3.10 -0.59 -0.43 3.02 -0.78 -4.92 115.26 110.76 2iyb n ASN 112 Ca -0.02 -1.95 0.07 0.00 -0.03 0.00 0.00 54.58 52.65 2iyb n ASN 112 Cb 0.34 -0.30 0.06 0.00 -0.61 0.00 0.00 39.78 39.27 2iyb n ASN 112 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10