#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ieb n ASP 5 N 0.00 0.31 -1.78 2.89 8.00 -1.26 -5.17 116.55 119.54 1ieb n ASP 5 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1ieb n ASP 5 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1ieb n ASP 5 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1ieb n ARG 6 N 0.00 1.05 -3.31 -1.24 1.74 -1.26 -5.07 116.66 108.57 1ieb n ARG 6 Ca 0.00 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.70 1ieb n ARG 6 Cb 0.00 0.00 -0.06 0.00 -1.02 0.00 0.00 32.46 31.38 1ieb n ARG 6 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1ieb s MET 7 N -1.18 4.30 0.11 5.56 0.23 -1.26 -5.04 119.30 122.02 1ieb s MET 7 Ca 0.00 0.42 -0.31 0.00 -1.03 0.00 0.00 55.69 54.77 1ieb s MET 7 Cb 0.00 -3.47 -0.09 0.00 -1.53 0.00 0.00 34.83 29.74 1ieb s MET 7 CO 0.00 0.09 1.64 0.08 -2.03 0.00 0.00 175.02 174.80 1ieb s VAL 1 N 0.85 2.82 0.58 5.16 1.01 -1.26 -4.98 120.40 124.58 1ieb s VAL 1 Ca 0.25 0.42 -0.05 0.00 0.00 0.00 0.00 61.98 62.60 1ieb s VAL 1 Cb -0.15 -3.27 0.01 0.00 0.00 0.00 0.00 36.38 32.97 1ieb s VAL 1 CO 0.10 0.01 0.88 0.20 0.00 0.00 0.00 175.10 176.29 1ieb s ASN 2 N 1.98 5.53 0.05 3.32 0.01 -1.26 -5.11 114.94 119.46 1ieb s ASN 2 Ca 0.73 0.60 -0.03 0.00 -0.71 0.00 0.00 52.86 53.46 1ieb s ASN 2 Cb -0.42 -1.59 -0.03 0.00 0.41 0.00 0.00 41.25 39.62 1ieb s ASN 2 CO 0.32 -1.07 0.03 -1.38 -1.51 0.00 0.00 177.10 173.49 1ieb s HIS 3 N -2.95 0.39 0.12 2.20 -3.43 -1.26 -4.97 115.29 105.39 1ieb s HIS 3 Ca 0.54 -0.87 -0.30 0.00 -0.80 0.00 0.00 55.06 53.63 1ieb s HIS 3 Cb -0.10 -0.28 -0.06 0.00 -1.43 0.00 0.00 32.58 30.70 1ieb s HIS 3 CO 0.44 -0.39 1.03 -0.06 -2.00 0.00 0.00 174.74 173.75 1ieb s PHE 4 N -3.55 3.70 -0.05 0.38 0.40 -1.26 -5.00 117.98 112.61 1ieb s PHE 4 Ca 0.03 1.69 -0.21 0.00 -0.60 0.00 0.00 56.93 57.84 1ieb s PHE 4 Cb 0.05 -3.16 -0.04 0.00 0.51 0.00 0.00 43.02 40.38 1ieb s PHE 4 CO -0.09 -0.18 0.62 0.42 0.70 0.00 0.00 175.22 176.69 1ieb s ILE 5 N 0.07 5.01 0.26 0.64 1.01 -1.26 -5.05 121.20 121.88 1ieb s ILE 5 Ca 0.49 1.28 -0.30 0.00 0.00 0.00 0.00 60.65 62.12 1ieb s ILE 5 Cb -0.26 -3.96 -0.09 0.00 0.01 0.00 0.00 42.46 38.16 1ieb s ILE 5 CO 0.31 0.33 1.00 0.00 0.00 0.00 0.00 174.94 176.59 1ieb s ALA 6 N 0.38 3.36 -0.01 9.38 0.00 -1.26 -5.07 121.76 128.54 1ieb s ALA 6 Ca 0.33 0.73 0.04 0.00 0.00 0.00 0.00 51.96 53.06 1ieb s ALA 6 Cb -0.17 -3.26 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 1ieb s ALA 6 CO 0.16 0.06 -0.13 -1.21 0.00 0.00 0.00 175.76 174.64 1ieb s GLU 7 N -1.33 2.39 0.26 0.00 0.41 -1.26 -5.10 118.70 114.07 1ieb s GLU 7 Ca 0.43 -0.78 -0.29 0.00 -0.41 0.00 0.00 54.97 53.91 1ieb s GLU 7 Cb -0.28 -2.36 -0.09 0.00 -1.78 0.00 0.00 34.13 29.62 1ieb s GLU 7 CO 0.35 0.59 1.15 -0.06 -0.49 0.00 0.00 175.26 176.80 1ieb s PHE 8 N -0.86 3.48 -0.17 1.61 0.40 -1.26 -4.98 117.98 116.21 1ieb s PHE 8 Ca 0.14 1.60 -0.21 0.00 -0.60 0.00 0.00 56.93 57.86 1ieb s PHE 8 Cb -0.11 -3.36 -0.03 0.00 0.51 0.00 0.00 43.02 40.03 1ieb s PHE 8 CO 0.04 -0.85 0.64 0.15 0.70 0.00 0.00 175.22 175.90 1ieb s LYS 9 N -1.18 4.26 -0.32 0.44 1.02 -1.26 -4.99 119.74 117.72 1ieb s LYS 9 Ca 0.47 0.67 -0.28 0.00 0.02 0.00 0.00 55.97 56.85 1ieb s LYS 9 Cb -0.33 -3.54 -0.02 0.00 -0.52 0.00 0.00 37.83 33.41 1ieb s LYS 9 CO 0.41 -0.16 1.89 1.03 -0.92 0.00 0.00 175.35 177.59 1ieb s ARG 1 N 1.64 3.26 0.00 1.68 0.52 -1.26 -4.83 118.95 119.96 1ieb s ARG 1 Ca 0.31 1.52 0.00 0.00 -0.52 0.00 0.00 55.73 57.04 1ieb s ARG 1 Cb -0.16 -4.24 0.00 0.00 0.52 0.00 0.00 34.95 31.07 1ieb s ARG 1 CO 0.12 -1.94 0.00 1.17 0.02 0.00 0.00 175.30 174.66 1ieb n LYS 2 N 8.51 0.00 0.00 3.54 4.81 -1.26 -4.83 118.16 128.94 1ieb n LYS 2 Ca 0.24 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 1ieb n LYS 2 Cb 0.47 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.52 1ieb n LYS 2 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ieb n GLY 3 N -0.77 -1.89 0.00 3.14 0.00 -1.26 -4.92 105.19 99.49 1ieb n GLY 3 Ca 0.00 -1.45 0.00 0.00 0.00 0.00 0.00 46.02 44.57 1ieb n GLY 3 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ieb n GLY 4 N 0.00 0.90 3.64 -0.02 0.00 -1.26 -5.12 105.19 103.33 1ieb n GLY 4 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1ieb n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ieb s SER 5 N -1.00 -0.61 -0.11 1.61 0.01 -1.26 -5.16 113.70 107.18 1ieb s SER 5 Ca 0.00 0.97 -0.03 0.00 1.31 0.00 0.00 55.95 58.20 1ieb s SER 5 Cb 0.00 1.27 -0.03 0.00 0.21 0.00 0.00 66.02 67.47 1ieb s SER 5 CO 0.00 -0.15 0.00 -0.76 0.41 0.00 0.00 173.24 172.74 1ieb s LEU 6 N 1.45 3.55 -0.29 2.44 1.43 -1.26 -5.05 118.68 120.94 1ieb s LEU 6 Ca -0.09 0.09 -0.28 0.00 -1.03 0.00 0.00 54.13 52.81 1ieb s LEU 6 Cb -0.04 -1.83 -0.03 0.00 0.03 0.00 0.00 46.19 44.33 1ieb s LEU 6 CO -0.16 0.32 1.90 -0.69 0.23 0.00 0.00 176.35 177.95 1ieb s VAL 7 N -0.52 3.36 0.62 -1.59 1.01 -1.26 -4.94 120.40 117.08 1ieb s VAL 7 Ca 0.09 0.37 -0.18 0.00 0.00 0.00 0.00 61.98 62.26 1ieb s VAL 7 Cb -0.12 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 1ieb s VAL 7 CO 0.02 -0.30 0.87 -0.81 0.00 0.00 0.00 175.10 174.88 1ieb n PRO 8 N 8.48 0.76 -0.06 2.72 -0.04 -1.26 -5.01 135.00 140.58 1ieb n PRO 8 Ca 0.24 0.30 -0.06 0.00 -0.04 0.00 0.00 63.50 63.94 1ieb n PRO 8 Cb 0.46 -2.09 -0.05 0.00 -0.04 0.00 0.00 33.50 31.79 1ieb n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ieb h ARG 9 N 0.31 0.00 0.00 0.54 -0.00 -2.08 -3.50 114.38 109.65 1ieb h ARG 9 Ca -0.48 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.00 1ieb h ARG 9 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.34 1ieb h ARG 9 CO 0.49 0.37 0.00 0.41 0.00 0.00 0.00 179.97 181.24 1ieb n GLY 10 N 1.68 -1.39 3.64 0.04 0.00 -1.26 -5.16 105.19 102.74 1ieb n GLY 10 Ca -0.06 -1.00 -0.07 0.00 0.00 0.00 0.00 46.02 44.89 1ieb n GLY 10 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ieb s SER 11 N -3.21 -0.59 0.46 1.61 1.04 -1.26 -5.17 113.70 106.57 1ieb s SER 11 Ca 0.00 1.02 -0.15 0.00 0.48 0.00 0.00 55.95 57.30 1ieb s SER 11 Cb 0.00 1.15 -0.08 0.00 0.10 0.00 0.00 66.02 67.19 1ieb s SER 11 CO 0.00 -0.17 0.90 -0.83 0.98 0.00 0.00 173.24 174.12 1ieb s GLY 12 N 0.91 2.08 0.00 7.32 0.00 -1.26 -5.07 107.32 111.30 1ieb s GLY 12 Ca -0.04 0.08 0.00 0.00 0.00 0.00 0.00 44.72 44.76 1ieb s GLY 12 CO -0.11 0.33 0.00 0.61 0.00 0.00 0.00 173.10 173.93 1ieb n GLY 13 N -1.32 5.56 2.73 0.20 0.00 -1.26 -4.82 105.19 106.28 1ieb n GLY 13 Ca 0.05 -1.