#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ill s ALA 2 N 0.00 1.92 0.52 3.04 0.00 -1.26 -1.29 121.76 124.69 2ill s ALA 2 Ca 0.00 0.86 -0.23 0.00 0.00 0.00 0.00 51.96 52.59 2ill s ALA 2 Cb 0.00 -3.49 -0.06 0.00 0.00 0.00 0.00 23.12 19.57 2ill s ALA 2 CO 0.00 -2.17 1.36 -2.14 0.00 0.00 0.00 175.76 172.81 2ill s PRO 3 N -4.07 3.31 -0.01 0.00 0.02 -1.26 -4.36 135.00 128.64 2ill s PRO 3 Ca 0.74 2.25 -0.01 0.00 0.02 0.00 0.00 61.00 64.00 2ill s PRO 3 Cb -0.29 -2.37 -0.00 0.00 0.02 0.00 0.00 34.50 31.86 2ill s PRO 3 CO 0.49 -1.06 0.03 -1.58 -0.33 0.00 0.00 177.00 174.55 2ill s HIS 4 N -1.29 0.02 -0.94 6.54 2.46 -0.22 -4.82 115.29 117.04 2ill s HIS 4 Ca 0.68 -0.04 -0.22 0.00 0.47 0.00 0.00 55.06 55.96 2ill s HIS 4 Cb -0.41 -0.03 0.08 0.00 -0.13 0.00 0.00 32.58 32.09 2ill s HIS 4 CO 0.49 -0.06 1.29 -0.06 -2.47 0.00 0.00 174.74 173.92 2ill s PHE 5 N -0.33 2.74 0.24 3.88 0.40 -1.26 -1.27 117.98 122.38 2ill s PHE 5 Ca -0.04 -0.97 -0.05 0.00 -0.60 0.00 0.00 56.93 55.28 2ill s PHE 5 Cb -0.02 -4.51 0.39 0.00 0.51 0.00 0.00 43.02 39.38 2ill s PHE 5 CO -0.00 -1.76 1.80 -0.22 0.70 0.00 0.00 175.22 175.73 2ill h LYS 6 N 9.45 0.70 -4.50 0.44 1.63 -1.50 -3.38 116.57 119.41 2ill h LYS 6 Ca 0.12 -0.04 -0.57 0.00 -0.85 0.00 0.00 60.65 59.31 2ill h LYS 6 Cb 1.02 -0.16 -0.36 0.00 -0.60 0.00 0.00 32.23 32.13 2ill h LYS 6 CO 1.28 0.47 -0.82 -1.21 -3.45 0.00 0.00 179.45 175.72 2ill s GLU 7 N -6.03 1.96 0.44 1.90 2.02 -0.91 -4.95 118.70 113.12 2ill s GLU 7 Ca -0.12 -0.43 -0.12 0.00 0.02 0.00 0.00 54.97 54.31 2ill s GLU 7 Cb 0.19 -1.83 -0.07 0.00 0.10 0.00 0.00 34.13 32.52 2ill s GLU 7 CO 0.78 -0.21 0.83 -1.21 0.02 0.00 0.00 175.26 175.47 2ill s GLU 8 N 1.45 3.81 0.31 1.61 2.02 -1.26 -1.30 118.70 125.34 2ill s GLU 8 Ca 0.02 0.59 -0.27 0.00 0.02 0.00 0.00 54.97 55.33 2ill s GLU 8 Cb -0.13 -2.31 -0.13 0.00 0.10 0.00 0.00 34.13 31.65 2ill s GLU 8 CO -0.08 -0.12 1.01 1.28 0.02 0.00 0.00 175.26 177.38 2ill n LEU 9 N -1.45 1.96 -4.57 1.80 4.77 -1.26 -4.81 117.00 113.44 2ill n LEU 9 Ca 0.04 1.16 -0.32 0.00 -0.03 0.00 0.00 56.01 56.85 2ill n LEU 9 Cb 0.54 -1.31 -0.11 0.00 -2.33 0.00 0.00 43.42 40.22 2ill n LEU 9 CO 0.48 -1.39 -0.40 -0.13 -1.33 0.00 0.00 177.39 174.61 2ill s ARG 10 N -1.64 2.50 0.51 3.23 0.52 -1.26 -4.81 118.95 118.00 2ill s ARG 10 Ca 0.59 -0.74 -0.23 0.00 -0.52 0.00 0.00 55.73 54.83 2ill s ARG 10 Cb -0.67 -2.46 -0.06 0.00 0.52 0.00 0.00 34.95 32.28 2ill s ARG 10 CO 0.60 0.60 1.40 -0.80 0.02 0.00 0.00 175.30 