#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 0.54 -2.48 2.89 8.00 -1.26 -5.16 116.55 119.09 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 0.97 -3.77 -1.24 1.74 -1.26 -5.07 116.66 108.03 1ieb n ARG 6 Ca 0.00 0.00 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 1ieb n ARG 6 Cb 0.00 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.37 1ieb n ARG 6 CO 0.00 0.00 0.00 -1.64 -1.52 0.00 0.00 177.63 174.47 1ieb s MET 7 N -0.42 3.81 0.03 5.56 -1.94 -1.26 -5.06 119.30 120.02 1ieb s MET 7 Ca 0.00 -0.10 -0.30 0.00 -1.71 0.00 0.00 55.69 53.58 1ieb s MET 7 Cb 0.00 -3.29 -0.08 0.00 2.01 0.00 0.00 34.83 33.47 1ieb s MET 7 CO 0.00 0.56 1.74 0.08 -0.01 0.00 0.00 175.02 177.39 1ieb s VAL 1 N -0.41 3.14 0.37 -6.03 1.01 -1.26 -4.93 120.40 112.29 1ieb s VAL 1 Ca 0.13 0.40 -0.06 0.00 0.00 0.00 0.00 61.98 62.45 1ieb s VAL 1 Cb -0.12 -3.26 -0.05 0.00 0.00 0.00 0.00 36.38 32.95 1ieb s VAL 1 CO 0.03 -0.02 0.67 0.20 0.00 0.00 0.00 175.10 175.98 1ieb s ASN 2 N 3.16 6.41 0.03 3.32 0.01 -1.26 -5.11 114.94 121.50 1ieb s ASN 2 Ca 0.78 0.85 0.00 0.00 -0.71 0.00 0.00 52.86 53.78 1ieb s ASN 2 Cb -0.39 -2.21 -0.02 0.00 0.41 0.00 0.00 41.25 39.04 1ieb s ASN 2 CO 0.34 -0.35 -0.04 -1.38 -1.51 0.00 0.00 177.10 174.15 1ieb s HIS 3 N -2.35 0.40 -0.06 2.20 -3.43 -1.26 -4.94 115.29 105.85 1ieb s HIS 3 Ca 0.46 -0.60 -0.30 0.00 -0.80 0.00 0.00 55.06 53.83 1ieb s HIS 3 Cb -0.10 -0.27 -0.04 0.00 -1.43 0.00 0.00 32.58 30.74 1ieb s HIS 3 CO 0.34 -0.19 1.37 -0.06 -2.00 0.00 0.00 174.74 174.21 1ieb s PHE 4 N -1.80 2.77 0.20 0.38 0.40 -1.26 -4.99 117.98 113.68 1ieb s PHE 4 Ca -0.11 0.83 -0.30 0.00 -0.60 0.00 0.00 56.93 56.75 1ieb s PHE 4 Cb -0.07 -3.62 -0.08 0.00 0.51 0.00 0.00 43.02 39.75 1ieb s PHE 4 CO -0.02 -2.29 1.08 0.42 0.70 0.00 0.00 175.22 175.11 1ieb s ILE 5 N 2.90 3.84 0.48 0.64 1.01 -1.26 -5.03 121.20 123.78 1ieb s ILE 5 Ca 0.62 1.65 -0.09 0.00 0.00 0.00 0.00 60.65 62.83 1ieb s ILE 5 Cb -0.28 -4.05 -0.05 0.00 0.01 0.00 0.00 42.46 38.09 1ieb s ILE 5 CO 0.23 0.31 0.84 0.00 0.00 0.00 0.00 174.94 176.32 1ieb s ALA 6 N -0.47 3.30 0.00 9.38 0.00 -1.26 -5.09 121.76 127.63 1ieb s ALA 6 Ca 0.48 -0.27 0.04 0.00 0.00 0.00 0.00 51.96 52.21 1ieb s ALA 6 Cb -0.29 -2.76 -0.01 0.00 0.00 0.00 0.00 23.12 20.06 1ieb s ALA 6 CO 0.36 -0.27 -0.14 -1.21 0.00 0.00 0.00 175.76 174.49 1ieb s GLU 7 N -4.43 1.08 0.24 0.00 0.41 -1.26 -5.12 118.70 109.61 1ieb s GLU 7 Ca 0.51 -0.55 -0.30 0.00 -0.41 0.00 0.00 54.97 54.22 1ieb s GLU 7 Cb -0.10 -1.05 -0.09 0.00 -1.78 0.00 0.00 34.13 31.10 1ieb s GLU 7 CO 0.40 0.28 1.30 -0.06 -0.49 0.00 0.00 175.26 176.70 1ieb s PHE 8 N -0.44 3.22 0.12 1.61 0.40 -1.26 -4.99 117.98 116.64 1ieb s PHE 8 Ca 0.05 1.28 -0.24 0.00 -0.60 0.00 0.00 56.93 57.42 1ieb s PHE 8 Cb -0.06 -3.61 -0.07 0.00 0.51 0.00 0.00 43.02 39.79 1ieb s PHE 8 CO -0.00 -1.84 0.72 0.15 0.70 0.00 0.00 175.22 174.95 1ieb s LYS 9 N -0.57 4.46 -0.06 0.44 1.02 -1.26 -5.01 119.74 118.77 1ieb s LYS 9 Ca 0.54 1.03 -0.30 0.00 0.02 0.00 0.00 55.97 57.26 1ieb s LYS 9 Cb -0.37 -3.28 -0.03 0.00 -0.52 0.00 0.00 37.83 33.63 1ieb s LYS 9 CO 0.42 0.53 1.10 1.03 -0.92 0.00 0.00 175.35 177.50 1ieb s ARG 1 N -0.90 4.41 0.13 1.68 0.52 -1.26 -4.95 118.95 118.58 1ieb s ARG 1 Ca 0.34 1.54 -0.12 0.00 -0.52 0.00 0.00 55.73 56.97 1ieb s ARG 1 Cb -0.22 -3.52 0.11 0.00 0.52 0.00 0.00 34.95 31.84 1ieb s ARG 1 CO 0.24 -0.33 0.95 1.17 0.02 0.00 0.00 175.30 177.35 1ieb n LYS 2 N 4.87 -0.17 0.00 3.54 4.81 -1.26 -4.89 118.16 125.07 1ieb n LYS 2 Ca 0.09 0.94 0.00 0.00 -0.87 0.00 0.00 58.31 58.48 1ieb n LYS 2 Cb 0.48 -1.40 0.00 0.00 0.02 0.00 0.00 35.03 34.13 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 -1.27 0.23 0.00 3.14 0.00 -1.26 -4.88 105.19 101.15 1ieb n GLY 3 Ca 0.05 -0.89 0.00 0.00 0.00 0.00 0.00 46.02 45.18 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 0.62 3.62 -0.02 0.00 -1.26 -5.14 105.19 103.01 1ieb n GLY 4 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.62 -0.09 1.61 0.01 -1.26 -5.17 113.70 107.18 1ieb s SER 5 Ca 0.00 1.14 0.02 0.00 1.31 0.00 0.00 55.95 58.42 1ieb s SER 5 Cb 0.00 1.13 -0.02 0.00 0.21 0.00 0.00 66.02 67.34 1ieb s SER 5 CO 0.00 -0.25 -0.14 -0.76 0.41 0.00 0.00 173.24 172.50 1ieb s LEU 6 N 0.12 2.70 -0.11 2.44 1.43 -1.26 -5.07 118.68 118.93 1ieb s LEU 6 Ca 0.00 -0.27 -0.29 0.00 -1.03 0.00 0.00 54.13 52.54 1ieb s LEU 6 Cb -0.04 -1.58 -0.06 0.00 0.03 0.00 0.00 46.19 44.54 1ieb s LEU 6 CO -0.01 0.25 2.01 -0.69 0.23 0.00 0.00 176.35 178.15 1ieb s VAL 7 N -0.16 3.13 0.55 -1.59 1.01 -1.26 -4.92 120.40 117.15 1ieb s VAL 7 Ca -0.01 0.15 -0.20 0.00 0.00 0.00 0.00 61.98 61.92 1ieb s VAL 7 Cb -0.13 -3.13 -0.07 0.00 0.00 0.00 0.00 36.38 33.05 1ieb s VAL 7 CO 0.03 -0.05 0.93 -0.81 0.00 0.00 0.00 175.10 175.20 1ieb n PRO 8 N 8.07 0.99 -0.06 2.72 -0.04 -1.26 -5.00 135.00 140.42 1ieb n PRO 8 Ca 0.24 0.37 -0.02 0.00 -0.04 0.00 0.00 63.50 64.05 1ieb n PRO 8 Cb 0.43 -2.09 -0.01 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 0.75 0.00 0.00 0.54 -0.00 -2.08 -3.51 114.38 110.08 1ieb h ARG 9 Ca -0.47 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.01 1ieb h ARG 9 Cb 1.36 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.33 1ieb h ARG 9 CO 0.52 0.05 0.00 0.41 0.00 0.00 0.00 179.97 180.95 1ieb n GLY 10 N 1.73 -1.94 3.63 0.04 0.00 -1.26 -5.17 105.19 102.22 1ieb n GLY 10 Ca -0.03 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.71 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 -0.24 -0.75 0.35 1.61 1.04 -1.26 -5.17 113.70 109.27 1ieb s SER 11 Ca 0.00 1.42 -0.08 0.00 0.48 0.00 0.00 55.95 57.78 1ieb s SER 11 Cb 0.00 1.43 -0.06 0.00 0.10 0.00 0.00 66.02 67.50 1ieb s SER 11 CO 0.00 -0.24 0.66 -0.83 0.98 0.00 0.00 173.24 173.81 1ieb s GLY 12 N 0.46 1.90 0.00 7.32 0.00 -1.26 -5.07 107.32 110.67 1ieb s GLY 12 Ca -0.01 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.33 1ieb s GLY 12 CO -0.01 -0.24 0.00 0.61 0.00 0.00 0.00 173.10 173.46 1ieb n GLY 13 N -1.12 4.83 2.61 0.20 0.00 -1.26 -4.87 105.19 105.58 1ieb n GLY 13 Ca 0.00 -0.67 -0.10 0.00 0.00 0.00 0.00 46.02 45.25 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 0.00 -0.29 0.04 -0.02 0.00 -1.26 -4.15 105.19 99.52 1ieb n GLY 14 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.22 1.95 3.07 -0.02 0.00 -1.26 -5.11 105.19 102.59 1ieb n GLY 15 Ca -0.10 -0.02 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 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 -2.02 2.11 -0.12 1.61 0.01 -1.26 -5.14 113.70 108.89 1ieb s SER 16 Ca 0.00 -0.36 -0.11 0.00 1.31 0.00 0.00 55.95 56.79 1ieb s SER 16 Cb 0.00 -0.97 -0.05 0.00 0.21 0.00 0.00 66.02 65.21 1ieb s SER 16 CO 0.00 0.06 0.22 -0.60 0.41 0.00 0.00 173.24 173.33 1ieb s ARG 4 N 0.61 3.86 0.24 12.44 3.52 -1.26 -4.86 118.95 133.51 1ieb s ARG 4 Ca -0.15 0.01 -0.31 0.00 -0.13 0.00 0.00 55.73 55.15 1ieb s ARG 4 Cb -0.16 -3.29 -0.14 0.00 -1.56 0.00 0.00 34.95 29.80 1ieb s ARG 4 CO 0.05 0.55 1.32 -2.30 -0.81 0.00 0.00 175.30 174.11 1ieb n PRO 5 N 2.61 1.85 -4.00 5.12 -0.02 -1.26 -5.00 135.00 134.30 1ieb n PRO 5 Ca -0.16 0.66 -0.09 0.00 -2.02 0.00 0.00 63.50 61.89 1ieb n PRO 5 Cb 0.53 -2.26 -0.08 0.00 -0.02 0.00 0.00 33.50 31.67 1ieb n PRO 5 CO 0.00 0.00 0.00 1.67 1.98 0.00 0.00 175.50 179.15 1ieb s TRP 6 N -0.27 0.45 -0.07 6.00 1.48 -1.26 -5.17 118.94 120.10 1ieb s TRP 6 Ca 0.67 -0.89 -0.05 0.00 -1.06 0.00 0.00 56.10 54.77 1ieb s TRP 6 Cb -0.68 -0.23 0.03 0.00 -1.16 0.00 0.00 33.47 31.43 1ieb s TRP 6 CO 0.52 -0.54 0.19 -0.06 -4.06 0.00 0.00 176.95 173.00 1ieb s PHE 7 N -3.94 -0.22 -0.18 1.66 0.08 -1.26 -5.01 117.98 109.11 1ieb s PHE 7 Ca 0.12 0.54 -0.04 0.00 0.12 0.00 0.00 56.93 57.68 1ieb s PHE 7 Cb 0.06 0.03 0.08 0.00 -0.57 0.00 0.00 43.02 42.62 1ieb s PHE 7 CO -0.06 -0.14 0.20 -1.17 -0.10 0.00 0.00 175.22 173.96 1ieb s LEU 8 N 0.56 -0.07 -0.62 -0.37 2.96 -1.26 -4.97 118.68 114.90 1ieb s LEU 8 Ca -0.04 -0.13 -0.19 0.00 -0.22 0.00 0.00 54.13 53.55 1ieb s LEU 8 Cb -0.05 0.33 0.11 0.00 0.50 0.00 0.00 46.19 47.07 1ieb s LEU 8 CO -0.03 -0.31 0.75 -0.70 -1.32 0.00 0.00 176.35 174.74 1ieb s GLU 9 N 2.31 3.09 -0.04 1.98 2.56 -1.26 -1.57 118.70 125.77 1ieb s GLU 9 Ca 0.06 -1.33 0.05 0.00 0.00 0.00 0.00 54.97 53.74 1ieb s GLU 9 Cb -0.15 -4.30 -0.01 0.00 2.00 0.00 0.00 34.13 31.68 1ieb s GLU 9 CO -0.11 -1.57 -0.20 -0.47 -0.56 0.00 0.00 175.26 172.35 1ieb s TYR 10 N 2.73 1.94 0.01 5.30 5.04 -1.15 -5.04 117.35 126.17 1ieb s TYR 10 Ca 0.13 -0.52 0.00 0.00 -2.44 0.00 0.00 57.07 54.24 1ieb s TYR 10 Cb -0.22 -1.28 -0.01 0.00 0.35 0.00 0.00 41.96 40.80 1ieb s TYR 10 CO 0.05 -0.15 -0.02 0.00 -1.34 0.00 0.00 175.55 174.10 1ieb s LYS 12 N -0.72 1.68 -0.30 0.00 1.02 0.30 -4.96 119.74 116.76 1ieb s LYS 12 Ca -0.08 -1.47 -0.04 0.00 0.02 0.00 0.00 55.97 54.41 1ieb s LYS 12 Cb -0.05 -1.93 0.10 0.00 -0.52 0.00 0.00 37.83 35.44 1ieb s LYS 12 CO -0.00 0.40 0.14 -1.12 -0.92 0.00 0.00 175.35 173.85 1ieb s SER 13 N -2.77 3.44 -0.34 2.83 0.01 -1.26 0.11 113.70 115.72 1ieb s SER 13 Ca 0.22 -1.35 -0.18 0.00 1.31 0.00 0.00 55.95 55.95 1ieb s SER 13 Cb -0.08 -0.33 -0.01 0.00 0.21 0.00 0.00 66.02 65.82 1ieb s SER 13 CO 0.12 -0.43 0.51 -1.61 0.41 0.00 0.00 173.24 172.24 1ieb s GLU 14 N 2.02 3.66 -0.39 12.44 2.02 -0.51 -4.94 118.70 133.01 1ieb s GLU 14 Ca 0.10 -0.13 -0.19 0.00 0.02 0.00 0.00 54.97 54.77 1ieb s GLU 14 Cb -0.17 -3.79 0.01 0.00 0.10 0.00 0.00 34.13 30.28 1ieb s GLU 14 CO -0.34 -0.61 0.55 0.00 0.02 0.00 0.00 175.26 174.87 1ieb s HIS 16 N 2.49 3.23 -0.35 0.00 3.76 0.83 -4.95 115.29 120.30 1ieb s HIS 16 Ca 0.19 -0.81 -0.13 0.00 -0.15 0.00 0.00 55.06 54.16 1ieb s HIS 16 Cb -0.15 -2.43 -0.01 0.00 1.11 0.00 0.00 32.58 31.10 1ieb s HIS 16 CO 0.15 -0.58 0.25 -0.06 -0.85 0.00 0.00 174.74 173.65 1ieb s PHE 17 N 1.58 3.23 0.09 1.40 0.08 -1.26 -0.87 117.98 122.24 1ieb s PHE 17 Ca 0.03 -0.28 -0.05 0.00 0.12 0.00 0.00 56.93 56.76 1ieb s PHE 17 Cb -0.19 -2.50 -0.22 0.00 -0.57 0.00 0.00 43.02 39.55 1ieb s PHE 17 CO 0.07 -0.40 1.20 1.88 -0.10 0.00 0.00 175.22 177.86 1ieb h TYR 18 N 8.52 0.55 -1.10 0.36 0.05 -1.92 -3.43 116.97 120.00 1ieb h TYR 18 Ca -0.30 -0.37 -0.05 0.00 0.05 0.00 0.00 58.73 58.06 1ieb h TYR 18 Cb 1.15 -0.04 -0.21 0.00 1.01 0.00 0.00 36.73 38.64 1ieb h TYR 18 CO 0.64 1.24 -0.44 1.21 -1.05 0.00 0.00 178.16 179.76 1ieb s ASN 19 N -7.15 -1.29 0.98 3.88 2.47 -1.26 -5.07 114.94 107.51 1ieb s ASN 19 Ca -0.05 -0.45 0.00 0.00 0.42 0.00 0.00 52.86 52.79 1ieb s ASN 19 Cb 0.08 1.86 0.00 0.00 -1.45 0.00 0.00 41.25 41.73 1ieb s ASN 19 CO 0.88 -0.23 0.00 0.61 -3.72 0.00 0.00 177.10 174.64 1ieb n GLY 20 N 4.84 1.79 0.56 1.21 0.00 -1.26 -2.65 105.19 109.67 1ieb n GLY 20 Ca 0.08 -0.51 0.13 0.00 0.00 0.00 0.00 46.02 45.72 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 0.05 0.00 2.61 -2.24 -1.26 -4.54 114.28 108.90 1ieb n THR 21 Ca 0.00 -0.31 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1ieb n THR 21 Cb 0.00 0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.82 1ieb n THR 21 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ieb n GLN 22 N 0.35 0.00 -4.36 -0.78 1.13 -1.09 -4.56 117.38 108.08 1ieb n GLN 22 Ca 0.18 0.22 -0.34 0.00 -1.94 0.00 0.00 57.00 55.12 1ieb n GLN 22 Cb 0.38 -1.12 -0.13 0.00 0.11 0.00 0.00 30.24 29.48 1ieb n GLN 22 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 1ieb s ARG 23 N -1.47 3.50 0.01 -1.09 1.70 -1.26 -5.07 118.95 115.27 1ieb s ARG 23 Ca 0.00 -0.60 0.06 0.00 -0.47 0.00 0.00 55.73 54.72 1ieb s ARG 23 Cb 0.00 -2.87 -0.02 0.00 -0.57 0.00 0.00 34.95 31.50 1ieb s ARG 23 CO 0.00 0.09 -0.18 0.08 -1.08 0.00 0.00 175.30 174.21 1ieb s VAL 24 N 0.72 1.47 -0.15 4.99 1.01 -1.26 -2.69 120.40 124.49 1ieb s VAL 24 Ca -0.03 -0.95 0.01 0.00 0.00 0.00 0.00 61.98 61.01 1ieb s VAL 24 Cb -0.15 -1.26 0.02 0.00 0.00 0.00 0.00 36.38 34.99 1ieb s VAL 24 CO 0.02 0.28 -0.18 -0.60 0.00 0.00 0.00 175.10 174.62 1ieb s ARG 25 N -0.78 2.70 -0.10 2.72 3.52 -0.05 -4.94 118.95 122.02 1ieb s ARG 25 Ca 0.06 -0.72 -0.17 0.00 -0.13 0.00 0.00 55.73 54.77 1ieb s ARG 25 Cb -0.08 -2.33 -0.05 0.00 -1.56 0.00 0.00 34.95 30.94 1ieb s ARG 25 CO 0.00 -0.16 0.45 -1.17 -0.81 0.00 0.00 175.30 173.61 1ieb s LEU 26 N 1.22 4.31 -0.38 -0.88 2.96 -1.26 -0.12 118.68 124.53 1ieb s LEU 26 Ca 0.01 0.82 0.02 0.00 -0.22 0.00 0.00 54.13 54.75 1ieb s LEU 26 Cb -0.14 -2.65 0.15 0.00 0.50 0.00 0.00 46.19 44.05 1ieb s LEU 26 CO -0.09 0.07 0.26 -0.22 -1.32 0.00 0.00 176.35 175.04 1ieb s LEU 27 N 0.31 1.29 0.24 -0.68 2.96 -0.05 0.12 118.68 122.87 1ieb s LEU 27 Ca 0.25 -2.52 -0.30 0.00 -0.22 0.00 0.00 54.13 51.33 1ieb s LEU 27 Cb -0.15 -0.47 -0.09 0.00 0.50 0.00 0.00 46.19 45.98 1ieb s LEU 27 CO 0.10 -0.26 0.98 -0.69 -1.32 0.00 0.00 176.35 175.16 1ieb s VAL 28 N 0.66 3.97 -0.19 1.68 1.01 -0.41 -1.42 120.40 125.70 1ieb s VAL 28 Ca 0.23 1.95 -0.01 0.00 0.00 0.00 0.00 61.98 64.15 1ieb s VAL 28 Cb -0.14 -4.24 0.05 0.00 0.00 0.00 0.00 36.38 32.05 1ieb s VAL 28 CO -0.06 0.45 -0.01 -0.13 0.00 0.00 0.00 175.10 175.36 1ieb s ARG 29 N -1.14 1.04 -0.24 2.72 0.52 0.12 -0.97 118.95 120.99 1ieb s ARG 29 Ca 0.42 -0.54 -0.18 0.00 -0.52 0.00 0.00 55.73 54.90 1ieb s ARG 29 Cb -0.27 -2.14 -0.03 0.00 0.52 0.00 0.00 34.95 33.04 1ieb s ARG 29 CO 0.34 -0.57 0.53 0.71 0.02 0.00 0.00 175.30 176.33 1ieb s TYR 30 N 1.71 3.30 0.38 -0.53 1.51 -0.63 -0.54 117.35 122.54 1ieb s TYR 30 Ca -0.01 0.70 0.08 0.00 -1.01 0.00 0.00 57.07 56.82 1ieb s TYR 30 Cb -0.17 -2.72 -0.05 0.00 -0.11 0.00 0.00 41.96 38.91 1ieb s TYR 30 CO -0.07 -0.24 0.15 -0.06 -1.11 0.00 0.00 175.55 174.22 1ieb s PHE 31 N 2.15 2.64 -0.18 2.71 0.40 0.14 -0.94 117.98 124.90 1ieb s PHE 31 Ca 0.23 -0.48 -0.07 0.00 -0.60 0.00 0.00 56.93 56.00 1ieb s PHE 31 Cb -0.16 -1.79 0.08 0.00 0.51 0.00 0.00 43.02 41.67 1ieb s PHE 31 CO 0.09 0.27 0.40 -0.47 