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.93 1ieb n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ieb n GLY 14 N 0.10 -0.59 0.00 -0.02 0.00 -1.26 -4.12 105.19 99.30 1ieb n GLY 14 Ca 0.00 0.33 0.00 0.00 0.00 0.00 0.00 46.02 46.35 1ieb n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ieb n GLY 15 N -1.33 1.18 3.41 -0.02 0.00 -1.26 -5.10 105.19 102.08 1ieb n GLY 15 Ca -0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.64 1ieb n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ieb s SER 16 N -2.00 4.27 -0.06 1.61 0.01 -1.26 -5.12 113.70 111.14 1ieb s SER 16 Ca 0.00 -0.26 -0.05 0.00 1.31 0.00 0.00 55.95 56.95 1ieb s SER 16 Cb 0.00 -1.66 -0.04 0.00 0.21 0.00 0.00 66.02 64.53 1ieb s SER 16 CO 0.00 0.17 0.16 -0.60 0.41 0.00 0.00 173.24 173.38 1ieb s ARG 4 N 0.34 3.44 0.16 12.44 3.52 -1.26 -4.86 118.95 132.72 1ieb s ARG 4 Ca -0.09 -0.22 -0.31 0.00 -0.13 0.00 0.00 55.73 54.98 1ieb s ARG 4 Cb -0.15 -3.14 -0.11 0.00 -1.56 0.00 0.00 34.95 29.99 1ieb s ARG 4 CO 0.05 0.73 1.73 -2.14 -0.81 0.00 0.00 175.30 174.86 1ieb s PRO 5 N -1.49 4.15 0.02 5.12 0.02 -1.26 -5.03 135.00 136.53 1ieb s PRO 5 Ca 0.21 2.54 -0.06 0.00 0.02 0.00 0.00 61.00 63.72 1ieb s PRO 5 Cb -0.12 -3.33 -0.01 0.00 0.02 0.00 0.00 34.50 31.06 1ieb s PRO 5 CO 0.12 -0.76 0.10 1.67 -0.33 0.00 0.00 177.00 177.79 1ieb s TRP 6 N 1.89 0.14 -0.07 6.54 1.48 -1.26 -5.15 118.94 122.51 1ieb s TRP 6 Ca 0.76 -0.34 -0.02 0.00 -1.06 0.00 0.00 56.10 55.44 1ieb s TRP 6 Cb -0.46 -0.11 0.03 0.00 -1.16 0.00 0.00 33.47 31.77 1ieb s TRP 6 CO 0.33 -0.31 0.03 -0.06 -4.06 0.00 0.00 176.95 172.89 1ieb s PHE 7 N -1.92 0.38 -0.12 1.66 0.08 -1.26 -4.98 117.98 111.81 1ieb s PHE 7 Ca -0.11 -0.01 0.02 0.00 0.12 0.00 0.00 56.93 56.95 1ieb s PHE 7 Cb -0.05 -0.66 0.01 0.00 -0.57 0.00 0.00 43.02 41.75 1ieb s PHE 7 CO -0.01 -0.29 -0.20 -1.17 -0.10 0.00 0.00 175.22 173.45 1ieb s LEU 8 N 2.07 1.96 -0.33 -0.37 2.96 -1.26 -4.97 118.68 118.73 1ieb s LEU 8 Ca 0.05 -0.53 -0.09 0.00 -0.22 0.00 0.00 54.13 53.34 1ieb s LEU 8 Cb -0.13 -1.30 0.02 0.00 0.50 0.00 0.00 46.19 45.28 1ieb s LEU 8 CO -0.05 0.06 0.14 -0.70 -1.32 0.00 0.00 176.35 174.49 1ieb s GLU 9 N 0.83 2.95 -0.02 1.98 2.56 -1.26 -0.62 118.70 125.12 1ieb s GLU 9 Ca -0.08 -0.97 0.05 0.00 0.00 0.00 0.00 54.97 53.96 1ieb s GLU 9 Cb -0.15 -3.55 -0.01 0.00 2.00 0.00 0.00 34.13 32.42 1ieb s GLU 9 CO -0.01 -0.57 -0.16 -0.47 -0.56 0.00 0.00 175.26 173.49 1ieb s TYR 10 N 1.52 1.47 0.01 5.30 5.04 -1.25 -5.00 117.35 124.44 1ieb s TYR 10 Ca 0.02 -0.32 0.03 0.00 -2.44 0.00 0.00 57.07 54.35 1ieb s TYR 10 Cb -0.18 -0.96 -0.01 0.00 0.35 0.00 0.00 41.96 41.15 1ieb s TYR 10 CO 0.05 -0.07 -0.08 0.00 -1.34 0.00 0.00 175.55 174.11 1ieb s LYS 12 N -0.54 1.59 -0.42 0.00 1.02 0.09 -4.97 119.74 116.50 1ieb s LYS 12 Ca 0.01 -0.32 -0.04 0.00 0.02 0.00 0.00 55.97 55.64 1ieb s LYS 12 Cb -0.05 -1.50 0.11 0.00 -0.52 0.00 0.00 37.83 35.88 1ieb s LYS 12 CO 0.00 -0.14 0.23 -1.12 -0.92 0.00 0.00 175.35 173.40 1ieb s SER 13 N 1.25 5.34 -0.45 2.83 0.01 -1.26 0.70 113.70 122.12 1ieb s SER 13 Ca -0.04 -2.02 -0.20 0.00 1.31 0.00 0.00 55.95 55.01 1ieb s SER 13 Cb -0.14 -1.86 0.03 0.00 0.21 0.00 0.00 66.02 64.26 1ieb s SER 13 CO -0.03 -0.57 0.60 -1.61 0.41 0.00 0.00 173.24 172.04 1ieb s GLU 14 N 1.18 3.21 -0.49 12.44 2.02 0.45 -4.94 118.70 132.56 1ieb s GLU 14 Ca 0.08 -0.54 -0.23 0.00 0.02 0.00 0.00 54.97 54.30 1ieb s GLU 14 Cb -0.23 -3.98 0.03 0.00 0.10 0.00 0.00 34.13 30.05 1ieb s GLU 14 CO -0.04 -1.02 0.81 0.00 0.02 0.00 0.00 175.26 175.04 1ieb s HIS 16 N 3.41 3.23 -0.28 0.00 3.76 0.12 -4.96 115.29 120.57 1ieb s HIS 16 Ca 0.28 -0.53 -0.09 0.00 -0.15 0.00 0.00 55.06 54.56 1ieb s HIS 16 Cb -0.13 -2.50 -0.03 0.00 1.11 0.00 0.00 32.58 31.03 1ieb s HIS 16 CO 0.20 -0.51 0.13 -0.06 -0.85 0.00 0.00 174.74 173.65 1ieb s PHE 17 N 1.66 3.15 0.03 1.40 0.08 -1.26 -0.06 117.98 122.99 1ieb s PHE 17 Ca 0.05 -0.32 -0.03 0.00 0.12 0.00 0.00 56.93 56.74 1ieb s PHE 17 Cb -0.18 -2.32 -0.28 0.00 -0.57 0.00 0.00 43.02 39.67 1ieb s PHE 17 CO 0.09 -0.34 0.95 1.88 -0.10 0.00 0.00 175.22 177.70 1ieb h TYR 18 N 8.32 0.46 -1.57 0.36 -1.99 -1.86 -3.42 116.97 117.27 1ieb h TYR 18 Ca -0.35 -0.34 -0.29 0.00 2.00 0.00 0.00 58.73 59.75 1ieb h TYR 18 Cb 1.17 -0.02 -0.26 0.00 2.00 0.00 0.00 36.73 39.62 1ieb h TYR 18 CO 0.68 1.34 -0.64 1.21 -0.00 0.00 0.00 178.16 180.75 1ieb s ASN 19 N -7.03 -0.06 0.82 3.88 2.47 -1.26 -5.03 114.94 108.73 1ieb s ASN 19 Ca -0.07 -1.79 0.00 0.00 0.42 0.00 0.00 52.86 51.42 1ieb s ASN 19 Cb 0.07 1.02 0.00 0.00 -1.45 0.00 0.00 41.25 40.89 1ieb s ASN 19 CO 0.86 -0.16 0.00 0.61 -3.72 0.00 0.00 177.10 174.69 1ieb n GLY 20 N 3.59 2.62 0.86 1.21 0.00 -1.26 -1.20 105.19 111.01 1ieb n GLY 20 Ca 0.17 -0.29 0.09 0.00 0.00 0.00 0.00 46.02 45.99 1ieb n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ieb n THR 21 N 0.00 0.56 0.05 2.61 -2.24 -1.26 -4.40 114.28 109.59 1ieb n THR 21 Ca 0.00 -0.60 -0.02 0.00 -2.27 0.00 0.00 64.05 61.16 1ieb n THR 21 Cb 0.00 0.39 -0.01 0.00 -2.10 0.00 0.00 70.33 68.61 1ieb n THR 21 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1ieb h GLN 22 N 2.88 -0.12 -4.78 -0.78 1.08 -1.59 -3.42 115.11 108.38 1ieb h GLN 22 Ca 0.00 0.01 -0.59 0.00 -1.45 0.00 0.00 58.65 56.61 1ieb h GLN 22 Cb 0.65 0.03 -0.35 0.00 -0.05 0.00 0.00 27.48 27.76 1ieb h GLN 22 CO 0.00 -0.08 -0.84 -0.98 -0.95 0.00 0.00 178.83 175.98 1ieb s ARG 23 N -3.29 2.29 0.07 1.46 1.70 -1.26 -5.05 118.95 114.88 1ieb s ARG 23 Ca -0.02 -0.59 0.09 0.00 -0.47 0.00 0.00 55.73 54.74 1ieb s ARG 23 Cb 0.00 -1.95 -0.03 0.00 -0.57 0.00 0.00 34.95 32.40 1ieb s ARG 23 CO 0.06 -0.07 -0.24 0.08 -1.08 0.00 0.00 175.30 174.05 1ieb s VAL 24 N 1.01 1.92 -0.11 4.99 1.01 -1.26 -2.27 120.40 125.70 1ieb s VAL 24 Ca -0.06 -1.40 0.00 0.00 0.00 0.00 0.00 61.98 60.52 1ieb s VAL 24 Cb -0.15 -1.68 0.02 0.00 0.00 0.00 0.00 36.38 34.58 1ieb s VAL 24 CO -0.02 0.20 -0.10 -0.60 0.00 0.00 0.00 175.10 174.58 1ieb s ARG 25 N -1.45 1.69 0.17 2.72 3.52 0.92 -4.96 118.95 121.55 1ieb s ARG 25 Ca 0.10 -0.34 -0.07 0.00 -0.13 0.00 0.00 55.73 55.28 1ieb s ARG 25 Cb -0.10 -1.61 -0.06 0.00 -1.56 0.00 0.00 34.95 31.62 1ieb s ARG 25 CO 0.03 -0.18 0.45 -1.17 -0.81 0.00 0.00 175.30 173.62 1ieb s LEU 26 N 1.39 4.24 -0.29 -0.88 2.96 -1.26 0.12 118.68 124.96 1ieb s LEU 26 Ca -0.00 0.76 0.02 0.00 -0.22 0.00 0.00 54.13 54.68 1ieb s LEU 26 Cb -0.13 -3.42 0.18 0.00 0.50 0.00 0.00 46.19 43.31 1ieb s LEU 26 CO -0.05 0.02 0.50 -0.22 -1.32 0.00 0.00 176.35 175.28 1ieb s LEU 27 N -2.62 -1.18 -0.19 -0.68 2.96 -0.66 -0.66 118.68 115.65 1ieb s LEU 27 Ca 0.43 0.12 -0.15 0.00 -0.22 0.00 0.00 54.13 54.31 1ieb s LEU 27 Cb -0.12 1.63 -0.04 0.00 0.50 0.00 0.00 46.19 48.15 1ieb s LEU 27 CO 0.22 -0.31 0.33 -0.69 -1.32 0.00 0.00 176.35 174.59 1ieb s VAL 28 N 2.70 5.26 -0.26 1.68 1.01 -0.72 -0.41 120.40 129.66 1ieb s VAL 28 Ca 0.12 0.59 0.02 0.00 0.00 0.00 0.00 61.98 62.71 1ieb s VAL 28 Cb -0.12 -3.67 0.07 0.00 0.00 0.00 0.00 36.38 32.65 1ieb s VAL 28 CO -0.25 0.31 -0.06 -0.13 0.00 0.00 0.00 175.10 174.96 1ieb s ARG 29 N 0.98 1.85 -0.14 2.72 0.52 0.22 0.54 118.95 125.64 1ieb s ARG 29 Ca 0.17 -1.23 -0.17 0.00 -0.52 0.00 0.00 55.73 53.97 1ieb s ARG 29 Cb -0.14 -2.76 -0.04 0.00 0.52 0.00 0.00 34.95 32.53 1ieb s ARG 29 CO 0.06 -0.63 0.45 0.71 0.02 0.00 0.00 175.30 175.91 1ieb s TYR 30 N 1.23 3.48 0.23 -0.53 1.51 0.01 -0.73 117.35 122.54 1ieb s TYR 30 Ca -0.05 0.81 0.02 0.00 -1.01 0.00 0.00 57.07 56.84 1ieb s TYR 30 Cb -0.19 -2.53 0.02 0.00 -0.11 0.00 0.00 41.96 39.14 1ieb s TYR 30 CO -0.06 0.13 0.16 1.19 -1.11 0.00 0.00 175.55 175.86 1ieb n PHE 31 N 3.84 -0.97 -3.40 2.71 3.01 0.15 -2.07 117.46 120.74 1ieb n PHE 31 Ca -0.08 -1.00 0.02 0.00 1.01 0.00 0.00 57.45 57.40 1ieb n PHE 31 Cb 0.51 -0.19 -0.05 0.00 -0.01 0.00 0.00 39.48 39.75 1ieb n PHE 31 CO 0.00 0.00 0.00 -0.47 1.01 0.00 0.00 176.76 177.30 1ieb s TYR 32 N -1.22 -0.37 0.00 1.38 5.04 -1.11 -3.91 117.35 117.16 1ieb s TYR 32 Ca 0.12 0.67 0.00 0.00 -2.44 0.00 0.00 57.07 55.42 1ieb s TYR 32 Cb -0.01 0.22 0.00 0.00 0.35 0.00 0.00 41.96 42.52 1ieb s TYR 32 CO 0.08 -0.18 0.00 0.09 -1.34 0.00 0.00 175.55 174.19 1ieb n ASN 33 N 4.38 0.00 -0.13 4.32 4.13 0.21 -1.60 115.26 126.56 1ieb n ASN 33 Ca -0.11 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.15 1ieb n ASN 33 Cb 0.55 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.79 1ieb n ASN 33 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 1ieb n LEU 34 N 0.00 0.19 -3.73 3.41 4.77 -1.26 -4.84 117.00 115.54 1ieb n LEU 34 Ca 0.00 -0.10 -0.13 0.00 -0.03 0.00 0.00 56.01 55.75 1ieb n LEU 34 Cb 0.00 -0.10 -0.10 0.00 -2.33 0.00 0.00 43.42 40.89 1ieb n LEU 34 CO 0.00 0.05 0.08 -1.83 -1.33 0.00 0.00 177.39 174.36 1ieb s GLU 35 N -1.74 0.47 0.09 3.23 -1.05 -0.63 -5.11 118.70 113.95 1ieb s GLU 35 Ca 0.00 0.58 -0.31 0.00 -0.15 0.00 0.00 54.97 55.09 1ieb s GLU 35 Cb 0.00 0.22 -0.08 0.00 -0.44 0.00 0.00 34.13 33.83 1ieb s GLU 35 CO 0.00 -0.06 1.47 -2.00 0.95 0.00 0.00 175.26 175.61 1ieb s GLU 36 N 0.28 4.27 0.00 -4.83 2.12 -1.26 -2.76 118.70 116.53 1ieb s GLU 36 Ca -0.01 2.14 0.00 0.00 0.36 0.00 0.00 54.97 57.46 1ieb s GLU 36 Cb -0.03 -3.37 0.00 0.00 0.26 0.00 0.00 34.13 30.99 1ieb s GLU 36 CO -0.00 -0.55 0.28 0.27 -0.54 0.00 0.00 175.26 174.72 1ieb n ASN 37 N 4.58 0.56 -3.60 -1.70 0.23 -0.88 -4.40 115.26 110.05 1ieb n ASN 37 Ca 0.13 -0.90 -0.10 0.00 -0.53 0.00 0.00 54.58 53.18 1ieb n ASN 37 Cb 0.42 0.10 -0.06 0.00 -2.08 0.00 0.00 39.78 38.16 1ieb n ASN 37 CO 0.00 0.00 0.00 -0.22 -0.93 0.00 0.00 177.26 176.11 1ieb s LEU 38 N -0.21 -0.39 0.19 -4.53 2.96 -1.15 -1.83 118.68 113.71 1ieb s LEU 38 Ca 0.00 0.54 -0.14 0.00 -0.22 0.00 0.00 54.13 54.31 1ieb s LEU 38 Cb 0.00 1.86 0.01 0.00 0.50 0.00 0.00 46.19 48.57 1ieb s LEU 38 CO 0.00 -0.28 0.44 0.00 -1.32 0.00 0.00 176.35 175.18 1ieb s ARG 39 N -0.70 1.30 -0.33 1.98 1.70 -0.80 -0.81 118.95 121.30 1ieb s ARG 39 Ca -0.00 -0.99 -0.01 0.00 -0.47 0.00 0.00 55.73 54.26 1ieb s ARG 39 Cb -0.02 0.47 0.11 0.00 -0.57 0.00 0.00 34.95 34.94 1ieb s ARG 39 CO -0.01 -0.53 0.12 0.12 -1.08 0.00 0.00 175.30 173.93 1ieb s PHE 40 N -3.91 1.60 0.05 5.89 2.19 0.19 -1.21 117.98 122.78 1ieb s PHE 40 Ca 0.12 -1.76 -0.22 0.00 0.33 0.00 0.00 56.93 55.40 1ieb s PHE 40 Cb 0.01 -1.65 -0.06 0.00 -1.31 0.00 0.00 43.02 40.01 1ieb s PHE 40 CO -0.01 -0.86 0.66 0.34 1.83 0.00 0.00 175.22 177.18 1ieb s ASP 41 N 1.46 7.11 0.11 6.13 2.15 -1.26 -1.75 116.67 130.63 1ieb s ASP 41 Ca 0.11 1.33 -0.31 0.00 0.43 0.00 0.00 52.55 54.11 1ieb s ASP 41 Cb -0.18 -2.41 -0.10 0.00 -0.30 0.00 0.00 42.92 39.92 1ieb s ASP 41 CO -0.21 0.12 1.59 -1.28 -0.17 0.00 0.00 175.17 175.21 1ieb h SER 42 N 5.29 -1.22 -0.95 -0.34 0.87 -1.26 -0.39 113.55 115.55 1ieb h SER 42 Ca -0.46 0.13 0.19 0.00 -1.23 0.00 0.00 61.79 60.42 1ieb h SER 42 Cb 1.21 0.45 -0.08 0.00 -0.44 0.00 0.00 62.40 63.54 1ieb h SER 42 CO 0.68 -0.49 0.60 0.44 -0.53 0.00 0.00 176.83 177.53 1ieb h ASP 43 N -0.67 0.60 0.20 6.23 3.32 -1.93 -2.30 116.42 121.87 1ieb h ASP 43 Ca 0.02 0.06 -0.26 0.00 0.02 0.00 0.00 57.03 56.87 1ieb h ASP 43 Cb 0.68 -0.05 0.03 0.00 0.22 0.00 0.00 39.33 40.21 1ieb h ASP 43 CO -0.23 0.24 -1.16 0.58 -1.72 0.00 0.00 179.24 176.96 1ieb h VAL 44 N 0.60 1.38 0.00 -1.35 2.07 -1.89 -3.48 116.25 113.59 1ieb h VAL 44 Ca 0.51 -2.61 0.00 0.00 0.82 0.00 0.00 66.70 65.42 1ieb h VAL 44 Cb 0.98 3.11 0.00 0.00 -1.52 0.00 0.00 31.29 33.87 1ieb h VAL 44 CO -0.26 0.76 0.00 0.61 0.02 0.00 0.00 177.57 178.71 1ieb n GLY 45 N 1.70 0.70 3.62 2.17 0.00 -0.19 -5.02 105.19 108.17 1ieb n GLY 45 Ca -0.16 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.77 1ieb n GLY 45 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ieb s GLU 46 N -0.36 1.55 0.63 1.61 2.02 -1.26 -5.04 118.70 117.84 1ieb s GLU 46 Ca 0.00 -1.11 -0.12 0.00 0.02 0.00 0.00 54.97 53.76 1ieb s GLU 46 Cb 0.00 0.51 -0.03 0.00 0.10 0.00 0.00 34.13 34.71 1ieb s GLU 46 CO 0.00 -0.66 1.03 -0.06 0.02 0.00 0.00 175.26 175.59 1ieb s PHE 47 N -3.96 3.42 -0.00 1.61 0.40 -1.26 -4.05 117.98 114.14 1ieb s PHE 47 Ca 0.17 1.36 0.00 0.00 -0.60 0.00 0.00 56.93 57.87 1ieb s PHE 47 Cb -0.02 -2.79 -0.00 0.00 0.51 0.00 0.00 43.02 40.72 1ieb s PHE 47 CO 0.06 -0.83 -0.01 1.03 0.70 0.00 0.00 175.22 176.17 1ieb s ARG 48 N -4.93 0.11 0.11 0.44 1.81 -0.35 -4.94 118.95 111.20 1ieb s ARG 48 Ca 0.57 -0.05 -0.30 0.00 -1.72 0.00 0.00 55.73 54.23 1ieb s ARG 48 Cb -0.12 -0.10 -0.06 0.00 -0.45 0.00 0.00 34.95 34.22 1ieb s ARG 48 CO 0.50 0.03 1.08 0.00 -0.68 0.00 0.00 175.30 176.23 1ieb s ALA 49 N -0.04 3.32 -0.12 2.13 0.00 -1.26 -1.90 121.76 123.89 1ieb s ALA 49 Ca 0.00 0.74 0.15 0.00 0.00 0.00 0.00 51.96 52.86 1ieb s ALA 49 Cb -0.01 -3.36 -0.24 0.00 0.00 0.00 0.00 23.12 19.52 1ieb s ALA 49 CO -0.00 -0.23 0.36 0.28 0.00 0.00 0.00 175.76 176.17 1ieb n VAL 50 N 3.03 1.50 -4.14 0.00 0.31 -0.76 -4.89 118.33 113.37 1ieb n VAL 50 Ca 0.05 -0.83 -0.11 0.00 -0.01 0.00 0.00 64.34 63.43 1ieb n VAL 50 Cb 0.47 -0.75 -0.09 0.00 -0.91 0.00 0.00 33.84 32.57 1ieb n VAL 50 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1ieb s THR 51 N -2.54 0.00 0.28 2.52 -4.23 -1.11 -4.92 115.64 105.63 1ieb s THR 51 Ca -0.08 -1.83 -0.02 0.00 -1.18 0.00 0.00 61.69 58.59 1ieb s THR 51 Cb 0.07 -2.42 0.27 0.00 1.34 0.00 0.00 72.50 71.76 1ieb s THR 51 CO 0.83 0.00 1.92 -0.33 -0.54 0.00 0.00 174.62 176.49 1ieb h GLU 52 N 2.50 1.12 -0.64 3.99 4.39 -1.93 -2.07 114.58 121.94 1ieb h GLU 52 Ca -0.33 -0.07 0.17 0.00 0.34 0.00 0.00 59.36 59.47 1ieb h GLU 52 Cb 1.25 -0.25 -0.03 0.00 -0.10 0.00 0.00 28.75 29.62 1ieb h GLU 52 CO 0.48 0.74 0.45 1.25 -1.16 0.00 0.00 179.01 180.77 1ieb h LEU 53 N 1.15 0.12 0.00 1.33 5.85 -1.98 -1.76 115.31 120.02 1ieb h LEU 53 Ca 0.38 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 59.09 1ieb h LEU 53 Cb 0.07 -0.02 -0.00 0.00 0.37 0.00 0.00 40.66 41.08 1ieb h LEU 53 CO -0.13 0.06 -0.49 1.23 -0.34 0.00 0.00 178.44 178.77 1ieb h GLY 54 N 0.12 0.00 0.28 3.75 0.00 -1.10 -3.39 103.07 102.74 1ieb h GLY 54 Ca 0.31 0.00 0.07 0.00 0.00 0.00 0.00 47.33 47.71 1ieb h GLY 54 CO -0.04 0.00 -0.08 -0.09 0.00 0.00 0.00 176.54 176.33 1ieb h ARG 55 N 0.00 0.01 -1.19 4.80 2.43 -1.31 -1.03 114.38 118.10 1ieb h ARG 55 Ca -0.01 -0.00 0.34 0.00 -0.81 0.00 0.00 59.98 59.49 1ieb h ARG 55 Cb 1.09 -0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.56 1ieb h ARG 55 CO 0.01 0.01 0.81 -1.35 -1.51 0.00 0.00 179.97 177.94 1ieb h PRO 56 N 0.01 0.16 0.02 0.20 0.11 -1.75 0.19 132.00 130.93 1ieb h PRO 56 Ca 0.18 -0.01 -0.09 0.00 0.11 0.00 0.00 66.00 66.19 1ieb h PRO 56 Cb 0.27 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.33 1ieb h PRO 56 CO -0.37 0.11 -0.48 -0.44 -0.21 0.00 0.00 178.00 176.61 1ieb h ASP 57 N 0.17 0.05 -0.89 -2.05 3.32 -1.60 -2.97 116.42 112.45 1ieb h ASP 57 Ca 0.63 -0.85 0.19 0.00 0.02 0.00 0.00 57.03 57.02 1ieb h ASP 57 Cb 2.08 -0.02 -0.11 