177.12 2ill s ASN 11 N -1.34 5.49 -0.01 0.23 0.01 -1.26 -4.72 114.94 113.34 2ill s ASN 11 Ca 0.16 2.87 0.06 0.00 -0.71 0.00 0.00 52.86 55.24 2ill s ASN 11 Cb -0.11 -2.65 -0.02 0.00 0.41 0.00 0.00 41.25 38.89 2ill s ASN 11 CO 0.06 -1.43 -0.20 -0.76 -1.51 0.00 0.00 177.10 173.26 2ill s LEU 12 N -3.19 2.05 -0.20 0.60 1.43 0.82 -4.97 118.68 115.23 2ill s LEU 12 Ca 0.67 -0.38 0.00 0.00 -1.03 0.00 0.00 54.13 53.39 2ill s LEU 12 Cb -0.43 -1.04 0.02 0.00 0.03 0.00 0.00 46.19 44.77 2ill s LEU 12 CO 0.52 0.24 -0.16 0.20 0.23 0.00 0.00 176.35 177.39 2ill s ASN 13 N -0.55 3.52 0.02 2.29 -0.87 -1.26 -1.12 114.94 116.97 2ill s ASN 13 Ca 0.08 -0.70 0.01 0.00 -1.57 0.00 0.00 52.86 50.67 2ill s ASN 13 Cb -0.08 -1.54 -0.02 0.00 -0.02 0.00 0.00 41.25 39.60 2ill s ASN 13 CO -0.01 -0.03 -0.04 -0.69 -2.57 0.00 0.00 177.10 173.76 2ill s VAL 14 N 1.30 0.26 0.11 1.60 1.01 -0.26 -4.94 120.40 119.49 2ill s VAL 14 Ca 0.03 -0.73 -0.23 0.00 0.00 0.00 0.00 61.98 61.05 2ill s VAL 14 Cb -0.14 -0.34 -0.07 0.00 0.00 0.00 0.00 36.38 35.83 2ill s VAL 14 CO -0.10 -0.31 0.70 -0.60 0.00 0.00 0.00 175.10 174.79 2ill s ARG 15 N -1.10 4.43 0.22 2.72 6.06 -1.26 -0.61 118.95 129.41 2ill s ARG 15 Ca -0.09 0.99 -0.28 0.00 -2.50 0.00 0.00 55.73 53.85 2ill s ARG 15 Cb -0.07 -3.27 -0.16 0.00 0.06 0.00 0.00 34.95 31.50 2ill s ARG 15 CO -0.00 0.54 0.63 0.98 -2.50 0.00 0.00 175.30 174.95 2ill n TYR 16 N 1.85 -0.10 -0.36 5.12 9.36 -0.85 -1.73 117.16 130.46 2ill n TYR 16 Ca -0.07 0.91 0.00 0.00 3.32 0.00 0.00 57.90 62.06 2ill n TYR 16 Cb 0.50 -2.02 0.00 0.00 -0.63 0.00 0.00 39.34 37.18 2ill n TYR 16 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 2ill n GLN 17 N 0.94 0.00 -1.53 2.98 6.02 0.25 -4.86 117.38 121.19 2ill n GLN 17 Ca 0.16 0.00 -0.29 0.00 -0.01 0.00 0.00 57.00 56.86 2ill n GLN 17 Cb 0.26 -3.33 0.16 0.00 1.02 0.00 0.00 30.24 28.36 2ill n GLN 17 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 2ill s SER 18 N -2.61 3.04 -0.03 1.08 0.01 -0.70 -4.19 113.70 110.29 2ill s SER 18 Ca 0.00 0.80 -0.19 0.00 1.31 0.00 0.00 55.95 57.87 2ill s SER 18 Cb 0.00 -1.24 -0.05 0.00 0.21 0.00 0.00 66.02 64.94 2ill s SER 18 CO 0.00 -2.83 0.53 0.20 0.41 0.00 0.00 173.24 171.55 2ill s ASN 19 N -4.14 6.87 -0.17 2.44 0.01 -1.26 -0.01 114.94 118.67 2ill s ASN 19 Ca 0.67 1.04 -0.06 0.00 -0.71 0.00 0.00 52.86 53.79 2ill s ASN 19 Cb -0.12 -2.32 -0.04 0.00 0.41 0.00 0.00 41.25 39.18 2ill s ASN 19 CO 0.54 0.13 0.03 0.00 -1.51 0.00 0.00 177.10 176.29 2ill s ALA 20 N -0.22 3.28 -0.25 0.60 0.00 0.98 -4.95 121.76 121.21 2ill s ALA 20 Ca 0.28 -0.77 -0.04 0.00 0.00 0.00 0.00 51.96 51.43 2ill s ALA 20 Cb -0.17 -1.81 0.00 0.00 0.00 0.00 0.00 23.12 21.15 2ill s ALA 20 CO 0.15 0.19 -0.02 0.99 0.00 0.00 0.00 175.76 177.07 2ill s THR 21 N 0.37 3.40 -0.23 0.00 2.01 -1.26 0.02 115.64 119.96 2ill s THR 21 Ca 0.01 -0.67 -0.10 0.00 0.31 0.00 0.00 61.69 61.24 2ill s THR 21 Cb -0.13 -2.64 -0.05 0.00 0.01 0.00 0.00 72.50 69.69 2ill s THR 21 CO 0.01 0.28 0.14 -0.76 -0.69 0.00 0.00 174.62 173.60 2ill s LEU 22 N 1.45 4.05 0.04 4.42 1.02 0.25 -4.97 118.68 124.93 2ill s LEU 22 Ca 0.04 0.10 0.03 0.00 0.02 0.00 0.00 54.13 54.32 2ill s LEU 22 Cb -0.16 -2.07 -0.02 0.00 0.02 0.00 0.00 46.19 43.96 2ill s LEU 22 CO -0.02 0.09 -0.10 -0.69 0.02 0.00 0.00 176.35 175.65 2ill s VAL 23 N 0.90 0.72 0.16 -1.59 1.01 -1.26 -1.25 120.40 119.08 2ill s VAL 23 Ca 0.07 -0.95 -0.13 0.00 0.00 0.00 0.00 61.98 60.97 2ill s VAL 23 Cb -0.13 -0.71 0.01 0.00 0.00 0.00 0.00 36.38 35.55 2ill s VAL 23 CO 0.03 -0.19 0.37 0.00 0.00 0.00 0.00 175.10 175.31 2ill s LYS 25 N -3.89 2.12 -0.08 0.00 2.20 -0.42 -1.91 119.74 117.75 2ill s LYS 25 Ca 0.11 -0.59 0.04 0.00 -0.36 0.00 0.00 55.97 55.17 2ill s LYS 25 Cb 0.02 -1.70 -0.01 0.00 -1.51 0.00 0.00 37.83 34.63 2ill s LYS 25 CO -0.04 0.12 -0.22 0.08 -0.36 0.00 0.00 175.35 174.93 2ill s VAL 26 N 0.43 2.29 0.31 4.02 1.01 0.38 -1.19 120.40 127.65 2ill s VAL 26 Ca -0.13 -0.97 0.09 0.00 0.00 0.00 0.00 61.98 60.97 2ill s VAL 26 Cb -0.15 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.31 2ill s VAL 26 CO 0.05 0.56 0.06 0.42 0.00 0.00 0.00 175.10 176.19 2ill s THR 27 N -0.01 3.12 0.00 3.92 -4.23 -0.39 -4.41 115.64 113.64 2ill s THR 27 Ca -0.07 -1.83 0.00 0.00 -1.18 0.00 0.00 61.69 58.61 2ill s THR 27 Cb -0.15 -2.89 0.00 0.00 1.34 0.00 0.00 72.50 70.80 2ill s THR 27 CO 0.05 -0.26 0.00 0.61 -0.54 0.00 0.00 174.62 174.48 2ill n GLY 28 N -1.01 4.18 3.17 3.99 0.00 -1.26 -1.06 105.19 113.20 2ill n GLY 28 Ca -0.05 -1.04 -0.11 0.00 0.00 0.00 0.00 46.02 44.83 2ill n GLY 28 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2ill s HIS 29 N -2.00 -0.60 0.95 1.61 3.76 -0.41 -3.67 115.29 114.93 2ill s HIS 29 Ca 0.00 1.24 -0.10 0.00 -0.15 0.00 0.00 55.06 56.04 2ill s HIS 29 Cb 0.00 0.17 0.16 0.00 1.11 0.00 0.00 32.58 34.02 2ill s HIS 29 CO 0.00 -0.39 1.13 -2.14 -0.85 0.00 0.00 174.74 172.49 2ill s PRO 30 N 2.18 0.77 -0.33 8.40 0.02 -1.26 -0.90 135.00 143.88 2ill s PRO 30 Ca -0.03 1.43 -0.37 