0.70 0.00 0.00 175.22 176.21 1ieb s TYR 32 N -2.52 -0.71 0.00 0.36 5.04 -0.81 -2.94 117.35 115.77 1ieb s TYR 32 Ca 0.39 1.41 0.00 0.00 -2.44 0.00 0.00 57.07 56.43 1ieb s TYR 32 Cb 0.01 0.26 0.00 0.00 0.35 0.00 0.00 41.96 42.58 1ieb s TYR 32 CO 0.22 -0.43 0.00 0.09 -1.34 0.00 0.00 175.55 174.09 1ieb n ASN 33 N 5.07 0.00 -0.31 4.32 4.13 -0.61 -1.72 115.26 126.14 1ieb n ASN 33 Ca -0.12 0.00 0.03 0.00 1.68 0.00 0.00 54.58 56.16 1ieb n ASN 33 Cb 0.51 0.00 0.07 0.00 -1.54 0.00 0.00 39.78 38.82 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 0.89 -3.72 3.41 4.77 -1.26 -4.92 117.00 116.17 1ieb n LEU 34 Ca 0.00 -0.45 -0.13 0.00 -0.03 0.00 0.00 56.01 55.40 1ieb n LEU 34 Cb 0.00 -0.12 -0.09 0.00 -2.33 0.00 0.00 43.42 40.87 1ieb n LEU 34 CO 0.00 0.22 0.13 -1.83 -1.33 0.00 0.00 177.39 174.57 1ieb s GLU 35 N -1.77 0.55 0.19 3.23 -1.05 -0.70 -5.12 118.70 114.03 1ieb s GLU 35 Ca 0.11 0.55 -0.31 0.00 -0.15 0.00 0.00 54.97 55.17 1ieb s GLU 35 Cb 0.06 0.26 -0.10 0.00 -0.44 0.00 0.00 34.13 33.92 1ieb s GLU 35 CO 0.07 -0.08 1.46 -2.00 0.95 0.00 0.00 175.26 175.66 1ieb s GLU 36 N 0.09 4.27 0.00 -4.83 2.12 -1.26 -1.93 118.70 117.16 1ieb s GLU 36 Ca -0.01 2.26 0.00 0.00 0.36 0.00 0.00 54.97 57.58 1ieb s GLU 36 Cb -0.03 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 31.20 1ieb s GLU 36 CO 0.01 -0.47 0.18 0.27 -0.54 0.00 0.00 175.26 174.71 1ieb n ASN 37 N 3.17 0.35 -3.47 -1.70 0.23 -0.12 -4.54 115.26 109.19 1ieb n ASN 37 Ca 0.10 -0.67 -0.12 0.00 -0.53 0.00 0.00 54.58 53.36 1ieb n ASN 37 Cb 0.40 0.44 -0.03 0.00 -2.08 0.00 0.00 39.78 38.51 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 -0.88 -0.52 0.19 -4.53 2.96 -1.14 -0.61 118.68 114.15 1ieb s LEU 38 Ca 0.00 0.13 -0.21 0.00 -0.22 0.00 0.00 54.13 53.82 1ieb s LEU 38 Cb 0.00 2.40 0.05 0.00 0.50 0.00 0.00 46.19 49.14 1ieb s LEU 38 CO 0.00 -0.79 0.60 0.00 -1.32 0.00 0.00 176.35 174.84 1ieb s ARG 39 N -3.06 1.39 -0.29 1.98 1.70 -0.62 -1.60 118.95 118.44 1ieb s ARG 39 Ca 0.00 -0.65 0.00 0.00 -0.47 0.00 0.00 55.73 54.61 1ieb s ARG 39 Cb -0.01 0.58 0.09 0.00 -0.57 0.00 0.00 34.95 35.04 1ieb s ARG 39 CO -0.08 -0.61 0.05 0.12 -1.08 0.00 0.00 175.30 173.71 1ieb s PHE 40 N -3.81 2.11 -0.26 5.89 2.19 -0.15 -1.27 117.98 122.68 1ieb s PHE 40 Ca 0.04 -1.85 -0.15 0.00 0.33 0.00 0.00 56.93 55.30 1ieb s PHE 40 Cb -0.02 -1.82 -0.04 0.00 -1.31 0.00 0.00 43.02 39.84 1ieb s PHE 40 CO -0.07 -0.84 0.38 0.34 1.83 0.00 0.00 175.22 176.86 1ieb s ASP 41 N 1.48 6.27 0.27 6.13 -1.08 -1.26 -1.28 116.67 127.19 1ieb s ASP 41 Ca 0.06 0.31 -0.01 0.00 -0.52 0.00 0.00 52.55 52.39 1ieb s ASP 41 Cb -0.18 -2.21 0.56 0.00 -1.46 0.00 0.00 42.92 39.63 1ieb s ASP 41 CO -0.17 -0.18 1.74 -1.28 0.52 0.00 0.00 175.17 175.81 1ieb h SER 42 N 8.10 0.44 -0.04 -0.34 0.87 0.54 0.19 113.55 123.31 1ieb h SER 42 Ca -0.32 0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.36 1ieb h SER 42 Cb 1.16 0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 63.17 1ieb h SER 42 CO 0.65 0.15 0.04 0.44 -0.53 0.00 0.00 176.83 177.58 1ieb h ASP 43 N 0.54 0.00 0.04 6.23 3.32 -1.93 -2.89 116.42 121.73 1ieb h ASP 43 Ca 0.48 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 57.27 1ieb h ASP 43 Cb 0.74 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.26 1ieb h ASP 43 CO -0.41 0.00 -1.40 0.58 -1.72 0.00 0.00 179.24 176.30 1ieb h VAL 44 N 0.00 0.89 0.00 -1.35 2.07 -1.10 -3.49 116.25 113.27 1ieb h VAL 44 Ca 0.02 -2.24 0.00 0.00 0.82 0.00 0.00 66.70 65.30 1ieb h VAL 44 Cb 0.09 2.36 0.00 0.00 -1.52 0.00 0.00 31.29 32.22 1ieb h VAL 44 CO -0.00 0.48 0.00 0.61 0.02 0.00 0.00 177.57 178.68 1ieb n GLY 45 N 1.59 2.51 3.21 2.17 0.00 -0.36 -5.07 105.19 109.24 1ieb n GLY 45 Ca -0.31 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.57 1.12 0.79 1.61 2.02 -1.26 -5.00 118.70 117.40 1ieb s GLU 46 Ca 0.00 -1.56 -0.11 0.00 0.02 0.00 0.00 54.97 53.32 1ieb s GLU 46 Cb 0.00 0.06 0.07 0.00 0.10 0.00 0.00 34.13 34.36 1ieb s GLU 46 CO 0.00 -0.27 1.11 -0.06 0.02 0.00 0.00 175.26 176.06 1ieb s PHE 47 N -3.94 2.32 -0.03 1.61 0.40 -1.26 -4.23 117.98 112.84 1ieb s PHE 47 Ca 0.30 1.62 -0.03 0.00 -0.60 0.00 0.00 56.93 58.21 1ieb s PHE 47 Cb 0.07 -3.16 0.01 0.00 0.51 0.00 0.00 43.02 40.45 1ieb s PHE 47 CO 0.07 -2.08 0.09 1.03 0.70 0.00 0.00 175.22 175.03 1ieb s ARG 48 N -4.67 0.14 0.21 0.44 1.81 -0.40 -4.97 118.95 111.51 1ieb s ARG 48 Ca 0.64 0.08 -0.30 0.00 -1.72 0.00 0.00 55.73 54.43 1ieb s ARG 48 Cb -0.20 0.07 -0.08 0.00 -0.45 0.00 0.00 34.95 34.29 1ieb s ARG 48 CO 0.54 -0.02 1.07 0.00 -0.68 0.00 0.00 175.30 176.21 1ieb s ALA 49 N -0.09 3.37 -0.04 2.13 0.00 -1.26 -1.59 121.76 124.27 1ieb s ALA 49 Ca -0.01 0.79 0.19 0.00 0.00 0.00 0.00 51.96 52.93 1ieb s ALA 49 Cb -0.01 -3.32 -0.29 0.00 0.00 0.00 0.00 23.12 19.49 1ieb s ALA 49 CO 0.00 -0.13 0.39 0.28 0.00 0.00 0.00 175.76 176.30 1ieb n VAL 50 N 2.01 0.13 -3.99 0.00 0.31 0.22 -4.86 118.33 112.14 1ieb n VAL 50 Ca 0.01 -0.48 -0.09 0.00 -0.01 0.00 0.00 64.34 63.77 1ieb n VAL 50 Cb 0.46 -0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.33 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 -3.25 0.01 0.44 2.52 -4.23 -0.81 -4.90 115.64 105.42 1ieb s THR 51 Ca -0.07 -1.40 0.11 0.00 -1.18 0.00 0.00 61.69 59.15 1ieb s THR 51 Cb 0.12 -2.12 0.23 0.00 1.34 0.00 0.00 72.50 72.07 1ieb s THR 51 CO 0.80 -0.06 2.04 -0.33 -0.54 0.00 0.00 174.62 176.53 1ieb h GLU 52 N 2.33 0.23 -0.39 3.99 4.39 -1.94 -2.80 114.58 120.39 1ieb h GLU 52 Ca -0.28 -0.03 0.09 0.00 0.34 0.00 0.00 59.36 59.49 1ieb h GLU 52 Cb 1.25 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 29.83 1ieb h GLU 52 CO 0.39 0.24 0.27 1.25 -1.16 0.00 0.00 179.01 180.00 1ieb h LEU 53 N 0.23 0.10 -0.39 1.33 5.85 -1.98 -2.07 115.31 118.38 1ieb h LEU 53 Ca 0.06 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.78 1ieb h LEU 53 Cb 0.13 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.14 1ieb h LEU 53 CO -0.00 0.06 -0.55 0.61 -0.34 0.00 0.00 178.44 178.22 1ieb n GLY 54 N -1.58 -0.69 0.37 3.75 0.00 -1.06 -4.46 105.19 101.52 1ieb n GLY 54 Ca 0.06 -0.50 -0.01 0.00 0.00 0.00 0.00 46.02 45.57 1ieb n GLY 54 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 1ieb h ARG 55 N 0.95 1.26 -0.00 1.61 2.43 -1.43 -1.24 114.38 117.96 1ieb h ARG 55 Ca 0.00 -0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1ieb h ARG 55 Cb 0.57 -0.28 -0.00 0.00 -0.42 0.00 0.00 29.97 29.83 1ieb h ARG 55 CO 0.00 0.84 0.00 -1.35 -1.51 0.00 0.00 179.97 177.95 1ieb h PRO 56 N 1.30 0.00 0.01 0.20 0.11 -1.78 -0.71 132.00 131.13 1ieb h PRO 56 Ca 0.36 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.47 1ieb h PRO 56 Cb -0.