0.00 0.22 0.00 0.00 39.33 41.50 1ieb h ASP 57 CO -0.18 1.19 0.43 0.00 -1.72 0.00 0.00 179.24 178.97 1ieb h ALA 58 N -0.13 1.40 -0.25 3.45 0.00 0.43 0.75 119.26 124.91 1ieb h ALA 58 Ca -0.12 0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 1ieb h ALA 58 Cb 1.17 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1ieb h ALA 58 CO -0.04 -0.23 -0.13 0.93 0.00 0.00 0.00 179.25 179.78 1ieb h GLU 59 N 0.51 0.52 0.36 0.00 5.08 -0.87 -0.69 114.58 119.49 1ieb h GLU 59 Ca 0.53 -0.23 -0.02 0.00 -1.00 0.00 0.00 59.36 58.63 1ieb h GLU 59 Cb 0.90 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1ieb h GLU 59 CO -0.45 0.79 -0.17 -0.97 -1.00 0.00 0.00 179.01 177.21 1ieb h ASN 60 N 0.24 -0.41 -0.82 1.42 -1.24 -1.07 -1.98 115.58 111.73 1ieb h ASN 60 Ca 0.05 -0.14 0.01 0.00 0.71 0.00 0.00 56.30 56.94 1ieb h ASN 60 Cb 0.64 0.11 -0.04 0.00 0.73 0.00 0.00 38.32 39.75 1ieb h ASN 60 CO 0.04 -0.07 0.54 -0.50 -1.29 0.00 0.00 177.43 176.15 1ieb h TRP 61 N -0.78 1.03 0.00 0.67 6.55 -0.97 0.02 115.95 122.47 1ieb h TRP 61 Ca -0.05 0.02 -0.01 0.00 0.95 0.00 0.00 58.89 59.81 1ieb h TRP 61 Cb 0.52 -0.35 -0.00 0.00 -0.86 0.00 0.00 29.16 28.47 1ieb h TRP 61 CO 0.01 0.63 -0.03 -0.91 -1.05 0.00 0.00 178.44 177.10 1ieb h ASN 62 N 1.10 0.00 1.29 -3.49 2.35 -1.06 -1.02 115.58 114.75 1ieb h ASN 62 Ca 0.31 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.06 1ieb h ASN 62 Cb -0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.27 1ieb h ASN 62 CO -0.08 0.03 -0.15 -1.54 -1.65 0.00 0.00 177.43 174.05 1ieb n SER 63 N -3.81 0.73 -4.42 5.81 3.41 -0.04 -4.54 113.62 110.76 1ieb n SER 63 Ca -0.03 0.46 -0.44 0.00 -0.26 0.00 0.00 58.87 58.60 1ieb n SER 63 Cb 0.12 -0.55 -0.04 0.00 -0.26 0.00 0.00 64.21 63.48 1ieb n SER 63 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1ieb s GLN 64 N -3.11 3.26 0.26 4.33 -0.21 -0.39 -4.90 119.66 118.90 1ieb s GLN 64 Ca 0.10 -1.32 -0.04 0.00 0.02 0.00 0.00 55.36 54.11 1ieb s GLN 64 Cb 0.13 -4.45 0.34 0.00 1.00 0.00 0.00 33.01 30.03 1ieb s GLN 64 CO 0.62 -1.70 1.89 -1.00 -2.12 0.00 0.00 175.29 172.98 1ieb h PRO 65 N 9.16 1.17 -0.31 2.91 0.13 -1.81 -1.24 132.00 142.00 1ieb h PRO 65 Ca -0.14 -0.07 -0.08 0.00 -0.87 0.00 0.00 66.00 64.83 1ieb h PRO 65 Cb 1.06 -0.26 -0.02 0.00 0.13 0.00 0.00 31.00 31.91 1ieb h PRO 65 CO 1.12 0.77 -0.16 0.93 -0.23 0.00 0.00 178.00 180.43 1ieb h GLU 66 N 1.20 0.55 -0.15 0.86 4.39 -1.94 -2.38 114.58 117.11 1ieb h GLU 66 Ca 0.40 -0.18 -0.13 0.00 0.34 0.00 0.00 59.36 59.79 1ieb h GLU 66 Cb 0.06 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 1ieb h GLU 66 CO -0.14 0.69 -0.42 0.35 -1.16 0.00 0.00 179.01 178.33 1ieb h PHE 67 N 0.50 0.72 0.00 4.33 3.57 -1.73 -2.45 116.94 121.88 1ieb h PHE 67 Ca 0.09 -0.28 -0.00 0.00 3.53 0.00 0.00 57.97 61.30 1ieb h PHE 67 Cb 0.57 -0.12 -0.00 0.00 2.79 0.00 0.00 35.95 39.19 1ieb h PHE 67 CO 0.02 1.04 -0.01 1.25 -2.23 0.00 0.00 178.31 178.38 1ieb h LEU 68 N 0.19 0.00 0.09 0.59 5.85 -0.97 0.19 115.31 121.25 1ieb h LEU 68 Ca -0.01 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.41 1ieb h LEU 68 Cb 1.04 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.05 1ieb h LEU 68 CO 0.09 0.01 -1.51 -0.08 -0.34 0.00 0.00 178.44 176.61 1ieb h GLU 69 N 0.00 0.19 0.41 1.25 4.57 -1.35 -2.90 114.58 116.76 1ieb h GLU 69 Ca -0.00 -0.33 -0.01 0.00 -1.18 0.00 0.00 59.36 57.84 1ieb h GLU 69 Cb 0.02 0.12 -0.03 0.00 -0.16 0.00 0.00 28.75 28.71 1ieb h GLU 69 CO 0.00 1.03 -0.49 0.37 -1.18 0.00 0.00 179.01 178.74 1ieb h GLN 70 N 0.05 -0.89 -1.00 1.92 4.15 -0.49 0.22 115.11 119.06 1ieb h GLN 70 Ca -0.23 0.06 0.10 0.00 0.77 0.00 0.00 58.65 59.36 1ieb h GLN 70 Cb 1.99 0.20 -0.08 0.00 0.21 0.00 0.00 27.48 29.80 1ieb h GLN 70 CO 0.15 -0.60 0.64 0.87 -1.93 0.00 0.00 178.83 177.96 1ieb h LYS 71 N -0.93 1.02 -0.62 1.69 1.79 -1.48 0.17 116.57 118.20 1ieb h LYS 71 Ca -0.04 -0.06 -0.01 0.00 -2.18 0.00 0.00 60.65 58.35 1ieb h LYS 71 Cb 0.83 -0.23 -0.03 0.00 -1.58 0.00 0.00 32.23 31.22 1ieb h LYS 71 CO -0.11 0.67 0.33 -0.09 -1.08 0.00 0.00 179.45 179.18 1ieb h ARG 72 N 1.05 0.87 0.00 3.15 2.43 -1.11 -1.99 114.38 118.77 1ieb h ARG 72 Ca 0.48 -0.10 0.00 0.00 -0.81 0.00 0.00 59.98 59.55 1ieb h ARG 72 Cb 0.39 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 29.77 1ieb h ARG 72 CO -0.24 0.65 -0.04 0.00 -1.51 0.00 0.00 179.97 178.83 1ieb h ALA 73 N 1.49 0.98 0.00 2.80 0.00 0.14 -3.26 119.26 121.40 1ieb h ALA 73 Ca 0.22 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1ieb h ALA 73 Cb 0.04 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 1ieb h ALA 73 CO -0.03 0.00 -0.01 0.93 0.00 0.00 0.00 179.25 180.14 1ieb h GLU 74 N 0.00 0.00 -0.19 0.00 5.08 -0.45 0.12 114.58 119.13 1ieb h GLU 74 Ca 0.00 0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.40 1ieb h GLU 74 Cb 0.87 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 1ieb h GLU 74 CO 0.00 0.01 0.14 0.28 -1.00 0.00 0.00 179.01 178.43 1ieb h VAL 75 N 0.00 0.94 0.00 3.13 2.07 -1.68 0.43 116.25 121.14 1ieb h VAL 75 Ca -0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1ieb h VAL 75 Cb 0.14 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 30.77 1ieb h VAL 75 CO 0.00 0.01 -0.49 0.47 0.02 0.00 0.00 177.57 177.59 1ieb n ASP 76 N -4.49 0.99 0.27 0.57 8.00 -0.05 -1.95 116.55 119.88 1ieb n ASP 76 Ca 0.01 0.20 0.15 0.00 0.71 0.00 0.00 54.79 55.86 1ieb n ASP 76 Cb 0.22 -0.63 0.78 0.00 -0.02 0.00 0.00 41.12 41.47 1ieb n ASP 76 CO 0.00 0.00 0.00 0.71 -0.39 0.00 0.00 177.20 177.52 1ieb h THR 77 N -0.51 0.00 0.00 -3.53 1.35 -0.96 -2.59 112.91 106.67 1ieb h THR 77 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 1ieb h THR 77 Cb 0.49 0.63 0.00 0.00 -1.73 0.00 0.00 68.15 67.54 1ieb h THR 77 CO 0.00 0.00 0.00 0.52 -0.25 0.00 0.00 175.52 175.79 1ieb n VAL 78 N -2.64 0.66 0.03 6.82 0.31 -0.66 -4.59 118.33 118.26 1ieb n VAL 78 Ca -0.02 0.22 -0.14 0.00 -0.01 0.00 0.00 64.34 64.39 1ieb n VAL 78 Cb 0.23 -1.18 -0.08 0.00 -0.91 0.00 0.00 33.84 31.90 1ieb n VAL 78 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ieb h ARG 80 N -0.57 -0.09 -1.03 0.00 2.47 -1.37 -2.19 114.38 111.59 1ieb h ARG 80 Ca 0.05 0.01 0.34 0.00 -1.26 0.00 0.00 59.98 59.12 1ieb h ARG 80 Cb 0.67 0.02 -0.15 0.00 -1.65 0.00 0.00 29.97 28.86 1ieb h ARG 80 CO -0.38 0.39 0.59 1.25 0.56 0.00 0.00 179.97 182.38 1ieb h HIS 81 N -0.63 0.87 0.06 3.04 2.76 -1.41 0.43 115.15 120.27 1ieb h HIS 81 Ca -0.01 0.04 -0.26 0.00 -2.20 0.00 0.00 60.37 57.93 1ieb h HIS 81 Cb 0.53 -0.23 -0.02 0.00 1.55 0.00 0.00 27.41 29.24 1ieb h HIS 81 CO 0.09 -0.21 -1.32 -0.91 -1.30 0.00 0.00 177.93 174.28 1ieb h ASN 82 N 0.26 0.19 0.08 3.26 2.35 -1.35 -3.25 115.58 117.13 1ieb h ASN 82 Ca 0.75 -0.24 -0.00 0.00 -0.55 0.00 0.00 56.30 56.26 1ieb h ASN 82 Cb 1.83 -0.06 0.00 0.00 0.05 0.00 0.00 38.32 40.14 1ieb h ASN 82 CO -0.60 1.20 -0.04 0.22 -1.65 0.00 0.00 177.43 176.55 1ieb h TYR 83 N 0.03 -0.11 -0.49 1.19 3.20 0.43 -1.10 116.97 120.13 1ieb h TYR 83 Ca -0.15 -0.00 0.09 0.00 3.14 0.00 0.00 58.73 61.81 1ieb h TYR 83 Cb 1.92 0.04 -0.09 0.00 1.54 0.00 0.00 36.73 40.14 1ieb h TYR 83 CO 0.03 -0.07 -0.14 -1.91 -1.64 0.00 0.00 178.16 174.43 1ieb n GLU 84 N -2.34 -0.07 0.31 1.82 4.07 -0.14 0.17 120.64 124.47 1ieb n GLU 84 Ca -0.01 0.76 -0.17 0.00 -0.06 0.00 0.00 57.16 57.68 1ieb n GLU 84 Cb 0.05 -1.13 -0.09 0.00 -0.06 0.00 0.00 31.44 30.21 1ieb n GLU 84 CO 0.00 0.00 0.00 0.82 -0.06 0.00 0.00 177.13 177.89 1ieb h ILE 85 N 0.00 0.43 0.00 6.31 2.04 -1.54 -2.56 117.51 122.19 1ieb h ILE 85 Ca 0.21 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.98 1ieb h ILE 85 Cb 0.34 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1ieb h ILE 85 CO -0.50 0.02 0.02 -0.26 0.00 0.00 0.00 178.15 177.43 1ieb h PHE 86 N -0.82 0.00 0.00 1.37 0.04 0.31 -1.30 116.94 116.53 1ieb h PHE 86 Ca -0.08 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.69 1ieb h PHE 86 Cb 0.61 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.76 1ieb h PHE 86 CO -0.02 0.00 0.00 -3.47 -0.60 0.00 0.00 178.31 174.22 1ieb n ASP 87 N -2.97 0.19 0.04 2.17 2.03 -0.10 -1.16 116.55 116.76 1ieb n ASP 87 Ca -0.03 0.54 -0.13 0.00 0.52 0.00 0.00 54.79 55.69 1ieb n ASP 87 Cb 0.08 -0.58 -0.14 0.00 -0.72 0.00 0.00 41.12 39.76 1ieb n ASP 87 CO 0.00 0.00 0.00 0.78 -1.92 0.00 0.00 177.20 176.06 1ieb h ASN 88 N 0.00 0.22 0.00 1.67 2.35 -1.34 -3.39 115.58 115.09 1ieb h ASN 88 Ca 0.00 -0.31 0.00 0.00 -0.55 0.00 0.00 56.30 55.44 1ieb h ASN 88 Cb 0.33 -0.07 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1ieb h ASN 88 CO 0.00 1.26 -0.71 2.22 -1.65 0.00 0.00 177.43 178.55 1ieb n PHE 89 N -3.34 0.00 0.32 1.19 -1.74 -1.11 -4.85 117.46 107.93 1ieb n PHE 89 Ca -0.14 0.00 -0.14 0.00 -0.56 0.00 0.00 57.45 56.62 1ieb n PHE 89 Cb 1.02 0.12 -0.07 0.00 1.52 0.00 0.00 39.48 42.08 1ieb n PHE 89 CO 0.00 0.00 0.00 -0.07 -0.56 0.00 0.00 176.76 176.13 1ieb h LEU 90 N 0.00 -0.72 -0.51 5.98 3.38 -1.43 -3.01 115.31 119.01 1ieb h LEU 90 Ca 0.00 0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.05 1ieb h LEU 90 Cb 0.71 0.19 -0.10 0.00 0.09 0.00 0.00 40.66 41.55 1ieb h LEU 90 CO 0.00 -0.33 -0.47 0.58 0.09 0.00 0.00 178.44 178.31 1ieb h VAL 91 N -1.20 0.07 0.00 1.22 2.07 -1.57 -1.36 116.25 115.48 1ieb h VAL 91 Ca -0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1ieb h VAL 91 Cb 0.67 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1ieb h VAL 91 CO 0.14 0.00 0.00 -0.81 0.02 0.00 0.00 177.57 176.92 1ieb n PRO 92 N -5.40 0.56 -1.62 1.57 -0.04 -1.25 -4.88 135.00 123.94 1ieb n PRO 92 Ca -0.00 0.03 -0.51 0.00 -0.04 0.00 0.00 63.50 62.98 1ieb n PRO 92 Cb 0.35 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.25 1ieb n PRO 92 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 1ieb n ARG 93 N -1.11 1.40 -3.90 0.54 0.63 -0.51 -4.96 116.66 108.75 1ieb n ARG 93 Ca 0.15 0.51 -0.11 0.00 -0.92 0.00 0.00 57.85 57.48 1ieb n ARG 93 Cb 0.12 -2.19 -0.11 0.00 0.45 0.00 0.00 32.46 30.72 1ieb n ARG 93 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 1ieb s ARG 94 N 0.97 0.28 -0.18 -0.14 1.81 -1.26 -4.24 118.95 116.18 1ieb s ARG 94 Ca 0.85 -0.30 -0.06 0.00 -1.72 0.00 0.00 55.73 54.49 1ieb s ARG 94 Cb -0.89 0.11 0.09 0.00 -0.45 0.00 0.00 34.95 33.80 1ieb s ARG 94 CO 0.47 -0.05 0.38 0.08 -0.68 0.00 0.00 175.30 175.49 1ieb s VAL 95 N -0.92 -0.59 0.35 3.52 1.01 -0.41 -4.93 120.40 118.43 1ieb s VAL 95 Ca -0.10 0.19 -0.28 0.00 0.00 0.00 0.00 61.98 61.79 1ieb s VAL 95 Cb -0.06 -0.62 -0.10 0.00 0.00 0.00 0.00 36.38 35.61 1ieb s VAL 95 CO 0.00 0.08 1.28 -1.61 0.00 0.00 0.00 175.10 174.85 1ieb s GLU 96 N 2.57 4.26 0.09 2.72 2.02 -1.26 -2.54 118.70 126.54 1ieb s GLU 96 Ca -0.01 2.14 -0.28 0.00 0.02 0.00 0.00 54.97 56.84 1ieb s GLU 96 Cb -0.12 -2.97 -0.06 0.00 0.10 0.00 0.00 34.13 31.09 1ieb s GLU 96 CO -0.12 -0.25 0.90 -1.25 0.02 0.00 0.00 175.26 174.57 1ieb s PRO 97 N -1.92 4.63 -0.73 0.39 0.04 -1.26 -4.51 135.00 131.64 1ieb s PRO 97 Ca 0.51 1.34 -0.27 0.00 0.04 0.00 0.00 61.00 62.62 1ieb s PRO 97 Cb -0.38 -3.38 0.03 0.00 0.04 0.00 0.00 34.50 30.81 1ieb s PRO 97 CO 0.50 0.22 1.30 0.99 0.04 0.00 0.00 177.00 180.05 1ieb s THR 98 N 0.03 3.71 0.26 1.26 2.01 -0.40 -4.85 115.64 117.66 1ieb s THR 98 Ca 0.45 0.42 -0.30 0.00 0.31 0.00 0.00 61.69 62.57 1ieb s THR 98 Cb -0.22 -4.88 -0.09 0.00 0.01 0.00 0.00 72.50 67.32 1ieb s THR 98 CO 0.28 -1.81 1.07 -0.69 -0.69 0.00 0.00 174.62 172.78 1ieb s VAL 99 N 5.85 3.64 -0.08 3.82 1.01 -1.26 -2.34 120.40 131.03 1ieb s VAL 99 Ca 0.37 1.63 -0.04 0.00 0.00 0.00 0.00 61.98 63.93 1ieb s VAL 99 Cb -0.08 -4.03 0.04 0.00 0.00 0.00 0.00 36.38 32.31 1ieb s VAL 99 CO 0.16 0.38 0.18 -0.89 0.00 0.00 0.00 175.10 174.92 1ieb s THR 100 N -1.06 -0.09 0.06 3.92 2.01 0.20 -4.99 115.64 115.70 1ieb s THR 100 Ca 0.44 0.19 0.07 0.00 0.31 0.00 0.00 61.69 62.71 1ieb s THR 100 Cb -0.30 -0.30 -0.03 0.00 0.01 0.00 0.00 72.50 71.87 1ieb s THR 100 CO 0.39 0.08 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.53 1ieb s VAL 101 N 1.38 2.80 0.00 3.82 1.01 -1.26 0.12 120.40 128.27 1ieb s VAL 101 Ca -0.07 -1.25 0.00 0.00 0.00 0.00 0.00 61.98 60.65 1ieb s VAL 101 Cb -0.11 -2.20 0.00 0.00 0.00 0.00 0.00 36.38 34.07 1ieb s VAL 101 CO -0.07 0.29 0.00 0.00 0.00 0.00 0.00 175.10 175.32 1ieb n TYR 102 N 1.40 0.00 -2.75 5.22 4.11 -0.52 -4.99 117.16 119.62 1ieb n TYR 102 Ca -0.16 0.00 -0.22 0.00 -0.00 0.00 0.00 57.90 57.52 1ieb n TYR 102 Cb 0.52 0.00 0.03 0.00 -0.00 0.00 0.00 39.34 39.89 1ieb n TYR 102 CO 0.00 0.00 0.00 -1.25 -0.00 0.00 0.00 176.86 175.61 1ieb s PRO 103 N -2.00 2.72 -0.36 -3.48 0.04 -1.26 0.39 135.00 131.05 1ieb s PRO 103 Ca 0.00 -0.68 0.08 0.00 0.04 0.00 0.00 61.00 60.43 1ieb s PRO 103 Cb 0.00 -2.51 0.64 0.00 0.04 0.00 0.00 34.50 32.67 1ieb s PRO 103 CO 0.00 -0.57 1.74 0.25 0.04 0.00 0.00 177.00 178.46 1ieb n THR 104 N -2.26 2.91 -1.59 1.26 -2.24 -1.21 -4.87 114.28 106.28 1ieb n THR 104 Ca 0.06 -2.06 -0.65 0.00 -2.27 0.00 0.00 64.05 59.14 1ieb n THR 104 Cb 0.59 -0.39 -0.10 0.00 -2.10 0.00 0.00 70.33 68.33 1ieb n THR 104 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1ieb n LYS 105 N -0.83 0.11 0.00 -0.78 0.00 -1.26 -4.83 118.16 110.57 1ieb n LYS 105 Ca 0.45 0.04 0.00 0.00 0.00 0.00 0.00 58.31 58.80 1ieb n LYS 105 Cb 1.38 -1.57 0.00 0.00 0.00 0.00 0.00 35.03 34.85 1ieb n LYS 105 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1ieb n THR 106 N 4.85 0.00 0.00 3.15 -2.24 -1.26 -5.07 114.28 113.71 1ieb n THR 106 Ca 0.38 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 62.16 1ieb n THR 106 Cb -0.03 -0.56 0.00 0.00 -2.10 0.00 0.00 70.33 67.64 1ieb n THR 106 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ieb n GLN 107 N -0.62 0.00 0.00 -0.78 0.00 -1.26 -5.09 117.38 109.62 1ieb n GLN 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.00 57.00 1ieb n GLN 107 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1ieb n GLN 107 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1ieb n PRO 108 N -0.36 0.00 0.00 2.61 -0.04 -1.26 -4.99 135.00 130.96 1ieb n PRO 108 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1ieb n PRO 108 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1ieb n PRO 108 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1ieb n