0.00 0.02 0.00 0.00 61.00 62.05 2ill s PRO 30 Cb -0.11 -1.71 -0.13 0.00 0.02 0.00 0.00 34.50 32.57 2ill s PRO 30 CO -0.11 -2.77 2.05 1.17 -0.33 0.00 0.00 177.00 177.01 2ill n LYS 31 N -4.32 1.06 -1.54 5.54 4.81 -1.24 -4.79 118.16 117.69 2ill n LYS 31 Ca 0.10 0.33 -0.35 0.00 -0.87 0.00 0.00 58.31 57.53 2ill n LYS 31 Cb 0.52 -2.28 0.08 0.00 0.02 0.00 0.00 35.03 33.37 2ill n LYS 31 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 2ill s PRO 32 N 5.36 2.30 -0.12 1.64 0.02 -1.26 -4.91 135.00 138.03 2ill s PRO 32 Ca 1.07 1.78 -0.05 0.00 0.02 0.00 0.00 61.00 63.81 2ill s PRO 32 Cb -0.97 -1.85 -0.04 0.00 0.02 0.00 0.00 34.50 31.66 2ill s PRO 32 CO 0.55 -1.72 0.08 0.42 -0.33 0.00 0.00 177.00 176.01 2ill s ILE 33 N -1.90 5.00 -0.13 2.83 1.01 -0.40 -4.82 121.20 122.80 2ill s ILE 33 Ca 0.75 0.02 0.01 0.00 0.00 0.00 0.00 60.65 61.43 2ill s ILE 33 Cb -0.30 -3.17 -0.01 0.00 0.01 0.00 0.00 42.46 38.99 2ill s ILE 33 CO 0.43 0.59 -0.15 -0.69 0.00 0.00 0.00 174.94 175.12 2ill s VAL 34 N -0.76 2.82 0.06 2.92 1.01 -1.26 -1.02 120.40 124.18 2ill s VAL 34 Ca 0.13 -0.74 0.08 0.00 0.00 0.00 0.00 61.98 61.45 2ill s VAL 34 Cb -0.12 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.06 2ill s VAL 34 CO 0.03 0.53 -0.21 -0.54 0.00 0.00 0.00 175.10 174.91 2ill s LYS 35 N 0.42 1.90 0.02 2.72 1.02 -0.42 -4.96 119.74 120.44 2ill s LYS 35 Ca -0.12 -1.07 0.06 0.00 0.02 0.00 0.00 55.97 54.86 2ill s LYS 35 Cb -0.16 -2.10 -0.03 0.00 -0.52 0.00 0.00 37.83 35.02 2ill s LYS 35 CO 0.06 0.52 -0.15 -1.58 -0.92 0.00 0.00 175.35 173.27 2ill s TRP 36 N -0.94 2.65 0.02 3.18 0.52 -1.26 -0.36 118.94 122.75 2ill s TRP 36 Ca 0.14 -0.20 0.01 0.00 0.02 0.00 0.00 56.10 56.08 2ill s TRP 36 Cb -0.10 -1.52 -0.01 0.00 -1.15 0.00 0.00 33.47 30.68 2ill s TRP 36 CO 0.05 0.26 -0.04 0.71 0.02 0.00 0.00 176.95 177.95 2ill s TYR 37 N -0.91 0.39 -0.29 -1.98 1.51 0.12 0.39 117.35 116.58 2ill s TYR 37 Ca 0.15 -0.32 -0.06 0.00 -1.01 0.00 0.00 57.07 55.83 2ill s TYR 37 Cb -0.11 -0.25 0.01 0.00 -0.11 0.00 0.00 41.96 41.51 2ill s TYR 37 CO 0.05 -0.08 0.07 0.50 -1.11 0.00 0.00 175.55 174.98 2ill s ARG 38 N -0.91 3.06 -1.42 -0.62 3.52 0.25 -1.39 118.95 121.44 2ill s ARG 38 Ca -0.07 -0.87 -0.12 0.00 -0.13 0.00 0.00 55.73 54.54 2ill s ARG 38 Cb -0.06 -3.34 0.02 0.00 -1.56 0.00 0.00 34.95 30.01 2ill s ARG 38 CO -0.00 -0.44 0.27 1.04 -0.81 0.00 0.00 175.30 175.36 2ill n GLN 39 N 4.85 -0.89 -0.98 5.12 6.02 0.01 -0.53 117.38 130.97 2ill n GLN 39 Ca -0.15 0.11 0.00 0.00 -0.01 0.00 0.00 57.00 56.96 2ill n GLN 39 Cb 0.48 -3.31 0.00 0.00 1.02 0.00 0.00 30.24 28.43 2ill n GLN 39 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2ill n GLY 40 N -2.37 0.60 3.30 1.08 0.00 -1.26 -5.01 105.19 101.53 2ill n GLY 40 Ca -0.25 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 2ill n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ill s LYS 41 N -0.15 3.15 0.28 1.61 1.02 0.30 -5.08 119.74 120.87 2ill s LYS 41 Ca 0.00 -0.79 -0.30 0.00 0.02 0.00 0.00 55.97 54.90 2ill s LYS 41 Cb 0.00 -2.44 -0.12 0.00 -0.52 0.00 0.00 37.83 34.76 2ill s LYS 41 CO 0.00 0.22 1.63 -2.00 -0.92 0.00 0.00 175.35 174.28 2ill s GLU 42 N 0.28 4.12 -0.11 1.68 2.12 -1.26 -0.58 118.70 124.94 2ill s GLU 42 Ca -0.14 2.60 -0.21 0.00 0.36 0.00 0.00 54.97 57.58 2ill s GLU 42 Cb -0.17 -3.03 -0.04 0.00 0.26 0.00 0.00 34.13 31.16 2ill s GLU 42 CO 0.07 -0.67 0.63 0.42 -0.54 0.00 0.00 175.26 175.17 2ill s ILE 43 N 0.23 5.08 -0.24 -3.70 1.01 0.16 -4.81 121.20 118.94 2ill s ILE 43 Ca 0.66 1.26 -0.08 0.00 0.00 0.00 0.00 60.65 62.49 2ill s ILE 43 Cb -0.48 -3.96 -0.03 0.00 0.01 0.00 0.00 42.46 37.99 2ill s ILE 43 CO 0.45 0.24 0.08 -0.63 0.00 0.00 0.00 174.94 175.08 2ill s ILE 44 N 0.99 4.53 0.20 2.92 -1.09 -1.26 -4.58 121.20 122.91 2ill s ILE 44 Ca 0.33 -0.10 -0.32 0.00 -2.23 0.00 0.00 60.65 58.33 2ill s ILE 44 Cb -0.17 -3.11 -0.11 0.00 -1.58 0.00 0.00 42.46 37.50 2ill s ILE 44 CO 0.14 0.35 1.64 0.00 -1.23 0.00 0.00 174.94 175.84 2ill s ALA 45 N 1.38 3.85 0.00 9.38 0.00 -1.26 -4.88 121.76 130.22 2ill s ALA 45 Ca 0.05 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.51 2ill s ALA 45 Cb -0.15 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2ill s ALA 45 CO 0.04 -0.87 0.58 -0.40 0.00 0.00 0.00 175.76 175.11 2ill n ASP 46 N 3.70 1.15 0.00 0.00 5.68 -0.66 -5.00 116.55 121.42 2ill n ASP 46 Ca 0.14 -1.18 0.00 0.00 -0.50 0.00 0.00 54.79 53.25 2ill n ASP 46 Cb 0.37 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.35 2ill n ASP 46 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2ill n GLY 47 N -0.09 2.58 0.00 6.12 0.00 -0.04 -4.85 105.19 108.91 2ill n GLY 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2ill n GLY 47 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2ill n LEU 48 N 0.00 0.00 -0.32 0.99 4.77 -1.26 -4.83 117.00 116.35 2ill n LEU 48 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 56.01 55.94 2ill n LEU 48 Cb 0.00 0.00 0.09 0.00 -2.33 0.00 0.00 43.42 41.18 2ill n LEU 48 CO 0.00 