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 30.99 1ieb h PRO 56 CO -0.09 0.00 -0.01 -0.44 -0.21 0.00 0.00 178.00 177.26 1ieb h ASP 57 N 0.00 -0.01 -0.71 -2.05 3.32 -1.56 -2.51 116.42 112.90 1ieb h ASP 57 Ca 0.00 -0.38 0.12 0.00 0.02 0.00 0.00 57.03 56.79 1ieb h ASP 57 Cb 0.00 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 39.43 1ieb h ASP 57 CO -0.00 0.67 -0.35 0.00 -1.72 0.00 0.00 179.24 177.85 1ieb h ALA 58 N -0.61 0.03 -0.15 3.45 0.00 -0.83 0.81 119.26 121.96 1ieb h ALA 58 Ca -0.00 0.20 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 1ieb h ALA 58 Cb 0.39 0.84 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1ieb h ALA 58 CO 0.00 -0.65 -0.07 0.93 0.00 0.00 0.00 179.25 179.46 1ieb h GLU 59 N -0.11 0.22 0.10 0.00 5.08 -1.27 0.30 114.58 118.89 1ieb h GLU 59 Ca 0.27 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1ieb h GLU 59 Cb 0.56 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1ieb h GLU 59 CO -0.77 0.31 -0.05 -0.97 -1.00 0.00 0.00 179.01 176.53 1ieb h ASN 60 N 0.22 -0.11 -0.86 1.42 -1.24 0.79 -3.11 115.58 112.69 1ieb h ASN 60 Ca 0.05 0.00 0.19 0.00 0.71 0.00 0.00 56.30 57.25 1ieb h ASN 60 Cb 0.27 0.03 -0.11 0.00 0.73 0.00 0.00 38.32 39.24 1ieb h ASN 60 CO 0.01 0.15 0.38 -0.50 -1.29 0.00 0.00 177.43 176.18 1ieb h TRP 61 N -0.58 0.65 0.00 0.67 6.55 0.10 0.37 115.95 123.71 1ieb h TRP 61 Ca -0.01 0.04 0.00 0.00 0.95 0.00 0.00 58.89 59.87 1ieb h TRP 61 Cb 0.10 -0.15 0.00 0.00 -0.86 0.00 0.00 29.16 28.25 1ieb h TRP 61 CO 0.02 0.03 0.00 -0.91 -1.05 0.00 0.00 178.44 176.53 1ieb h ASN 62 N 0.46 0.00 0.50 -3.49 2.35 -0.52 -1.51 115.58 113.38 1ieb h ASN 62 Ca 0.51 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.26 1ieb h ASN 62 Cb 0.87 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.24 1ieb h ASN 62 CO -0.47 0.00 -0.85 -1.54 -1.65 0.00 0.00 177.43 172.92 1ieb n SER 63 N -2.84 0.63 -4.41 5.81 3.41 0.13 -4.62 113.62 111.73 1ieb n SER 63 Ca -0.01 -0.20 -0.44 0.00 -0.26 0.00 0.00 58.87 57.95 1ieb n SER 63 Cb 0.14 0.58 -0.04 0.00 -0.26 0.00 0.00 64.21 64.63 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 -3.14 3.24 0.34 4.33 -0.21 -0.57 -4.89 119.66 118.76 1ieb s GLN 64 Ca 0.06 -1.36 0.02 0.00 0.02 0.00 0.00 55.36 54.10 1ieb s GLN 64 Cb 0.15 -4.43 0.60 0.00 1.00 0.00 0.00 33.01 30.33 1ieb s GLN 64 CO 0.77 -1.67 1.97 -1.00 -2.12 0.00 0.00 175.29 173.24 1ieb h PRO 65 N 9.13 0.79 -0.95 2.91 0.13 -1.81 -2.00 132.00 140.19 1ieb h PRO 65 Ca -0.15 -0.08 0.10 0.00 -0.87 0.00 0.00 66.00 65.00 1ieb h PRO 65 Cb 1.06 -0.16 -0.07 0.00 0.13 0.00 0.00 31.00 31.96 1ieb h PRO 65 CO 1.11 0.58 0.61 0.93 -0.23 0.00 0.00 178.00 180.99 1ieb h GLU 66 N 0.80 0.95 -0.05 0.86 4.39 -1.94 -2.52 114.58 117.07 1ieb h GLU 66 Ca 0.21 -0.06 -0.02 0.00 0.34 0.00 0.00 59.36 59.83 1ieb h GLU 66 Cb 0.01 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 28.44 1ieb h GLU 66 CO -0.04 0.63 -0.04 0.35 -1.16 0.00 0.00 179.01 178.75 1ieb h PHE 67 N 0.98 0.14 -0.46 4.33 3.57 -1.69 -2.91 116.94 120.90 1ieb h PHE 67 Ca 0.45 -0.04 0.13 0.00 3.53 0.00 0.00 57.97 62.04 1ieb h PHE 67 Cb 0.40 -0.03 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 1ieb h PHE 67 CO -0.00 0.56 0.34 -0.07 -2.23 0.00 0.00 178.31 176.91 1ieb h LEU 68 N -0.33 0.00 -0.10 0.59 4.07 -1.23 0.80 115.31 119.12 1ieb h LEU 68 Ca 0.01 0.00 -0.22 0.00 0.08 0.00 0.00 57.88 57.75 1ieb h LEU 68 Cb 0.54 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.26 1ieb h LEU 68 CO 0.01 0.00 -1.00 -0.08 -1.08 0.00 0.00 178.44 176.29 1ieb h GLU 69 N 0.00 0.15 0.62 1.13 4.57 -1.45 -2.45 114.58 117.14 1ieb h GLU 69 Ca 0.22 -0.20 -0.03 0.00 -1.18 0.00 0.00 59.36 58.16 1ieb h GLU 69 Cb 0.89 0.07 0.01 0.00 -0.16 0.00 0.00 28.75 29.56 1ieb h GLU 69 CO -0.00 1.03 -0.30 0.37 -1.18 0.00 0.00 179.01 178.93 1ieb h GLN 70 N 0.06 -0.80 -0.90 1.92 4.15 -0.67 0.38 115.11 119.25 1ieb h GLN 70 Ca -0.06 0.05 0.11 0.00 0.77 0.00 0.00 58.65 59.53 1ieb h GLN 70 Cb 1.70 0.18 -0.08 0.00 0.21 0.00 0.00 27.48 29.49 1ieb h GLN 70 CO 0.15 -0.51 0.53 0.87 -1.93 0.00 0.00 178.83 177.94 1ieb h LYS 71 N -0.88 0.84 -0.96 1.69 1.79 -1.44 0.21 116.57 117.82 1ieb h LYS 71 Ca -0.08 -0.05 0.05 0.00 -2.18 0.00 0.00 60.65 58.38 1ieb h LYS 71 Cb 0.65 -0.19 -0.06 0.00 -1.58 0.00 0.00 32.23 31.06 1ieb h LYS 71 CO 0.14 0.56 0.62 -0.09 -1.08 0.00 0.00 179.45 179.60 1ieb h ARG 72 N 0.87 1.13 0.00 3.15 2.43 -0.92 -2.40 114.38 118.64 1ieb h ARG 72 Ca 0.44 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.54 1ieb h ARG 72 Cb 0.42 -0.26 -0.00 0.00 -0.42 0.00 0.00 29.97 29.72 1ieb h ARG 72 CO -0.26 0.75 -0.02 0.00 -1.51 0.00 0.00 179.97 178.93 1ieb h ALA 73 N 1.46 0.99 0.00 2.80 0.00 0.28 -3.29 119.26 121.50 1ieb h ALA 73 Ca 0.39 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.24 1ieb h ALA 73 Cb 0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1ieb h ALA 73 CO -0.13 0.02 -0.20 0.93 0.00 0.00 0.00 179.25 179.87 1ieb h GLU 74 N 0.00 0.00 -0.21 0.00 5.08 -0.65 -0.68 114.58 118.12 1ieb h GLU 74 Ca -0.00 0.00 0.06 0.00 -1.00 0.00 0.00 59.36 58.42 1ieb h GLU 74 Cb 0.98 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.22 1ieb h GLU 74 CO 0.00 0.20 0.20 0.28 -1.00 0.00 0.00 179.01 178.69 1ieb h VAL 75 N 0.00 0.55 0.00 3.13 2.07 -1.66 0.77 116.25 121.12 1ieb h VAL 75 Ca -0.00 0.00 -0.29 0.00 0.82 0.00 0.00 66.70 67.23 1ieb h VAL 75 Cb 0.57 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 31.14 1ieb h VAL 75 CO 0.03 0.00 -1.95 0.47 0.02 0.00 0.00 177.57 176.14 1ieb n ASP 76 N -3.94 1.95 0.00 0.57 8.00 -0.68 -2.04 116.55 120.40 1ieb n ASP 76 Ca 0.02 0.34 0.06 0.00 0.71 0.00 0.00 54.79 55.93 1ieb n ASP 76 Cb 0.34 -0.80 0.33 0.00 -0.02 0.00 0.00 41.12 40.97 1ieb n ASP 76 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1ieb n THR 77 N -4.33 0.57 0.06 -3.53 -2.24 -0.35 -2.01 114.28 102.44 1ieb n THR 77 Ca -0.39 0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 1ieb n THR 77 Cb 0.75 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1ieb n THR 77 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1ieb n VAL 78 N -1.25 0.20 0.12 2.28 0.31 0.21 -4.60 118.33 115.59 1ieb n VAL 78 Ca 0.07 0.06 -0.15 0.00 -0.01 0.00 0.00 64.34 64.31 1ieb n VAL 78 Cb 0.09 -0.58 -0.08 0.00 -0.91 0.00 0.00 33.84 32.36 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 -0.67 0.04 -0.69 0.00 3.08 -1.50 -1.85 114.38 112.79 1ieb h ARG 80 Ca 0.02 -0.02 0.15 0.00 0.07 0.00 0.00 59.98 60.19 1ieb h ARG 80 Cb 0.70 -0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.62 1ieb h ARG 80 CO -0.25 0.49 -0.07 1.25 -1.07 0.00 0.00 179.97 180.32 1ieb h HIS 81 N -0.40 -0.17 -0.08 3.04 2.76 -1.26 -2.14 115.15 116.90 1ieb h HIS 81 Ca 0.00 0.06 -0.14 0.00 -2.20 0.00 0.00 60.37 58.09 1ieb h HIS 81 Cb 0.48 0.18 0.01 0.00 1.55 0.00 0.00 27.41 29.63 1ieb h HIS 81 CO 0.08 -0.25 -0.51 -0.91 -1.30 0.00 0.00 177.93 175.05 1ieb h ASN 82 N 0.06 0.58 -0.62 3.26 2.35 -0.96 -3.25 115.58 117.01 1ieb h ASN 82 Ca 0.36 -0.66 0.13 0.00 -0.55 0.00 0.00 56.30 55.57 1ieb h ASN 82 Cb 0.59 -0.17 -0.10 0.00 0.05 0.00 0.00 38.32 38.69 1ieb h ASN 82 CO -0.65 1.16 0.05 0.22 -1.65 0.00 0.00 177.43 176.56 1ieb h TYR 83 N 0.05 0.05 -0.70 1.19 5.03 -0.72 0.33 116.97 122.20 1ieb h TYR 83 Ca -0.04 0.04 0.15 0.00 2.58 0.00 0.00 58.73 61.46 1ieb h TYR 83 Cb 1.16 0.07 -0.10 0.00 1.55 0.00 0.00 36.73 39.41 1ieb h TYR 83 CO 0.12 -0.12 0.16 1.49 -1.32 0.00 0.00 178.16 178.49 1ieb h GLU 84 N 0.17 0.25 0.46 1.82 4.57 -1.48 0.93 114.58 121.31 1ieb h GLU 84 Ca 0.33 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.47 1ieb h GLU 84 Cb 0.52 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1ieb h GLU 84 CO -0.49 0.17 -0.22 0.82 -1.18 0.00 0.00 179.01 178.11 1ieb h ILE 85 N 0.26 0.51 0.00 2.32 2.04 -0.57 -2.04 117.51 120.03 1ieb h ILE 85 Ca 0.39 -0.28 0.00 0.00 1.00 0.00 0.00 64.86 65.97 1ieb h ILE 85 Cb 0.64 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1ieb h ILE 85 CO -0.49 0.05 0.00 0.49 0.00 0.00 0.00 178.15 178.20 1ieb n PHE 86 N -5.29 0.00 0.98 1.37 3.72 0.76 -1.20 117.46 117.79 1ieb n PHE 86 Ca -0.11 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.41 1ieb n PHE 86 Cb 0.29 -0.46 0.57 0.00 -0.94 0.00 0.00 39.48 38.94 1ieb n PHE 86 CO 0.00 0.00 0.00 -3.47 -0.05 0.00 0.00 176.76 173.24 1ieb n ASP 87 N -1.46 0.00 0.00 4.37 2.03 0.31 -1.21 116.55 120.59 1ieb n ASP 87 Ca 0.02 0.30 0.11 0.00 0.52 0.00 0.00 54.79 55.74 1ieb n ASP 87 Cb 0.10 -0.42 -0.03 0.00 -0.72 0.00 0.00 41.12 40.04 1ieb n ASP 87 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1ieb n ASN 88 N -1.42 0.81 0.00 1.67 3.02 -0.34 -4.43 115.26 114.56 1ieb n ASN 88 Ca 0.08 -0.72 0.00 0.00 -0.03 0.00 0.00 54.58 53.91 1ieb n ASN 88 Cb 0.26 0.87 0.00 0.00 -0.61 0.00 0.00 39.78 40.29 1ieb n ASN 88 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 1ieb n PHE 89 N -1.58 -0.08 0.15 3.10 -1.74 -1.19 -4.91 117.46 111.22 1ieb n PHE 89 Ca 0.04 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.86 1ieb n PHE 89 Cb 0.35 0.20 -0.03 0.00 1.52 0.00 0.00 39.48 41.52 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 -0.38 -0.26 5.98 3.38 -1.62 -2.94 115.31 119.46 1ieb h LEU 90 Ca 0.00 0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.04 1ieb h LEU 90 Cb 0.00 0.10 -0.08 0.00 0.09 0.00 0.00 40.66 40.77 1ieb h LEU 90 CO 0.00 -0.05 -0.43 0.58 0.09 0.00 0.00 178.44 178.63 1ieb h VAL 91 N -0.89 0.13 0.00 1.22 2.07 -1.41 -1.01 116.25 116.35 1ieb h VAL 91 Ca -0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.47 1ieb h VAL 91 Cb 0.34 0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.24 1ieb h VAL 91 CO 0.07 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.21 1ieb h PRO 92 N -0.41 0.00 -6.03 1.57 0.13 -1.77 -3.46 132.00 122.02 1ieb h PRO 92 Ca 0.10 0.00 -0.80 0.00 -0.87 0.00 0.00 66.00 64.43 1ieb h PRO 92 Cb 0.61 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.77 1ieb h PRO 92 CO -0.48 0.00 0.32 -2.13 -0.23 0.00 0.00 178.00 175.47 1ieb n ARG 93 N -2.38 0.15 -4.07 0.86 0.63 -0.39 -4.96 116.66 106.50 1ieb n ARG 93 Ca 0.01 0.05 -0.12 0.00 -0.92 0.00 0.00 57.85 56.87 1ieb n ARG 93 Cb 0.18 -1.57 -0.11 0.00 0.45 0.00 0.00 32.46 31.41 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 1.09 0.54 -0.28 -0.14 1.81 -1.26 -4.23 118.95 116.47 1ieb s ARG 94 Ca 0.95 -0.80 -0.01 0.00 -1.72 0.00 0.00 55.73 54.15 1ieb s ARG 94 Cb -1.30 -0.25 0.17 0.00 -0.45 0.00 0.00 34.95 33.11 1ieb s ARG 94 CO 0.64 0.04 0.52 0.08 -0.68 0.00 0.00 175.30 175.90 1ieb s VAL 95 N -1.59 -0.86 0.50 3.52 1.01 -0.38 -4.92 120.40 117.68 1ieb s VAL 95 Ca -0.08 -0.03 -0.23 0.00 0.00 0.00 0.00 61.98 61.63 1ieb s VAL 95 Cb -0.09 -0.94 -0.06 0.00 0.00 0.00 0.00 36.38 35.29 1ieb s VAL 95 CO -0.00 -0.05 1.39 -1.61 0.00 0.00 0.00 175.10 174.82 1ieb s GLU 96 N 2.74 3.42 -0.23 2.72 2.02 -1.26 -2.17 118.70 125.94 1ieb s GLU 96 Ca 0.17 2.31 -0.27 0.00 0.02 0.00 0.00 54.97 57.21 1ieb s GLU 96 Cb -0.15 -2.45 0.00 0.00 0.10 0.00 0.00 34.13 31.63 1ieb s GLU 96 CO -0.20 -0.99 0.93 -1.25 0.02 0.00 0.00 175.26 173.77 1ieb s PRO 97 N -2.68 4.23 -0.47 0.39 0.04 -1.26 -4.45 135.00 130.80 1ieb s PRO 97 Ca 0.66 1.15 -0.28 0.00 0.04 0.00 0.00 61.00 62.57 1ieb s PRO 97 Cb -0.42 -3.64 -0.01 0.00 0.04 0.00 0.00 34.50 30.48 1ieb s PRO 97 CO 0.51 -0.55 1.71 0.99 0.04 0.00 0.00 177.00 179.70 1ieb s THR 98 N 2.94 3.54 -0.13 1.26 2.01 -0.45 -4.79 115.64 120.03 1ieb s THR 98 Ca 0.40 0.48 -0.18 0.00 0.31 0.00 0.00 61.69 62.70 1ieb s THR 98 Cb -0.15 -3.93 -0.04 0.00 0.01 0.00 0.00 72.50 68.38 1ieb s THR 98 CO 0.07 -0.73 0.47 -0.69 -0.69 0.00 0.00 174.62 173.05 1ieb s VAL 99 N 7.28 5.19 0.04 3.82 1.01 -1.26 -1.36 120.40 135.11 1ieb s VAL 99 Ca 0.69 0.94 0.04 0.00 0.00 0.00 0.00 61.98 63.65 1ieb s VAL 99 Cb -0.16 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1ieb s VAL 99 CO 0.28 0.32 -0.11 -0.89 0.00 0.00 0.00 175.10 174.69 1ieb s THR 100 N 0.70 0.86 0.07 3.92 2.01 -0.39 -4.99 115.64 117.83 1ieb s THR 100 Ca 0.25 -0.94 0.05 0.00 0.31 0.00 0.00 61.69 61.36 1ieb s THR 100 Cb -0.15 -0.81 -0.03 0.00 0.01 0.00 0.00 72.50 71.52 1ieb s THR 100 CO 0.10 -0.11 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.10 1ieb s VAL 101 N -0.93 1.10 0.00 3.82 1.01 -1.26 0.17 120.40 124.31 1ieb s VAL 101 Ca -0.02 -1.34 0.00 0.00 0.00 0.00 0.00 61.98 60.62 1ieb s VAL 101 Cb -0.08 -1.10 0.00 0.00 0.00 0.00 0.00 36.38 35.20 1ieb s VAL 101 CO 0.01 -0.26 0.00 0.00 0.00 0.00 0.00 175.10 174.85 1ieb n TYR 102 N 1.20 0.00 -2.48 5.22 4.11 -0.32 -4.99 117.16 119.91 1ieb n TYR 102 Ca -0.21 0.00 -0.25 0.00 -0.00 0.00 0.00 57.90 57.44 1ieb n TYR 102 Cb 0.54 0.00 0.03 0.00 -0.00 0.00 0.00 39.34 39.92 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 2.78 -0.42 -3.48 0.04 -1.26 0.62 135.00 131.29 1ieb s PRO 103 Ca 0.00 -0.20 0.05 0.00 0.04 0.00 0.00 61.00 60.89 1ieb s PRO 103 Cb 0.00 -2.32 0.55 0.00 0.04 0.00 0.00 34.50 32.77 1ieb s PRO 103 CO 0.00 -0.72 1.71 0.25 0.04 0.00 0.00 177.00 178.28 1ieb n THR 104 N -2.54 2.99 -1.57 1.26 -2.24 -0.94 -4.82 114.28 106.42 1ieb n THR 104 Ca 0.05 -2.61 -0.56 0.00 -2.27 0.00 0.00 64.05 58.66 1ieb n THR 104 Cb 0.58 -0.59 -0.08 0.00 -2.10 0.00 0.00 70.33 68.14 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 -1.07 0.93 0.00 -0.78 0.00 -1.26 -4.78 118.16 111.20 1ieb n LYS 105 Ca 0.49 0.31 0.00 0.00 0.00 0.00 0.00 58.31 59.11 1ieb n LYS 105 Cb 1.20 -2.11 0.00 0.00 0.00 0.00 0.00 35.03 34.12 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 5.66 0.00 0.00 3.15 -2.24 -1.26 -5.05 114.28 114.54 1ieb n THR 106 Ca 0.35 0.23 0.00 0.00 -2.27 0.00 0.00 64.05 62.36 1ieb n THR 106 Cb 0.13 -0.94 0.00 0.00 -2.10 0.00 0.00 70.33 67.41 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 -1.56 0.00 0.00 -0.78 0.00 -1.26 -5.08 117.38 108.71 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 0.00 0.00 0.00 2.61 -0.04 -1.26 -4.98 135.00 131.33 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 -4.67 117.00 116.92 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 -1.84 -1.22 0.00 0.00 177.39 174.33 1ieb n GLU 110 N 0.00 0.00 -0.30 3.23 0.00 -1.26 -4.63 120.64 117.68 1ieb n GLU 110 Ca 0.00 0.00 0.28 0.00 0.00 0.00 0.00 57.16 57.44 1ieb n GLU 110 Cb 0.00 -0.11 0.62 0.00 0.00 0.00 0.00 31.44 31.95 1ieb n GLU 110 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 177.13 178.25 1ieb h HIS 111 N 0.00 0.33 -0.77 -1.84 -0.00 -2.00 -3.46 115.15 107.41 1ieb h HIS 111 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.38 1ieb h HIS 111 Cb 0.00 -0.10 0.00 0.00 -0.00 0.00 0.00 27.41 27.31 1ieb h HIS 111 CO 0.00 0.03 0.00 1.58 -0.00 0.00 0.00 177.93 179.54 1ieb n HIS 112 N -4.42 0.00 -1.58 6.12 -0.00 -1.26 -4.81 115.22 109.26 1ieb n HIS 112 Ca 0.24 0.00 -0.48 0.00 -0.00 0.00 0.00 57.72 57.48 1ieb n HIS 112 Cb 1.01 -0.53 -0.05 0.00 -0.00 0.00 0.00 29.99 30.42 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 2.93 -4.69 0.26 3.02 -1.26 -4.34 115.26 111.18 1ieb n ASN 113 Ca 0.00 0.60 -0.43 0.00 -0.03 0.00 0.00 54.58 54.71 1ieb n ASN 113 Cb 0.00 -1.37 -0.02 0.00 -0.61 0.00 0.00 39.78 37.78 1ieb n ASN 113 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ieb n LEU 114 N 8.93 3.40 -4.65 3.41 -0.00 -1.26 -4.26 117.00 122.57 1ieb n LEU 114 Ca 0.31 1.17 -0.43 0.00 -0.00 0.00 0.00 56.01 57.06 1ieb n LEU 114 Cb 0.30 -1.47 -0.02 0.00 -0.00 0.00 0.00 43.42 42.24 1ieb n LEU 114 CO 0.73 -0.44 1.07 -0.22 -0.00 0.00 0.00 177.39 178.53 1ieb s LEU 115 N -0.43 4.03 -0.06 1.47 1.98 -0.28 -2.22 118.68 123.17 1ieb s LEU 115 Ca 0.62 1.40 -0.15 0.00 -2.89 0.00 0.00 54.13 53.11 1ieb s LEU 115 Cb -0.60 -3.54 -0.05 0.00 0.66 0.00 0.00 46.19 42.66 1ieb s LEU 115 CO 0.55 -0.89 0.39 -0.69 -1.89 0.00 0.00 176.35 173.82 1ieb s VAL 116 N 3.82 5.13 -0.37 1.68 1.01 0.20 -1.10 120.40 130.77 1ieb s VAL 116 Ca 0.53 0.78 0.03 0.00 0.00 0.00 0.00 61.98 63.32 1ieb s VAL 116 Cb -0.18 -3.70 0.11 0.00 0.00 0.00 0.00 36.38 32.61 1ieb s VAL 116 CO 0.17 0.50 0.11 0.00 0.00 0.00 0.00 175.10 175.87 1ieb s SER 118 N 0.86 6.18 -0.41 0.00 0.15 0.13 -1.73 113.70 118.87 1ieb s SER 118 Ca 0.12 -0.54 -0.13 0.00 0.70 0.00 0.00 55.95 56.10 1ieb s SER 118 Cb -0.20 -2.21 0.04 0.00 -1.71 0.00 0.00 66.02 61.94 1ieb s SER 118 CO -0.10 -0.49 0.29 -0.69 1.20 0.00 0.00 173.24 173.45 1ieb s VAL 119 N 2.06 4.88 0.54 4.45 1.01 -0.83 -1.26 120.40 131.25 1ieb s VAL 119 Ca 0.11 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.20 1ieb s VAL 119 Cb -0.17 -3.81 0.02 0.00 0.00 0.00 0.00 36.38 32.43 1ieb s VAL 119 CO 0.13 -0.38 0.26 -0.94 0.00 0.00 0.00 175.10 174.17 1ieb s SER 120 N 1.91 4.44 -0.88 3.32 1.04 -0.47 -1.61 113.70 121.46 1ieb s SER 120 Ca 0.03 -1.42 -0.16 0.00 0.48 0.00 0.00 55.95 54.88 1ieb s SER 120 Cb -0.21 0.52 0.02 0.00 0.10 0.00 0.00 66.02 66.46 1ieb s SER 120 CO 0.07 -1.04 0.55 -0.67 0.98 0.00 0.00 173.24 173.12 1ieb n ASP 121 N -1.60 -3.76 -4.08 7.02 2.03 -0.76 -1.34 116.55 114.06 1ieb n ASP 121 Ca -0.09 -0.99 -0.15 0.00 0.52 0.00 0.00 54.79 54.08 1ieb n ASP 121 Cb 0.65 -1.35 -0.12 0.00 -0.72 0.00 0.00 41.12 39.58 1ieb n ASP 121 CO 0.00 0.00 0.00 0.72 -1.92 0.00 0.00 177.20 176.00 1ieb s PHE 122 N -3.32 0.80 -0.20 -0.67 -0.71 -0.88 -4.13 117.98 108.87 1ieb s PHE 122 Ca 0.22 -0.46 -0.20 0.00 -1.04 0.00 0.00 56.93 55.46 1ieb s PHE 122 Cb -0.13 -0.47 0.05 0.00 -1.21 0.00 0.00 43.02 41.27 1ieb s PHE 122 CO 0.80 -0.04 0.56 -0.47 -1.34 0.00 0.00 175.22 174.73 1ieb s TYR 123 N -1.24 -0.61 1.30 3.49 6.14 -0.92 -0.88 117.35 124.63 1ieb s TYR 123 Ca -0.07 1.47 -0.22 0.00 0.64 0.00 0.00 57.07 58.89 1ieb s TYR 123 Cb -0.09 0.21 0.33 0.00 0.42 0.00 0.00 41.96 42.83 1ieb s TYR 123 CO 0.01 -0.30 0.86 -0.35 0.64 0.00 0.00 175.55 176.40 1ieb n PRO 124 N 2.71 -4.24 0.08 4.97 -0.04 -1.26 -1.24 135.00 135.98 1ieb n PRO 124 Ca -0.14 -1.42 -0.09 0.00 -0.04 0.00 0.00 63.50 61.81 1ieb n PRO 124 Cb 0.56 -1.69 -0.05 0.00 -0.04 0.00 0.00 33.50 32.28 1ieb n PRO 124 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1ieb h GLY 125 N -3.20 0.16 -4.42 0.55 0.00 -1.99 -3.45 103.07 90.72 1ieb h GLY 125 Ca -0.37 -0.32 -0.53 0.00 0.00 0.00 0.00 47.33 46.11 1ieb h GLY 125 CO 0.23 0.28 0.80 0.54 0.00 0.00 0.00 176.54 178.39 1ieb s ASN 126 N -6.90 6.65 0.13 0.19 6.03 -1.26 -4.95 114.94 114.82 1ieb s ASN 126 Ca -0.02 2.61 -0.25 0.00 -1.03 0.00 0.00 52.86 54.17 1ieb s ASN 126 Cb 0.10 -2.61 0.07 0.00 -3.03 0.00 0.00 41.25 35.78 1ieb s ASN 126 CO 0.83 -0.75 0.87 -0.51 -2.03 0.00 0.00 177.10 175.51 1ieb s ILE 127 N 0.58 0.00 -0.06 0.54 2.07 -1.26 -4.45 121.20 118.63 1ieb s ILE 127 Ca 0.64 -0.45 0.01 0.00 -1.41 0.00 0.00 60.65 59.44 1ieb s ILE 127 Cb -0.42 -1.60 0.02 0.00 0.13 0.00 0.00 42.46 40.59 1ieb s ILE 127 CO 0.37 0.00 -0.06 -1.61 -1.91 0.00 0.00 174.94 171.73 1ieb s GLU 128 N -3.38 1.05 -0.28 3.50 2.02 -0.43 -4.98 118.70 116.21 1ieb s GLU 128 Ca 0.09 -0.16 0.01 0.00 0.02 0.00 0.00 54.97 54.93 1ieb s GLU 128 Cb -0.02 -1.04 0.08 0.00 0.10 0.00 0.00 34.13 33.26 1ieb s GLU 128 CO -0.02 -0.09 0.01 0.08 0.02 0.00 0.00 175.26 175.26 1ieb s VAL 129 N 1.03 1.59 -0.18 2.63 1.01 -1.26 -0.30 120.40 124.92 1ieb s VAL 129 Ca -0.09 -1.58 -0.04 0.00 0.00 0.00 0.00 61.98 60.28 1ieb s VAL 129 Cb -0.14 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 1ieb s VAL 129 CO -0.00 -0.37 -0.04 -0.13 0.00 0.00 0.00 175.10 174.55 1ieb s ARG 130 N 1.31 3.57 -0.06 2.72 0.52 0.78 -4.95 118.95 122.83 1ieb s ARG 130 Ca 0.02 -0.56 -0.19 0.00 -0.52 0.00 0.00 55.73 54.49 1ieb s ARG 130 Cb -0.19 -2.94 -0.05 0.00 0.52 0.00 0.00 34.95 32.30 1ieb s ARG 130 CO -0.11 0.10 0.51 -1.58 0.02 0.00 0.00 175.30 174.23 1ieb s TRP 131 N 0.73 3.60 -0.09 -0.53 0.23 -1.26 -0.85 118.94 120.78 1ieb s TRP 131 Ca -0.02 1.01 0.03 0.00 -2.03 0.00 0.00 56.10 55.09 1ieb s TRP 131 Cb -0.15 -2.54 -0.01 0.00 0.03 0.00 0.00 33.47 30.80 1ieb s TRP 131 CO 0.02 0.29 -0.18 -0.06 0.96 0.00 0.00 176.95 177.98 1ieb s PHE 132 N 0.13 2.64 -0.94 -1.98 0.40 -0.29 -1.22 117.98 116.73 1ieb s PHE 132 Ca 0.27 -0.60 -0.17 0.00 -0.60 0.00 0.00 56.93 55.84 1ieb s PHE 132 Cb -0.16 -1.70 0.16 0.00 0.51 0.00 0.00 43.02 41.82 1ieb s PHE 132 CO 0.13 -0.14 1.07 0.50 0.70 0.00 0.00 175.22 177.48 1ieb s ARG 133 N -0.06 3.66 0.00 0.44 6.06 -0.11 -2.33 118.95 126.61 1ieb s ARG 133 Ca -0.04 -2.03 0.00 0.00 -2.50 0.00 0.00 55.73 51.15 1ieb s ARG 133 Cb -0.14 -4.81 0.00 0.00 0.06 0.00 0.00 34.95 30.06 1ieb s ARG 133 CO 0.04 -1.65 0.00 0.09 -2.50 0.00 0.00 175.30 171.28 1ieb n ASN 134 N 5.78 0.00 0.01 -2.12 4.13 -1.09 -3.33 115.26 118.64 1ieb n ASN 134 Ca 0.23 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.49 1ieb n ASN 134 Cb 0.48 -0.87 0.00 0.00 -1.54 0.00 0.00 39.78 37.84 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 -1.55 -0.77 3.89 7.41 0.00 -1.26 -4.96 105.19 107.95 1ieb n GLY 135 Ca 0.00 0.31 -0.29 0.00 0.00 0.00 0.00 46.02 46.04 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 -2.00 3.70 -0.35 