LEU 109 N 0.00 0.00 0.00 1.53 4.32 -1.26 -4.71 117.00 116.88 1ieb n LEU 109 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 55.99 1ieb n LEU 109 Cb 0.00 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 41.80 1ieb n LEU 109 CO 0.00 0.00 0.00 -0.62 -1.22 0.00 0.00 177.39 175.55 1ieb n GLU 110 N 0.00 0.00 -0.14 3.23 -0.58 -1.26 -4.64 120.64 117.26 1ieb n GLU 110 Ca 0.00 0.00 0.27 0.00 -0.42 0.00 0.00 57.16 57.01 1ieb n GLU 110 Cb 0.00 -0.00 0.72 0.00 -0.57 0.00 0.00 31.44 31.59 1ieb n GLU 110 CO 0.00 0.00 0.00 1.12 -0.48 0.00 0.00 177.13 177.77 1ieb h HIS 111 N 0.00 0.00 -0.74 -0.32 -0.00 -1.99 -3.47 115.15 108.64 1ieb h HIS 111 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.37 1ieb h HIS 111 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.41 1ieb h HIS 111 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 177.93 179.51 1ieb n HIS 112 N -4.22 0.00 -1.60 6.12 -0.00 -1.26 -4.78 115.22 109.47 1ieb n HIS 112 Ca 0.17 0.00 -0.46 0.00 -0.00 0.00 0.00 57.72 57.43 1ieb n HIS 112 Cb 0.90 -1.09 -0.04 0.00 -0.00 0.00 0.00 29.99 29.75 1ieb n HIS 112 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 176.34 176.43 1ieb n ASN 113 N 0.00 3.24 -4.73 0.26 3.02 -1.26 -4.35 115.26 111.44 1ieb n ASN 113 Ca 0.00 0.58 -0.42 0.00 -0.03 0.00 0.00 54.58 54.72 1ieb n ASN 113 Cb 0.00 -1.44 -0.02 0.00 -0.61 0.00 0.00 39.78 37.71 1ieb n ASN 113 CO 0.00 0.00 0.00 -1.48 -2.62 0.00 0.00 177.26 173.16 1ieb s LEU 114 N 6.26 4.36 -0.41 3.41 2.34 -1.26 -4.41 118.68 128.98 1ieb s LEU 114 Ca 0.98 2.79 -0.28 0.00 0.06 0.00 0.00 54.13 57.69 1ieb s LEU 114 Cb -0.56 -3.61 -0.01 0.00 -0.56 0.00 0.00 46.19 41.44 1ieb s LEU 114 CO 0.44 -0.86 1.72 -0.76 -1.06 0.00 0.00 176.35 175.82 1ieb s LEU 115 N 0.28 3.48 -0.43 1.48 2.01 0.63 -3.30 118.68 122.82 1ieb s LEU 115 Ca 0.67 0.99 -0.25 0.00 0.01 0.00 0.00 54.13 55.55 1ieb s LEU 115 Cb -0.46 -3.32 0.02 0.00 0.01 0.00 0.00 46.19 42.44 1ieb s LEU 115 CO 0.40 -1.77 0.87 -0.69 1.01 0.00 0.00 176.35 176.17 1ieb s VAL 116 N 6.95 4.57 -0.79 -1.59 1.01 0.16 -1.09 120.40 129.62 1ieb s VAL 116 Ca 0.73 0.77 -0.12 0.00 0.00 0.00 0.00 61.98 63.35 1ieb s VAL 116 Cb -0.18 -4.36 0.21 0.00 0.00 0.00 0.00 36.38 32.04 1ieb s VAL 116 CO 0.31 -0.71 0.71 0.00 0.00 0.00 0.00 175.10 175.41 1ieb s SER 118 N 1.93 7.04 -0.34 0.00 0.15 0.33 -2.09 113.70 120.73 1ieb s SER 118 Ca 0.17 1.29 -0.03 0.00 0.70 0.00 0.00 55.95 58.09 1ieb s SER 118 Cb -0.12 -2.50 0.06 0.00 -1.71 0.00 0.00 66.02 61.75 1ieb s SER 118 CO -0.08 -0.51 0.08 -0.69 1.20 0.00 0.00 173.24 173.24 1ieb s VAL 119 N 2.54 3.22 0.39 4.45 1.01 -0.26 0.63 120.40 132.37 1ieb s VAL 119 Ca 0.42 -1.53 0.08 0.00 0.00 0.00 0.00 61.98 60.95 1ieb s VAL 119 Cb -0.16 -2.95 -0.07 0.00 0.00 0.00 0.00 36.38 33.20 1ieb s VAL 119 CO 0.11 -0.28 0.01 -0.94 0.00 0.00 0.00 175.10 174.00 1ieb s SER 120 N 1.44 3.95 -1.24 3.32 1.04 -0.99 -0.33 113.70 120.89 1ieb s SER 120 Ca -0.01 -1.27 -0.24 0.00 0.48 0.00 0.00 55.95 54.91 1ieb s SER 120 Cb -0.21 -0.41 0.02 0.00 0.10 0.00 0.00 66.02 65.52 1ieb s SER 120 CO -0.01 -0.40 0.64 0.47 0.98 0.00 0.00 173.24 174.91 1ieb n ASP 121 N -0.97 -3.73 -4.43 7.02 9.92 -0.30 -1.27 116.55 122.79 1ieb n ASP 121 Ca -0.04 -1.17 -0.21 0.00 -0.53 0.00 0.00 54.79 52.83 1ieb n ASP 121 Cb 0.66 -2.41 -0.10 0.00 -0.64 0.00 0.00 41.12 38.62 1ieb n ASP 121 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 1ieb s PHE 122 N -3.62 1.99 -0.28 1.24 -0.12 -1.10 -4.27 117.98 111.81 1ieb s PHE 122 Ca 0.40 -0.62 -0.23 0.00 -0.05 0.00 0.00 56.93 56.43 1ieb s PHE 122 Cb -0.19 -1.08 0.12 0.00 -0.63 0.00 0.00 43.02 41.25 1ieb s PHE 122 CO 0.93 0.37 0.99 -0.47 -0.05 0.00 0.00 175.22 176.99 1ieb s TYR 123 N -2.92 -0.53 1.34 3.49 6.14 -1.05 -0.48 117.35 123.33 1ieb s TYR 123 Ca 0.29 1.23 -0.20 0.00 0.64 0.00 0.00 57.07 59.02 1ieb s TYR 123 Cb 0.02 0.37 0.34 0.00 0.42 0.00 0.00 41.96 43.11 1ieb s TYR 123 CO 0.12 -0.26 0.97 -1.25 0.64 0.00 0.00 175.55 175.77 1ieb s PRO 124 N 0.55 -2.28 0.04 4.97 0.04 -1.26 -1.29 135.00 135.78 1ieb s PRO 124 Ca -0.00 0.27 -0.27 0.00 0.04 0.00 0.00 61.00 61.04 1ieb s PRO 124 Cb -0.05 -1.44 -0.17 0.00 0.04 0.00 0.00 34.50 32.88 1ieb s PRO 124 CO -0.09 -4.48 1.45 0.78 0.04 0.00 0.00 177.00 174.70 1ieb h GLY 125 N -3.14 -0.54 -5.61 0.56 0.00 -1.99 -3.45 103.07 88.91 1ieb h GLY 125 Ca -0.48 0.20 -0.69 0.00 0.00 0.00 0.00 47.33 46.36 1ieb h GLY 125 CO 0.35 -0.20 0.52 1.16 0.00 0.00 0.00 176.54 178.38 1ieb n ASN 126 N -5.24 1.75 -3.72 0.19 2.04 -1.26 -4.95 115.26 104.06 1ieb n ASN 126 Ca -0.10 1.11 -0.04 0.00 -0.44 0.00 0.00 54.58 55.10 1ieb n ASN 126 Cb 0.26 -1.18 -0.01 0.00 -2.53 0.00 0.00 39.78 36.32 1ieb n ASN 126 CO 0.00 0.00 0.00 -0.51 -0.44 0.00 0.00 177.26 176.31 1ieb s ILE 127 N 1.00 0.00 -0.04 1.53 2.07 -1.26 -4.47 121.20 120.03 1ieb s ILE 127 Ca 0.87 -0.76 -0.02 0.00 -1.41 0.00 0.00 60.65 59.33 1ieb s ILE 127 Cb -0.98 -2.10 0.03 0.00 0.13 0.00 0.00 42.46 39.55 1ieb s ILE 127 CO 0.50 0.00 0.06 -1.61 -1.91 0.00 0.00 174.94 171.99 1ieb s GLU 128 N -3.33 -0.06 -0.21 3.50 2.02 -0.95 -5.00 118.70 114.66 1ieb s GLU 128 Ca 0.13 0.36 0.01 0.00 0.02 0.00 0.00 54.97 55.50 1ieb s GLU 128 Cb -0.03 -0.45 0.03 0.00 0.10 0.00 0.00 34.13 33.79 1ieb s GLU 128 CO 0.04 -0.30 -0.16 0.08 0.02 0.00 0.00 175.26 174.94 1ieb s VAL 129 N 2.00 2.18 -0.08 2.63 1.01 -1.26 -1.28 120.40 125.60 1ieb s VAL 129 Ca 0.03 -1.17 0.04 0.00 0.00 0.00 0.00 61.98 60.87 1ieb s VAL 129 Cb -0.12 -2.06 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 1ieb s VAL 129 CO -0.03 0.32 -0.20 -0.13 0.00 0.00 0.00 175.10 175.06 1ieb s ARG 130 N 1.23 2.85 -0.15 2.72 0.52 0.20 -4.94 118.95 121.39 1ieb s ARG 130 Ca 0.00 -0.81 -0.12 0.00 -0.52 0.00 0.00 55.73 54.27 1ieb s ARG 130 Cb -0.16 -2.34 -0.05 0.00 0.52 0.00 0.00 34.95 32.93 1ieb s ARG 130 CO -0.10 0.33 0.25 -1.58 0.02 0.00 0.00 175.30 174.22 1ieb s TRP 131 N -0.02 3.49 -0.07 -0.53 0.23 -1.26 -0.12 118.94 120.67 1ieb s TRP 131 Ca -0.06 0.56 0.05 0.00 -2.03 0.00 0.00 56.10 54.62 1ieb s TRP 131 Cb -0.15 -2.24 -0.01 0.00 0.03 0.00 0.00 33.47 31.10 1ieb s TRP 131 CO 0.05 0.35 -0.24 -0.06 0.96 0.00 0.00 176.95 178.01 1ieb s PHE 132 N 0.11 2.49 -1.13 -1.98 0.40 0.43 -2.64 117.98 115.66 1ieb s PHE 132 Ca 0.15 -0.80 -0.15 0.00 -0.60 0.00 0.00 56.93 55.53 1ieb s PHE 132 Cb -0.13 -1.64 0.17 0.00 0.51 0.00 0.00 43.02 41.93 1ieb s PHE 132 CO 0.03 -0.26 1.34 0.50 0.70 0.00 0.00 175.22 177.53 1ieb s ARG 133 N -0.02 3.97 0.00 0.44 6.06 -0.63 -1.94 118.95 126.82 1ieb s ARG 133 Ca -0.08 -2.41 0.00 0.00 -2.50 0.00 0.00 55.73 50.74 1ieb s ARG 133 Cb -0.15 -5.00 0.00 0.00 0.06 0.00 0.00 34.95 29.86 1ieb s ARG 133 CO 0.05 -1.74 0.00 0.09 -2.50 0.00 0.00 175.30 171.20 1ieb n ASN 134 N 5.73 0.00 0.12 -2.12 4.13 -1.07 -3.75 115.26 118.30 1ieb n ASN 134 Ca 0.33 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.59 1ieb n ASN 134 Cb 0.44 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.68 1ieb n ASN 134 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ieb n GLY 135 N 0.00 -1.80 3.82 7.41 0.00 -1.26 -4.95 105.19 108.41 1ieb n GLY 135 Ca 