0.00 1.14 0.50 -1.33 0.00 0.00 177.39 177.70 2ill h LYS 49 N 0.00 1.24 -4.59 3.23 1.63 -1.92 -3.40 116.57 112.76 2ill h LYS 49 Ca 0.00 -0.17 -0.58 0.00 -0.85 0.00 0.00 60.65 59.05 2ill h LYS 49 Cb 0.00 -0.23 -0.36 0.00 -0.60 0.00 0.00 32.23 31.04 2ill h LYS 49 CO 0.00 0.93 -0.83 0.71 -3.45 0.00 0.00 179.45 176.81 2ill s TYR 50 N -5.74 1.94 -0.02 1.91 1.51 -1.26 -0.87 117.35 114.82 2ill s TYR 50 Ca -0.12 -1.01 0.06 0.00 -1.01 0.00 0.00 57.07 54.98 2ill s TYR 50 Cb 0.17 -1.45 -0.01 0.00 -0.11 0.00 0.00 41.96 40.55 2ill s TYR 50 CO 0.83 -0.57 -0.19 1.03 -1.11 0.00 0.00 175.55 175.55 2ill s ARG 51 N 1.37 1.57 -0.07 -0.62 0.52 -0.51 -0.86 118.95 120.35 2ill s ARG 51 Ca 0.01 -0.67 0.03 0.00 -0.52 0.00 0.00 55.73 54.58 2ill s ARG 51 Cb -0.13 -1.49 -0.02 0.00 0.52 0.00 0.00 34.95 33.82 2ill s ARG 51 CO -0.07 0.38 -0.15 0.42 0.02 0.00 0.00 175.30 175.90 2ill s ILE 52 N -0.37 2.96 -0.02 1.52 1.01 -1.26 -1.39 121.20 123.65 2ill s ILE 52 Ca 0.06 -0.74 0.02 0.00 0.00 0.00 0.00 60.65 59.99 2ill s ILE 52 Cb -0.08 -2.18 0.00 0.00 0.01 0.00 0.00 42.46 40.22 2ill s ILE 52 CO -0.00 0.57 -0.08 -1.10 0.00 0.00 0.00 174.94 174.33 2ill s GLN 53 N -0.36 0.81 -0.01 2.79 -0.21 -0.41 -5.01 119.66 117.26 2ill s GLN 53 Ca 0.03 -0.27 0.04 0.00 0.02 0.00 0.00 55.36 55.18 2ill s GLN 53 Cb -0.12 -0.77 -0.01 0.00 1.00 0.00 0.00 33.01 33.10 2ill s GLN 53 CO 0.02 0.11 -0.13 -2.00 -2.12 0.00 0.00 175.29 171.17 2ill s GLU 54 N 0.12 1.10 0.06 2.91 2.12 -1.26 -0.36 118.70 123.38 2ill s GLU 54 Ca -0.02 -0.48 0.05 0.00 0.36 0.00 0.00 54.97 54.89 2ill s GLU 54 Cb -0.07 -1.06 -0.03 0.00 0.26 0.00 0.00 34.13 33.24 2ill s GLU 54 CO 0.00 0.28 -0.15 -0.06 -0.54 0.00 0.00 175.26 174.80 2ill s PHE 55 N -0.29 1.27 0.18 5.30 0.40 -0.45 -5.01 117.98 119.38 2ill s PHE 55 Ca 0.05 -0.42 -0.30 0.00 -0.60 0.00 0.00 56.93 55.66 2ill s PHE 55 Cb -0.05 -0.73 -0.17 0.00 0.51 0.00 0.00 43.02 42.58 2ill s PHE 55 CO -0.00 0.06 0.72 1.63 0.70 0.00 0.00 175.22 178.32 2ill n LYS 56 N 1.48 0.30 -0.42 0.44 5.02 -1.26 -2.58 118.16 121.13 2ill n LYS 56 Ca -0.20 0.10 0.00 0.00 -2.02 0.00 0.00 58.31 56.19 2ill n LYS 56 Cb 0.54 -1.27 0.00 0.00 -0.02 0.00 0.00 35.03 34.29 2ill n LYS 56 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2ill n GLY 57 N 1.82 0.77 2.02 0.72 0.00 -1.26 -4.40 105.19 104.86 2ill n GLY 57 Ca 0.17 -0.17 -0.01 0.00 0.00 0.00 0.00 46.02 46.01 2ill n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ill n GLY 58 N -2.42 0.43 3.76 -0.02 0.00 -1.16 -4.70 105.19 101.08 2ill n GLY 58 Ca 0.00 -1.06 -0.40 0.00 0.00 0.00 0.00 46.02 44.56 2ill n GLY 58 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2ill s TYR 59 N -2.02 3.94 -0.03 1.61 1.51 -1.07 -0.47 117.35 120.82 2ill s TYR 59 Ca 0.00 1.77 -0.00 0.00 -1.01 0.00 0.00 57.07 57.83 2ill s TYR 59 Cb 0.00 -2.88 0.03 0.00 -0.11 0.00 0.00 41.96 39.00 2ill s TYR 59 CO 0.00 0.47 0.01 -1.01 -1.11 0.00 0.00 175.55 173.91 2ill s HIS 60 N -1.09 0.27 -0.03 2.71 3.76 -0.80 -1.34 115.29 118.77 2ill s HIS 60 Ca 0.39 0.04 0.01 0.00 -0.15 0.00 0.00 55.06 55.34 2ill s HIS 60 Cb -0.24 -0.42 0.02 0.00 1.11 0.00 0.00 32.58 33.04 2ill s HIS 60 CO 0.29 -0.14 -0.03 -1.14 -0.85 0.00 0.00 174.74 172.86 2ill s GLN 61 N 1.22 0.53 -0.17 1.40 0.74 0.51 -1.60 119.66 122.29 2ill s GLN 61 Ca -0.07 -0.07 -0.04 0.00 0.05 0.00 0.00 55.36 55.22 2ill s GLN 61 Cb -0.13 -0.58 -0.03 0.00 1.10 0.00 0.00 33.01 33.37 2ill s GLN 61 CO -0.02 -0.04 -0.02 -1.17 -0.55 0.00 0.00 175.29 173.49 2ill s LEU 62 N 0.62 3.30 -0.24 3.68 2.96 -0.38 -1.28 118.68 127.33 2ill s LEU 62 Ca -0.07 -0.13 -0.04 0.00 -0.22 0.00 0.00 54.13 53.67 2ill s LEU 62 Cb -0.10 -1.81 0.00 0.00 0.50 0.00 0.00 46.19 44.78 2ill s LEU 62 CO -0.00 0.14 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.52 2ill s ILE 63 N 0.52 3.40 -0.27 6.68 1.01 -0.49 -0.59 121.20 131.47 2ill s ILE 63 Ca -0.02 -0.63 -0.08 0.00 0.00 0.00 0.00 60.65 59.91 2ill s ILE 63 Cb -0.14 -2.63 -0.03 0.00 0.01 0.00 0.00 42.46 39.68 2ill s ILE 63 CO 0.02 0.31 0.11 -0.63 0.00 0.00 0.00 174.94 174.76 2ill s ILE 64 N 1.45 4.54 0.38 2.92 1.01 0.10 -1.42 121.20 130.19 2ill s ILE 64 Ca 0.04 -0.19 -0.17 0.00 0.00 0.00 0.00 60.65 60.33 2ill s ILE 64 Cb -0.15 -3.19 -0.09 0.00 0.01 0.00 0.00 42.46 39.04 2ill s ILE 64 CO -0.02 0.25 0.83 0.00 0.00 0.00 0.00 174.94 175.99 2ill s ALA 65 N 1.64 3.21 -0.75 9.38 0.00 -0.05 -0.01 121.76 135.18 2ill s ALA 65 Ca 0.06 0.15 -0.07 0.00 0.00 0.00 0.00 51.96 52.09 2ill s ALA 65 Cb -0.16 -2.91 0.01 0.00 0.00 0.00 0.00 23.12 20.06 2ill s ALA 65 CO 0.05 0.20 0.62 -1.13 0.00 0.00 0.00 175.76 175.50 2ill n SER 66 N -0.63 -5.07 -4.69 0.00 3.41 -0.93 -4.71 113.62 101.00 2ill n SER 66 Ca 0.05 -0.78 -0.42 0.00 -0.26 0.00 0.00 58.87 57.45 2ill n SER 66 Cb 0.54 -1.79 -0.03 0.00 -0.26 0.00 0.00 64.21 62.66 2ill n SER 66 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2ill s VAL 67 N -2.71 3.71 0.54 -3.33 -7.23 0.98 -4.57 120.40 107.79 2ill s VAL 67 Ca 0.07 1.11 0.07 0.00 -1.81 0.00 0.00 