1.61 2.20 -1.21 -4.99 119.74 118.70 1ieb s LYS 136 Ca 0.00 0.29 -0.28 0.00 -0.36 0.00 0.00 55.97 55.62 1ieb s LYS 136 Cb 0.00 -2.46 -0.03 0.00 -1.51 0.00 0.00 37.83 33.83 1ieb s LYS 136 CO 0.00 0.01 1.94 -2.00 -0.36 0.00 0.00 175.35 174.94 1ieb s GLU 137 N -3.91 3.12 -0.98 4.03 2.12 -1.26 -0.93 118.70 120.89 1ieb s GLU 137 Ca 0.48 1.47 -0.24 0.00 0.36 0.00 0.00 54.97 57.05 1ieb s GLU 137 Cb -0.10 -4.29 -0.07 0.00 0.26 0.00 0.00 34.13 29.93 1ieb s GLU 137 CO 0.33 -2.11 1.97 -2.00 -0.54 0.00 0.00 175.26 172.91 1ieb s GLU 138 N 6.15 2.45 -0.02 4.30 2.56 -0.35 -4.82 118.70 128.96 1ieb s GLU 138 Ca 0.84 -0.49 -0.02 0.00 0.00 0.00 0.00 54.97 55.31 1ieb s GLU 138 Cb -0.23 -5.09 -0.08 0.00 2.00 0.00 0.00 34.13 30.73 1ieb s GLU 138 CO 0.32 -3.66 2.54 1.63 -0.56 0.00 0.00 175.26 175.53 1ieb n LYS 139 N 8.68 1.38 -3.55 4.30 5.02 -1.26 -4.73 118.16 128.00 1ieb n LYS 139 Ca 0.42 -0.43 -0.10 0.00 -2.02 0.00 0.00 58.31 56.18 1ieb n LYS 139 Cb 0.47 -1.37 -0.04 0.00 -0.02 0.00 0.00 35.03 34.07 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 0.18 0.00 -0.61 -0.18 -1.32 -1.26 -4.96 115.64 107.49 1ieb s THR 140 Ca 0.24 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.71 1ieb s THR 140 Cb 0.12 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 70.11 1ieb s THR 140 CO -0.00 0.00 0.13 0.61 -2.21 0.00 0.00 174.62 173.15 1ieb n GLY 141 N 0.39 0.16 3.35 6.08 0.00 -1.26 -4.77 105.19 109.14 1ieb n GLY 141 Ca -0.10 -0.49 -0.46 0.00 0.00 0.00 0.00 46.02 44.97 1ieb n GLY 141 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ieb s ILE 142 N -2.61 5.57 -0.33 -0.61 -1.09 -1.26 -0.42 121.20 120.45 1ieb s ILE 142 Ca 0.07 -2.58 -0.29 0.00 -2.23 0.00 0.00 60.65 55.62 1ieb s ILE 142 Cb -0.03 -4.56 0.02 0.00 -1.58 0.00 0.00 42.46 36.31 1ieb s ILE 142 CO 0.08 -1.15 1.07 -0.69 -1.23 0.00 0.00 174.94 173.02 1ieb s VAL 143 N 0.22 4.50 0.38 2.92 1.01 -0.12 -4.88 120.40 124.43 1ieb s VAL 143 Ca 0.24 1.71 0.08 0.00 0.00 0.00 0.00 61.98 64.01 1ieb s VAL 143 Cb -0.09 -4.42 -0.07 0.00 0.00 0.00 0.00 36.38 31.80 1ieb s VAL 143 CO -0.08 -0.50 -0.04 -0.55 0.00 0.00 0.00 175.10 173.92 1ieb s SER 144 N 1.69 3.77 -0.05 3.32 0.15 -1.26 -0.13 113.70 121.20 1ieb s SER 144 Ca 0.45 -1.29 0.19 0.00 0.70 0.00 0.00 55.95 56.01 1ieb s SER 144 Cb -0.12 -0.37 -0.29 0.00 -1.71 0.00 0.00 66.02 63.53 1ieb s SER 144 CO 0.16 -0.34 0.38 0.35 1.20 0.00 0.00 173.24 175.00 1ieb n THR 145 N -0.88 0.16 0.00 6.45 -2.24 -0.61 -4.98 114.28 112.17 1ieb n THR 145 Ca -0.05 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 1ieb n THR 145 Cb 0.65 -0.02 0.00 0.00 -2.10 0.00 0.00 70.33 68.87 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 1.46 -0.60 3.61 3.38 0.00 -1.26 -4.79 105.19 106.99 1ieb n GLY 146 Ca -0.07 -1.72 -0.43 0.00 0.00 0.00 0.00 46.02 43.81 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 -2.67 3.58 0.06 0.99 2.96 -1.26 -4.53 118.68 117.81 1ieb s LEU 147 Ca 0.00 1.80 -0.18 0.00 -0.22 0.00 0.00 54.13 55.53 1ieb s LEU 147 Cb 0.00 -3.52 -0.06 0.00 0.50 0.00 0.00 46.19 43.11 1ieb s LEU 147 CO 0.00 -1.77 0.53 -0.69 -1.32 0.00 0.00 176.35 173.10 1ieb s VAL 148 N 7.39 4.82 -0.27 1.68 1.01 0.35 -4.97 120.40 130.41 1ieb s VAL 148 Ca 0.92 1.09 0.01 0.00 0.00 0.00 0.00 61.98 64.01 1ieb s VAL 148 Cb -0.31 -3.84 0.05 0.00 0.00 0.00 0.00 36.38 32.29 1ieb s VAL 148 CO 0.35 0.53 -0.08 -0.60 0.00 0.00 0.00 175.10 175.30 1ieb s ARG 149 N -1.19 2.36 0.35 2.72 3.52 -1.26 -2.69 118.95 122.76 1ieb s ARG 149 Ca 0.29 -1.28 0.26 0.00 -0.13 0.00 0.00 55.73 54.86 1ieb s ARG 149 Cb -0.18 -2.96 0.74 0.00 -1.56 0.00 0.00 34.95 30.99 1ieb s ARG 149 CO 0.18 -0.56 1.74 -0.91 -0.81 0.00 0.00 175.30 174.94 1ieb h ASN 150 N 7.85 0.00 0.00 -2.12 2.35 -1.82 -3.48 115.58 118.36 1ieb h ASN 150 Ca -0.22 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.53 1ieb h ASN 150 Cb 1.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.42 1ieb h ASN 150 CO 0.49 0.00 0.00 0.61 -1.65 0.00 0.00 177.43 176.88 1ieb n GLY 151 N 0.88 1.98 1.81 2.83 0.00 -1.26 -4.85 105.19 106.58 1ieb n GLY 151 Ca 0.04 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.86 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 4.63 -1.59 1.61 5.68 -1.26 -4.91 116.55 120.70 1ieb n ASP 152 Ca 0.00 -3.77 -0.17 0.00 -0.50 0.00 0.00 54.79 50.35 1ieb n ASP 152 Cb 0.00 -0.66 -0.04 0.00 -1.14 0.00 0.00 41.12 39.28 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 -0.96 -0.36 -4.28 2.11 7.02 -1.26 -5.02 117.44 114.70 1ieb n TRP 153 Ca 0.46 0.00 -0.18 0.00 -1.02 0.00 0.00 57.50 56.76 1ieb n TRP 153 Cb 0.97 -3.16 -0.13 0.00 -2.42 0.00 0.00 31.31 26.57 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 -2.73 0.84 0.54 -0.99 -4.23 -1.26 -4.70 115.64 103.11 1ieb s THR 154 Ca 0.00 -0.81 0.04 0.00 -1.18 0.00 0.00 61.69 59.74 1ieb s THR 154 Cb 0.00 -0.77 0.03 0.00 1.34 0.00 0.00 72.50 73.09 1ieb s THR 154 CO 0.00 -0.02 0.29 -0.36 -0.54 0.00 0.00 174.62 173.99 1ieb s PHE 155 N -0.75 1.65 0.01 3.99 0.08 -0.06 -2.26 117.98 120.65 1ieb s PHE 155 Ca -0.00 -0.89 -0.28 0.00 0.12 0.00 0.00 56.93 55.88 1ieb s PHE 155 Cb -0.07 -1.82 0.10 0.00 -0.57 0.00 0.00 43.02 40.66 1ieb s PHE 155 CO 0.01 -0.29 0.83 1.14 -0.10 0.00 0.00 175.22 176.81 1ieb s GLN 156 N -4.18 0.90 -0.20 0.44 -2.07 -1.09 -1.82 119.66 111.64 1ieb s GLN 156 Ca 0.25 -0.28 -0.22 0.00 -1.82 0.00 0.00 55.36 53.29 1ieb s GLN 156 Cb -0.01 0.42 0.06 0.00 -1.09 0.00 0.00 33.01 32.38 1ieb s GLN 156 CO 0.15 -0.38 0.61 -0.08 -1.32 0.00 0.00 175.29 174.27 1ieb s THR 157 N -3.04 0.00 -0.21 3.63 -1.32 -0.63 -0.50 115.64 113.57 1ieb s THR 157 Ca 0.03 -0.02 -0.03 0.00 -1.21 0.00 0.00 61.69 60.46 1ieb s THR 157 Cb -0.01 -0.86 -0.00 0.00 -1.51 0.00 0.00 72.50 70.12 1ieb s THR 157 CO -0.08 -0.01 -0.07 -0.76 -2.21 0.00 0.00 174.62 171.48 1ieb s LEU 158 N 0.05 2.74 -0.64 9.08 1.43 -1.26 -1.97 118.68 128.11 1ieb s LEU 158 Ca -0.02 -0.45 -0.01 0.00 -1.03 0.00 0.00 54.13 52.62 1ieb s LEU 158 Cb -0.04 -1.69 0.16 0.00 0.03 0.00 0.00 46.19 44.66 1ieb s LEU 158 CO 0.02 -0.02 0.45 -0.69 0.23 0.00 0.00 176.35 176.34 1ieb s VAL 159 N 1.44 3.55 0.44 -1.59 1.01 -0.70 -1.57 120.40 122.97 1ieb s VAL 159 Ca 0.06 -3.19 -0.15 0.00 0.00 0.00 0.00 61.98 58.70 1ieb s VAL 159 Cb -0.14 -3.32 -0.08 0.00 0.00 0.00 0.00 36.38 32.84 1ieb s VAL 159 CO -0.05 -0.89 0.87 -0.04 0.00 0.00 0.00 175.10 174.98 1ieb s MET 160 N -0.31 3.93 -0.11 2.72 -1.94 0.81 -3.11 119.30 121.29 1ieb s MET 160 Ca 0.18 0.76 -0.01 0.00 -1.71 0.00 0.00 55.69 54.91 1ieb s MET 160 Cb -0.19 -2.28 0.03 0.00 2.01 0.00 0.00 34.83 34.40 1ieb s MET 160 CO -0.04 -0.10 -0.05 -1.17 -0.01 0.00 0.00 175.02 173.66 1ieb s LEU 161 N -3.74 1.07 -0.20 -0.03 2.96 -0.26 -0.94 118.68 117.54 1ieb s LEU 161 Ca 0.56 -0.31 -0.29 0.00 -0.22 0.00 0.00 54.13 53.86 1ieb s LEU 161 Cb -0.10 -0.73 -0.00 0.00 0.50 0.00 0.00 46.19 45.86 1ieb s LEU 161 CO 0.27 -0.16 