0.00 0.40 -0.32 0.00 0.00 0.00 0.00 46.02 46.10 1ieb n GLY 135 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1ieb s LYS 136 N -1.48 3.19 -0.73 1.61 2.20 -1.25 -4.94 119.74 118.34 1ieb s LYS 136 Ca 0.00 1.01 -0.26 0.00 -0.36 0.00 0.00 55.97 56.36 1ieb s LYS 136 Cb 0.00 -2.02 -0.02 0.00 -1.51 0.00 0.00 37.83 34.28 1ieb s LYS 136 CO 0.00 -0.90 1.77 -2.00 -0.36 0.00 0.00 175.35 173.87 1ieb s GLU 137 N -4.69 2.75 -0.99 4.03 2.12 -1.26 -1.61 118.70 119.06 1ieb s GLU 137 Ca 0.59 0.15 -0.26 0.00 0.36 0.00 0.00 54.97 55.81 1ieb s GLU 137 Cb -0.14 -4.60 -0.19 0.00 0.26 0.00 0.00 34.13 29.47 1ieb s GLU 137 CO 0.48 -2.78 2.20 -2.00 -0.54 0.00 0.00 175.26 172.61 1ieb s GLU 138 N 6.72 1.39 0.00 4.30 2.56 -1.08 -4.76 118.70 127.83 1ieb s GLU 138 Ca 0.62 -0.17 0.00 0.00 0.00 0.00 0.00 54.97 55.42 1ieb s GLU 138 Cb -0.10 -4.93 0.00 0.00 2.00 0.00 0.00 34.13 31.10 1ieb s GLU 138 CO 0.12 -5.06 0.96 1.63 -0.56 0.00 0.00 175.26 172.35 1ieb n LYS 139 N 8.40 0.82 -3.61 4.30 5.02 -1.26 -4.78 118.16 127.05 1ieb n LYS 139 Ca 0.43 0.00 -0.14 0.00 -2.02 0.00 0.00 58.31 56.58 1ieb n LYS 139 Cb 0.46 -1.09 -0.06 0.00 -0.02 0.00 0.00 35.03 34.31 1ieb n LYS 139 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 1ieb s THR 140 N 0.22 0.04 -0.08 -0.18 -1.32 -1.26 -4.89 115.64 108.15 1ieb s THR 140 Ca 0.00 -0.29 0.00 0.00 -1.21 0.00 0.00 61.69 60.19 1ieb s THR 140 Cb 0.00 -0.93 0.00 0.00 -1.51 0.00 0.00 72.50 70.06 1ieb s THR 140 CO 0.00 -0.16 0.00 0.61 -2.21 0.00 0.00 174.62 172.86 1ieb n GLY 141 N 0.60 0.45 3.22 6.08 0.00 -1.26 -4.75 105.19 109.53 1ieb n GLY 141 Ca -0.19 -0.96 -0.43 0.00 0.00 0.00 0.00 46.02 44.44 1ieb n GLY 141 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1ieb n ILE 142 N -2.97 3.99 -1.96 -0.61 2.08 -1.26 -1.09 119.36 117.53 1ieb n ILE 142 Ca -0.01 -4.07 -0.42 0.00 0.56 0.00 0.00 62.75 58.81 1ieb n ILE 142 Cb 0.03 -2.44 -0.03 0.00 -0.75 0.00 0.00 39.64 36.45 1ieb n ILE 142 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1ieb s VAL 143 N 2.60 2.99 0.12 1.39 1.01 0.27 -4.78 120.40 124.00 1ieb s VAL 143 Ca 0.47 0.54 0.03 0.00 0.00 0.00 0.00 61.98 63.02 1ieb s VAL 143 Cb 0.06 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 33.05 1ieb s VAL 143 CO 0.01 0.01 -0.09 -0.55 0.00 0.00 0.00 175.10 174.48 1ieb s SER 144 N 1.98 1.48 -0.05 3.32 0.15 -1.26 0.13 113.70 119.44 1ieb s SER 144 Ca 0.72 -0.96 0.14 0.00 0.70 0.00 0.00 55.95 56.54 1ieb s SER 144 Cb -0.40 0.03 -0.23 0.00 -1.71 0.00 0.00 66.02 63.72 1ieb s SER 144 CO 0.31 -0.36 0.62 0.35 1.20 0.00 0.00 173.24 175.36 1ieb n THR 145 N 0.04 1.55 -0.26 6.45 -2.24 -0.79 -5.00 114.28 114.03 1ieb n THR 145 Ca -0.12 -0.79 0.00 0.00 -2.27 0.00 0.00 64.05 60.86 1ieb n THR 145 Cb 0.60 -0.95 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 1ieb n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ieb n GLY 146 N 1.56 -3.09 3.67 3.38 0.00 -1.26 -4.80 105.19 104.64 1ieb n GLY 146 Ca -0.18 -1.79 -0.42 0.00 0.00 0.00 0.00 46.02 43.62 1ieb n GLY 146 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ieb s LEU 147 N 0.00 4.27 -0.11 0.99 2.96 -1.26 -4.52 118.68 121.00 1ieb s LEU 147 Ca 0.00 2.00 -0.05 0.00 -0.22 0.00 0.00 54.13 55.87 1ieb s LEU 147 Cb 0.00 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.11 1ieb s LEU 147 CO 0.00 -0.81 0.07 -0.69 -1.32 0.00 0.00 176.35 173.59 1ieb s VAL 148 N 3.42 4.87 -0.19 1.68 1.01 -0.33 -5.00 120.40 125.86 1ieb s VAL 148 Ca 0.64 -0.03 -0.01 0.00 0.00 0.00 0.00 61.98 62.58 1ieb s VAL 148 Cb -0.29 -3.10 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1ieb s VAL 148 CO 0.23 0.59 -0.11 -0.60 0.00 0.00 0.00 175.10 175.21 1ieb s ARG 149 N -0.75 3.23 0.10 2.72 3.52 -1.26 -2.53 118.95 123.99 1ieb s ARG 149 Ca 0.12 -0.71 0.26 0.00 -0.13 0.00 0.00 55.73 55.27 1ieb s ARG 149 Cb -0.12 -2.79 0.65 0.00 -1.56 0.00 0.00 34.95 31.14 1ieb s ARG 149 CO 0.03 -0.14 1.56 0.09 -0.81 0.00 0.00 175.30 176.03 1ieb n ASN 150 N 4.53 0.58 0.00 -2.12 3.02 -1.01 -4.97 115.26 115.29 1ieb n ASN 150 Ca -0.19 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.60 1ieb n ASN 150 Cb 0.51 -0.20 0.00 0.00 -0.61 0.00 0.00 39.78 39.48 1ieb n ASN 150 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ieb n GLY 151 N 1.38 2.09 2.32 7.41 0.00 -1.26 -4.87 105.19 112.26 1ieb n GLY 151 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.77 1ieb n GLY 151 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ieb n ASP 152 N 0.00 6.20 -2.16 1.61 5.68 -1.26 -4.91 116.55 121.70 1ieb n ASP 152 Ca 0.00 -3.77 -0.12 0.00 -0.50 0.00 0.00 54.79 50.40 1ieb n ASP 152 Cb 0.00 -0.67 -0.02 0.00 -1.14 0.00 0.00 41.12 39.29 1ieb n ASP 152 CO 0.00 0.00 0.00 0.79 -1.33 0.00 0.00 177.20 176.66 1ieb n TRP 153 N -0.72 -1.16 -4.58 2.11 7.02 -1.26 -4.98 117.44 113.86 1ieb n TRP 153 Ca 0.51 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.76 1ieb n TRP 153 Cb 0.72 -2.66 -0.16 0.00 -2.42 0.00 0.00 31.31 26.79 1ieb n TRP 153 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1ieb s THR 154 N -2.46 1.08 0.48 -0.99 -4.23 -1.26 -4.73 115.64 103.52 1ieb s THR 154 Ca 0.00 -0.50 0.08 0.00 -1.18 0.00 0.00 61.69 60.09 1ieb s THR 154 Cb 0.00 -0.96 0.08 0.00 1.34 0.00 0.00 72.50 72.96 1ieb s THR 154 CO 0.00 0.33 0.63 0.49 -0.54 0.00 0.00 174.62 175.53 1ieb n PHE 155 N 3.41 -2.28 -3.60 3.99 3.01 0.37 -2.40 117.46 119.97 1ieb n PHE 155 Ca -0.20 -1.76 -0.04 0.00 1.01 0.00 0.00 57.45 56.47 1ieb n PHE 155 Cb 0.53 -0.45 -0.02 0.00 -0.01 0.00 0.00 39.48 39.53 1ieb n PHE 155 CO 0.00 0.00 0.00 1.14 1.01 0.00 0.00 176.76 178.91 1ieb s GLN 156 N -4.14 0.31 -0.28 -1.08 -2.07 -1.05 -1.14 119.66 110.20 1ieb s GLN 156 Ca 0.48 -0.12 -0.20 0.00 -1.82 0.00 0.00 55.36 53.70 1ieb s GLN 156 Cb -0.04 0.14 0.12 0.00 -1.09 0.00 0.00 33.01 32.14 1ieb s GLN 156 CO 0.31 -0.14 0.93 -0.08 -1.32 0.00 0.00 175.29 174.99 1ieb s THR 157 N -2.41 0.00 -0.24 3.63 -1.32 0.55 -1.18 115.64 114.67 1ieb s THR 157 Ca 0.10 0.00 -0.07 0.00 -1.21 0.00 0.00 61.69 60.51 1ieb s THR 157 Cb -0.00 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.96 1ieb s THR 157 CO -0.04 0.00 0.06 -0.76 -2.21 0.00 0.00 174.62 171.66 1ieb s LEU 158 N 0.87 3.41 -0.51 9.08 1.43 -1.26 -1.11 118.68 130.59 1ieb s LEU 158 Ca -0.04 -0.20 -0.07 0.00 -1.03 0.00 0.00 54.13 52.80 1ieb s LEU 158 Cb -0.04 -1.90 0.13 0.00 0.03 0.00 0.00 46.19 44.40 1ieb s LEU 158 CO -0.11 -0.01 0.36 -0.69 0.23 0.00 0.00 176.35 176.13 1ieb s VAL 159 N 1.47 4.00 -0.15 -1.59 1.01 -0.89 -1.88 120.40 122.38 1ieb s VAL 159 Ca 0.06 -2.13 -0.17 0.00 0.00 0.00 0.00 61.98 59.73 1ieb s VAL 159 Cb -0.15 -3.64 -0.04 0.00 0.00 0.00 0.00 36.38 32.55 1ieb s VAL 159 CO 0.03 -0.80 0.45 -0.04 0.00 0.00 0.00 175.10 174.74 1ieb s MET 160 N 0.94 4.29 -0.24 2.72 1.00 0.34 -2.13 119.30 126.22 1ieb s MET 160 Ca 0.09 0.36 -0.08 0.00 0.00 0.00 0.00 55.69 56.06 1ieb s MET 160 Cb -0.23 -3.47 -0.04 0.00 0.00 0.00 0.00 34.83 31.10 1ieb s MET 160 CO -0.03 0.10 0.10 -1.17 0.00 0.00 0.00 175.02 174.02 1ieb s LEU 161 N 0.83 3.69 -0.32 -0.03 2.96 -0.25 0.96 118.68 126.52 1ieb s LEU 161 Ca 0.23 -0.07 -0.29 0.00 -0.22 0.00 0.00 54.13 53.78 1ieb s LEU 161 Cb -0.15 -1.98 0.02 0.00 0.50 0.00 0.00 46.19 44.58 1ieb s LEU 161 CO 0.09 0.03 1.06 -1.61 -1.32 0.00 0.00 176.35 174.60 1ieb s GLU 162 N 1.27 4.06 0.34 1.98 2.02 -0.25 -0.27 118.70 127.84 1ieb s GLU 162 Ca 0.05 1.05 -0.16 0.00 0.02 0.00 0.00 54.97 55.93 1ieb s GLU 162 Cb -0.14 -3.74 0.04 0.00 0.10 0.00 0.00 34.13 30.38 1ieb s GLU 162 CO 0.04 -0.89 0.73 0.95 0.02 0.00 0.00 175.26 176.11 1ieb s THR 163 N 3.62 0.00 -0.60 3.63 -4.23 -1.26 -4.87 115.64 111.93 1ieb s THR 163 Ca 0.45 -1.07 0.02 0.00 -1.18 0.00 0.00 61.69 59.91 1ieb s THR 163 Cb -0.12 -2.52 0.15 0.00 1.34 0.00 0.00 72.50 71.35 1ieb s THR 163 CO 0.15 0.00 0.38 0.68 -0.54 0.00 0.00 174.62 175.29 1ieb s VAL 164 N -3.02 3.05 -0.11 2.29 -7.23 -1.26 -4.20 120.40 109.92 1ieb s VAL 164 Ca 0.15 -3.42 -0.37 0.00 -1.81 0.00 0.00 61.98 56.54 1ieb s VAL 164 Cb -0.05 -3.04 -0.14 0.00 0.56 0.00 0.00 36.38 33.71 1ieb s VAL 164 CO 0.10 -0.87 1.72 -2.65 -0.31 0.00 0.00 175.10 173.09 1ieb n PRO 165 N 2.98 1.64 -4.20 4.82 -0.02 -1.26 -4.96 135.00 134.00 1ieb n PRO 165 Ca 0.09 0.60 -0.12 0.00 -2.02 0.00 0.00 63.50 62.05 1ieb n PRO 165 Cb 0.34 -2.34 -0.10 0.00 -0.02 0.00 0.00 33.50 31.38 1ieb n PRO 165 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1ieb s GLN 166 N 3.00 0.96 0.98 -0.52 -0.21 -1.26 -5.15 119.66 117.46 1ieb s GLN 166 Ca 0.92 -1.43 -0.12 0.00 0.02 0.00 0.00 55.36 54.76 1ieb s GLN 166 Cb -0.87 -0.21 0.18 0.00 1.00 0.00 0.00 33.01 33.10 1ieb s GLN 166 CO 0.55 -0.08 1.08 -1.12 -2.12 0.00 0.00 175.29 173.60 1ieb s SER 167 N -3.10 2.57 -1.65 5.90 0.01 -1.26 -3.80 113.70 112.37 1ieb s SER 167 Ca 0.18 1.64 0.00 0.00 1.31 0.00 0.00 55.95 59.08 1ieb s SER 167 Cb 0.06 -2.29 0.00 0.00 0.21 0.00 0.00 66.02 64.00 1ieb s SER 167 CO -0.00 -3.23 0.00 0.61 0.41 0.00 0.00 173.24 171.03 1ieb n GLY 168 N -0.26 1.04 3.09 3.44 0.00 -1.26 -4.97 105.19 106.26 1ieb n GLY 168 Ca 0.07 -0.22 -0.07 0.00 0.00 0.00 0.00 46.02 45.79 1ieb n GLY 168 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ieb s GLU 169 N -3.84 0.37 -0.20 1.61 -1.05 -1.25 -5.11 118.70 109.22 1ieb s GLU 169 Ca 0.00 0.79 -0.08 0.00 -0.15 0.00 0.00 54.97 55.53 1ieb s GLU 169 Cb 0.00 -0.05 -0.04 0.00 -0.44 0.00 0.00 34.13 33.60 1ieb s GLU 169 CO 0.00 -0.48 0.07 0.14 0.95 0.00 0.00 175.26 175.94 1ieb s VAL 170 N 2.61 4.74 0.29 1.83 -7.23 -1.26 -4.80 120.40 116.57 1ieb s VAL 170 Ca 0.08 -0.04 -0.18 0.00 -1.81 0.00 0.00 61.98 60.02 1ieb s VAL 170 Cb -0.14 -3.16 -0.09 0.00 0.56 0.00 0.00 36.38 33.55 1ieb s VAL 170 CO -0.15 0.42 0.76 -0.31 -0.31 0.00 0.00 175.10 175.50 1ieb s TYR 171 N 0.71 3.50 0.01 2.82 1.51 0.25 -2.59 117.35 123.57 1ieb s TYR 171 Ca 0.04 1.34 0.04 0.00 -1.01 0.00 0.00 57.07 57.48 1ieb s TYR 171 Cb -0.13 -2.61 -0.01 0.00 -0.11 0.00 0.00 41.96 39.09 1ieb s TYR 171 CO 0.02 0.18 -0.11 0.99 -1.11 0.00 0.00 175.55 175.52 1ieb s THR 172 N -1.79 0.86 -0.28 -0.71 2.01 -0.82 0.12 115.64 115.02 1ieb s THR 172 Ca 0.50 -0.68 0.01 0.00 0.31 0.00 0.00 61.69 61.83 1ieb s THR 172 Cb -0.13 -0.76 0.06 0.00 0.01 0.00 0.00 72.50 71.68 1ieb s THR 172 CO 0.19 0.08 -0.06 0.00 -0.69 0.00 0.00 174.62 174.14 1ieb s GLN 174 N 1.14 2.93 -0.28 0.00 0.74 0.83 -1.65 119.66 123.38 1ieb s GLN 174 Ca -0.07 -1.02 -0.07 0.00 0.05 0.00 0.00 55.36 54.25 1ieb s GLN 174 Cb -0.20 -3.83 -0.01 0.00 1.10 0.00 0.00 33.01 30.08 1ieb s GLN 174 CO -0.04 -0.70 0.09 0.08 -0.55 0.00 0.00 175.29 174.17 1ieb s VAL 175 N 1.61 4.19 -0.12 1.34 1.01 0.06 -0.63 120.40 127.87 1ieb s VAL 175 Ca 0.03 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.53 1ieb s VAL 175 Cb -0.19 -3.08 -0.03 0.00 0.00 0.00 0.00 36.38 33.08 1ieb s VAL 175 CO 0.08 0.18 -0.03 -1.61 0.00 0.00 0.00 175.10 173.71 1ieb s GLU 176 N 1.56 3.28 0.02 2.72 8.01 -0.40 -1.58 118.70 132.31 1ieb s GLU 176 Ca 0.04 -0.49 -0.18 0.00 0.01 0.00 0.00 54.97 54.35 1ieb s GLU 176 Cb -0.16 -2.81 0.03 0.00 -4.31 0.00 0.00 34.13 26.88 1ieb s GLU 176 CO 0.03 0.47 0.40 -1.58 0.01 0.00 0.00 175.26 174.59 1ieb s HIS 177 N -0.25 -0.26 -1.52 1.61 2.46 -1.26 -2.25 115.29 113.82 1ieb s HIS 177 Ca 0.05 0.29 0.00 0.00 0.47 0.00 0.00 55.06 55.86 1ieb s HIS 177 Cb -0.13 0.19 0.00 0.00 -0.13 0.00 0.00 32.58 32.52 1ieb s HIS 177 CO 0.02 -0.52 0.20 -2.30 -2.47 0.00 0.00 174.74 169.67 1ieb n PRO 178 N 0.73 0.27 0.00 2.88 -0.02 -1.26 -0.11 135.00 137.48 1ieb n PRO 178 Ca -0.19 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.29 1ieb n PRO 178 Cb 0.59 -1.06 0.00 0.00 -0.02 0.00 0.00 33.50 33.00 1ieb n PRO 178 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1ieb n SER 179 N -0.08 0.45 -4.32 2.55 3.41 -1.26 -4.98 113.62 109.39 1ieb n SER 179 Ca 0.00 -0.74 -0.36 0.00 -0.26 0.00 0.00 58.87 57.51 1ieb n SER 179 Cb 0.03 0.32 -0.13 0.00 -0.26 0.00 0.00 64.21 64.17 1ieb n SER 179 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 1ieb s LEU 180 N -0.64 3.29 0.05 1.04 1.43 0.84 -4.85 118.68 119.84 1ieb s LEU 180 Ca 0.00 -0.55 -0.19 0.00 -1.03 0.00 0.00 54.13 52.36 1ieb s LEU 180 Cb 0.00 -1.79 -0.14 0.00 0.03 0.00 0.00 46.19 44.29 1ieb s LEU 180 CO 0.00 -0.09 1.34 0.71 0.23 0.00 0.00 176.35 178.54 1ieb h THR 181 N 5.81 1.35 -3.60 5.49 1.35 -1.94 -3.40 112.91 117.96 1ieb h THR 181 Ca -0.37 -1.41 -0.67 0.00 -0.55 0.00 0.00 66.41 63.41 1ieb h THR 181 Cb 1.14 1.88 -0.19 0.00 -1.73 0.00 0.00 68.15 69.25 1ieb h THR 181 CO 0.60 0.42 -0.80 -1.81 -0.25 0.00 0.00 175.52 173.67 1ieb s ASP 182 N -6.28 3.80 0.56 5.36 1.11 -1.26 -5.05 116.67 114.92 1ieb s ASP 182 Ca -0.14 -0.62 -0.20 0.00 0.18 0.00 0.00 52.55 51.77 1ieb s ASP 182 Cb 0.06 -0.49 -0.05 0.00 1.07 0.00 0.00 42.92 43.51 1ieb s ASP 182 CO 0.78 0.16 1.23 -2.16 1.18 0.00 0.00 175.17 176.36 1ieb s PRO 183 N -2.27 3.15 -0.20 8.23 0.04 -1.26 -4.91 135.00 137.78 1ieb s PRO 183 Ca 0.19 1.90 -0.14 0.00 0.04 0.00 0.00 61.00 63.00 1ieb s PRO 183 Cb -0.10 -2.08 -0.04 0.00 0.04 0.00 0.00 34.50 32.31 1ieb s PRO 183 CO 0.10 -1.08 0.29 0.08 0.04 0.00 0.00 177.00 176.42 1ieb s VAL 184 N -1.52 5.29 -0.07 -0.36 1.01 -0.61 -4.93 120.40 119.20 1ieb s VAL 184 Ca 0.74 0.50 0.03 0.00 0.00 0.00 0.00 61.98 63.24 1ieb s VAL 184 Cb -0.32 -3.62 0.01 0.00 0.00 0.00 0.00 36.38 32.44 1ieb s VAL 184 CO 0.36 0.33 -0.15 0.42 0.00 0.00 0.00 175.10 176.07 1ieb s THR 185 N 0.89 1.33 -0.22 3.92 -4.23 -1.25 -0.76 115.64 115.33 1ieb s THR 185 Ca 0.15 -0.59 0.02 0.00 -1.18 0.00 0.00 61.69 60.08 1ieb s THR 185 Cb -0.14 -1.20 0.04 0.00 1.34 0.00 0.00 72.50 72.55 1ieb s THR 185 CO 0.05 0.40 -0.12 -0.69 -0.54 0.00 0.00 174.62 173.72 1ieb s VAL 186 N 0.63 1.88 0.70 2.29 1.01 -0.66 -4.91 120.40 121.33 1ieb s VAL 186 Ca -0.15 -1.19 -0.06 0.00 0.00 0.00 0.00 61.98 60.58 1ieb s VAL 186 Cb -0.16 -1.92 0.06 0.00 0.00 0.00 0.00 36.38 34.37 1ieb s VAL 186 CO 0.04 0.17 1.00 -1.61 0.00 0.00 0.00 175.10 174.70 1ieb s GLU 187 N 1.29 2.17 0.00 2.72 2.02 -1.26 -0.35 118.70 125.28 1ieb s GLU 187 Ca -0.03 -0.34 0.00 0.00 0.02 0.00 0.00 54.97 54.62 1ieb s GLU 187 Cb -0.17 -2.20 0.00 0.00 0.10 0.00 0.00 34.13 31.86 1ieb s GLU 187 CO -0.08 -1.23 0.00 1.87 0.02 0.00 0.00 175.26 175.84