1.20 -1.61 -1.32 0.00 0.00 176.35 174.73 1ieb s GLU 162 N 1.78 4.20 0.24 1.98 2.02 0.44 -1.13 118.70 128.23 1ieb s GLU 162 Ca 0.04 1.52 -0.14 0.00 0.02 0.00 0.00 54.97 56.41 1ieb s GLU 162 Cb -0.13 -3.74 0.05 0.00 0.10 0.00 0.00 34.13 30.41 1ieb s GLU 162 CO -0.07 -0.73 0.70 0.25 0.02 0.00 0.00 175.26 175.43 1ieb n THR 163 N 5.46 0.00 -3.82 3.63 -2.24 -1.26 -4.84 114.28 111.21 1ieb n THR 163 Ca 0.13 -0.64 -0.35 0.00 -2.27 0.00 0.00 64.05 60.93 1ieb n THR 163 Cb 0.45 0.71 -0.12 0.00 -2.10 0.00 0.00 70.33 69.27 1ieb n THR 163 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1ieb s VAL 164 N -2.24 3.15 -0.05 2.28 -7.23 -1.26 -4.41 120.40 110.63 1ieb s VAL 164 Ca 0.15 -2.42 -0.30 0.00 -1.81 0.00 0.00 61.98 57.60 1ieb s VAL 164 Cb -0.03 -3.16 -0.06 0.00 0.56 0.00 0.00 36.38 33.69 1ieb s VAL 164 CO 0.07 -0.73 1.79 -2.84 -0.31 0.00 0.00 175.10 173.08 1ieb s PRO 165 N 0.71 4.06 0.23 4.82 0.02 -1.26 -4.98 135.00 138.60 1ieb s PRO 165 Ca 0.11 2.26 0.02 0.00 0.02 0.00 0.00 61.00 63.42 1ieb s PRO 165 Cb -0.22 -4.07 -0.05 0.00 0.02 0.00 0.00 34.50 30.18 1ieb s PRO 165 CO -0.04 -1.00 0.03 -0.65 -0.33 0.00 0.00 177.00 175.00 1ieb s GLN 166 N 4.38 1.31 0.65 5.54 -0.21 -1.26 -5.14 119.66 124.93 1ieb s GLN 166 Ca 0.80 -1.67 -0.16 0.00 0.02 0.00 0.00 55.36 54.35 1ieb s GLN 166 Cb -0.35 -0.44 -0.00 0.00 1.00 0.00 0.00 33.01 33.22 1ieb s GLN 166 CO 0.34 -0.17 1.13 -1.12 -2.12 0.00 0.00 175.29 173.35 1ieb s SER 167 N -3.28 5.07 0.00 5.90 0.01 -1.26 -3.33 113.70 116.81 1ieb s SER 167 Ca 0.30 2.08 0.00 0.00 1.31 0.00 0.00 55.95 59.64 1ieb s SER 167 Cb 0.07 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.73 1ieb s SER 167 CO 0.09 -1.66 0.00 0.61 0.41 0.00 0.00 173.24 172.69 1ieb n GLY 168 N -0.28 0.62 2.77 3.44 0.00 -1.26 -5.01 105.19 105.48 1ieb n GLY 168 Ca 0.11 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.14 -0.01 -0.15 1.61 4.04 -1.21 -5.13 118.70 117.71 1ieb s GLU 169 Ca 0.00 0.42 -0.00 0.00 0.04 0.00 0.00 54.97 55.43 1ieb s GLU 169 Cb 0.00 -0.35 -0.01 0.00 0.02 0.00 0.00 34.13 33.79 1ieb s GLU 169 CO 0.00 -0.28 -0.14 0.14 -1.84 0.00 0.00 175.26 173.14 1ieb s VAL 170 N 1.95 2.84 0.37 1.83 -7.23 -1.26 -4.69 120.40 114.21 1ieb s VAL 170 Ca 0.01 -0.72 0.00 0.00 -1.81 0.00 0.00 61.98 59.46 1ieb s VAL 170 Cb -0.12 -2.20 -0.03 0.00 0.56 0.00 0.00 36.38 34.59 1ieb s VAL 170 CO -0.04 0.51 0.58 -0.31 -0.31 0.00 0.00 175.10 175.53 1ieb s TYR 171 N 0.69 3.46 0.00 2.82 1.51 -0.08 -2.66 117.35 123.09 1ieb s TYR 171 Ca -0.07 0.36 -0.04 0.00 -1.01 0.00 0.00 57.07 56.31 1ieb s TYR 171 Cb -0.15 -1.98 -0.00 0.00 -0.11 0.00 0.00 41.96 39.72 1ieb s TYR 171 CO 0.02 0.03 0.08 0.99 -1.11 0.00 0.00 175.55 175.56 1ieb s THR 172 N -2.37 0.08 -0.33 -0.71 2.01 -0.98 -1.15 115.64 112.19 1ieb s THR 172 Ca 0.42 -0.63 -0.03 0.00 0.31 0.00 0.00 61.69 61.75 1ieb s THR 172 Cb -0.10 -0.33 0.05 0.00 0.01 0.00 0.00 72.50 72.14 1ieb s THR 172 CO 0.37 -0.35 0.06 0.00 -0.69 0.00 0.00 174.62 174.01 1ieb s GLN 174 N 1.28 3.32 -0.14 0.00 0.74 -0.03 -1.66 119.66 123.18 1ieb s GLN 174 Ca -0.02 -0.75 -0.02 0.00 0.05 0.00 0.00 55.36 54.62 1ieb s GLN 174 Cb -0.20 -3.74 -0.02 0.00 1.10 0.00 0.00 33.01 30.14 1ieb s GLN 174 CO -0.00 -0.49 -0.09 0.08 -0.55 0.00 0.00 175.29 174.23 1ieb s VAL 175 N 1.67 3.41 -0.11 1.34 1.01 -0.09 -0.16 120.40 127.46 1ieb s VAL 175 Ca 0.05 -0.53 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 1ieb s VAL 175 Cb -0.18 -2.46 -0.03 0.00 0.00 0.00 0.00 36.38 33.72 1ieb s VAL 175 CO 0.09 0.51 -0.07 -1.61 0.00 0.00 0.00 175.10 174.02 1ieb s GLU 176 N 0.33 3.20 -0.17 2.72 8.01 0.59 -1.40 118.70 131.99 1ieb s GLU 176 Ca -0.08 -0.57 -0.23 0.00 0.01 0.00 0.00 54.97 54.10 1ieb s GLU 176 Cb -0.15 -2.71 0.06 0.00 -4.31 0.00 0.00 34.13 27.02 1ieb s GLU 176 CO 0.05 0.42 0.60 -1.58 0.01 0.00 0.00 175.26 174.76 1ieb s HIS 177 N -0.16 -0.62 -0.96 1.61 2.46 -1.26 -1.31 115.29 115.05 1ieb s HIS 177 Ca 0.02 1.38 0.00 0.00 0.47 0.00 0.00 55.06 56.93 1ieb s HIS 177 Cb -0.13 0.26 0.00 0.00 -0.13 0.00 0.00 32.58 32.58 1ieb s HIS 177 CO 0.03 -0.40 0.00 -2.30 -2.47 0.00 0.00 174.74 169.60 1ieb n PRO 178 N 2.17 0.00 0.00 2.88 -0.02 -1.26 0.29 135.00 139.06 1ieb n PRO 178 Ca -0.16 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.32 1ieb n PRO 178 Cb 0.56 -0.97 0.00 0.00 -0.02 0.00 0.00 33.50 33.07 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 0.43 0.11 -4.39 2.55 3.41 -1.26 -4.93 113.62 109.55 1ieb n SER 179 Ca 0.00 -0.45 -0.35 0.00 -0.26 0.00 0.00 58.87 57.82 1ieb n SER 179 Cb 0.00 0.22 -0.13 0.00 -0.26 0.00 0.00 64.21 64.04 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 -0.45 3.05 0.11 1.04 1.43 0.14 -4.86 118.68 119.14 1ieb s LEU 180 Ca 0.00 -0.29 -0.06 0.00 -1.03 0.00 0.00 54.13 52.75 1ieb s LEU 180 Cb 0.00 -1.76 -0.15 0.00 0.03 0.00 0.00 46.19 44.31 1ieb s LEU 180 CO 0.00 0.05 1.25 0.71 0.23 0.00 0.00 176.35 178.59 1ieb h THR 181 N 5.51 1.39 -4.17 5.49 1.35 -1.96 -3.41 112.91 117.11 1ieb h THR 181 Ca -0.37 -2.52 -0.53 0.00 -0.55 0.00 0.00 66.41 62.44 1ieb h THR 181 Cb 1.18 2.52 -0.30 0.00 -1.73 0.00 0.00 68.15 69.81 1ieb h THR 181 CO 0.60 0.75 -0.83 -1.81 -0.25 0.00 0.00 175.52 173.99 1ieb s ASP 182 N -7.14 1.94 -0.01 5.36 1.01 -1.26 -5.08 116.67 111.49 1ieb s ASP 182 Ca -0.06 -0.30 -0.39 0.00 0.71 0.00 0.00 52.55 52.51 1ieb s ASP 182 Cb 0.08 -0.31 -0.18 0.00 1.01 0.00 0.00 42.92 43.52 1ieb s ASP 182 CO 0.88 0.18 1.29 -0.81 0.21 0.00 0.00 175.17 176.93 1ieb n PRO 183 N 2.82 0.68 -3.06 8.23 -0.04 -1.26 -4.94 135.00 137.42 1ieb n PRO 183 Ca -0.16 0.25 -0.41 0.00 -0.04 0.00 0.00 63.50 63.14 1ieb n PRO 183 Cb 0.54 -1.83 -0.06 0.00 -0.04 0.00 0.00 33.50 32.11 1ieb n PRO 183 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1ieb s VAL 184 N 0.71 4.97 -0.04 0.52 1.01 -0.49 -4.87 120.40 122.21 1ieb s VAL 184 Ca 0.89 1.26 0.07 0.00 0.00 0.00 0.00 61.98 64.20 1ieb s VAL 184 Cb -1.11 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 31.28 1ieb s VAL 184 CO 0.54 0.05 -0.25 0.42 0.00 0.00 0.00 175.10 175.85 1ieb s THR 185 N 2.28 2.05 -0.09 3.92 -4.23 -1.25 -0.92 115.64 117.40 1ieb s THR 185 Ca 0.29 -1.08 0.00 0.00 -1.18 0.00 0.00 61.69 59.72 1ieb s THR 185 Cb -0.16 -1.72 0.02 0.00 1.34 0.00 0.00 72.50 71.99 1ieb s THR 185 CO 0.09 0.57 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.98 1ieb s VAL 186 N -0.36 0.98 0.50 2.29 1.01 -0.66 -4.92 120.40 119.23 1ieb s VAL 186 Ca 0.02 -0.30 0.04 0.00 0.00 0.00 0.00 61.98 61.75 1ieb s VAL 186 Cb -0.12 -0.97 0.03 0.00 0.00 0.00 0.00 36.38 35.31 1ieb s VAL 186 CO 0.02 0.35 0.69 -1.61 0.00 0.00 0.00 175.10 174.55 1ieb s GLU 187 N 1.38 2.63 0.00 2.72 2.02 -1.26 0.49 118.70 126.69 1ieb s GLU 187 Ca -0.02 -1.01 0.00 0.00 0.02 0.00 0.00 54.97 53.96 1ieb s GLU 187 Cb -0.14 -2.60 0.00 0.00 0.10 0.00 0.00 34.13 31.49 1ieb s GLU 187 CO -0.04 -0.55 0.00 1.87 0.02 0.00 0.00 175.26 176.56