61.98 61.43 2ill s VAL 67 Cb -0.01 -3.72 0.06 0.00 0.56 0.00 0.00 36.38 33.28 2ill s VAL 67 CO 0.89 0.01 0.74 0.42 -0.31 0.00 0.00 175.10 176.85 2ill s THR 68 N 2.21 2.46 0.10 5.32 -4.23 -1.26 -0.58 115.64 119.66 2ill s THR 68 Ca 0.63 -0.93 0.30 0.00 -1.18 0.00 0.00 61.69 60.51 2ill s THR 68 Cb -0.32 -2.53 0.34 0.00 1.34 0.00 0.00 72.50 71.34 2ill s THR 68 CO 0.27 0.00 1.93 -0.78 -0.54 0.00 0.00 174.62 175.50 2ill h ASP 69 N 0.24 0.00 -0.15 3.99 3.58 -1.96 -0.20 116.42 121.93 2ill h ASP 69 Ca -0.35 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.10 2ill h ASP 69 Cb 1.28 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.33 2ill h ASP 69 CO 0.43 0.07 0.08 -0.78 -2.88 0.00 0.00 179.24 176.16 2ill h ASP 70 N 0.00 0.20 0.95 2.28 3.58 -2.01 -0.21 116.42 121.21 2ill h ASP 70 Ca -0.00 -0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.44 2ill h ASP 70 Cb 0.59 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 41.59 2ill h ASP 70 CO 0.01 0.17 -0.04 0.47 -2.88 0.00 0.00 179.24 176.97 2ill n ASP 71 N -4.48 0.04 -4.56 2.28 8.00 -0.09 -4.63 116.55 113.11 2ill n ASP 71 Ca -0.00 0.42 -0.41 0.00 0.71 0.00 0.00 54.79 55.51 2ill n ASP 71 Cb 0.10 -0.44 -0.03 0.00 -0.02 0.00 0.00 41.12 40.74 2ill n ASP 71 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ill s ALA 72 N -2.99 2.69 0.00 2.24 0.00 -0.09 -4.79 121.76 118.82 2ill s ALA 72 Ca 0.14 -2.07 0.00 0.00 0.00 0.00 0.00 51.96 50.04 2ill s ALA 72 Cb 0.19 -4.48 0.00 0.00 0.00 0.00 0.00 23.12 18.83 2ill s ALA 72 CO 0.54 -3.59 0.00 -2.37 0.00 0.00 0.00 175.76 170.34 2ill n THR 73 N 6.82 0.00 -3.29 0.00 5.66 -0.79 -4.93 114.28 117.75 2ill n THR 73 Ca 0.27 0.00 -0.38 0.00 -3.05 0.00 0.00 64.05 60.89 2ill n THR 73 Cb 0.51 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.23 2ill n THR 73 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 2ill s VAL 74 N -2.95 5.06 0.02 1.08 0.11 -1.26 -0.99 120.40 121.47 2ill s VAL 74 Ca 0.00 1.06 0.09 0.00 -2.93 0.00 0.00 61.98 60.20 2ill s VAL 74 Cb 0.00 -3.85 -0.02 0.00 -1.53 0.00 0.00 36.38 30.97 2ill s VAL 74 CO 0.00 0.39 -0.26 -0.31 -3.33 0.00 0.00 175.10 171.60 2ill s TYR 75 N 0.08 2.27 0.06 1.54 1.51 0.16 -0.81 117.35 122.15 2ill s TYR 75 Ca 0.28 -0.42 0.09 0.00 -1.01 0.00 0.00 57.07 56.01 2ill s TYR 75 Cb -0.17 -1.40 -0.03 0.00 -0.11 0.00 0.00 41.96 40.26 2ill s TYR 75 CO 0.13 0.06 -0.23 -0.65 -1.11 0.00 0.00 175.55 173.75 2ill s GLN 76 N -0.98 1.83 -0.07 -0.62 1.11 -0.49 -1.33 119.66 119.11 2ill s GLN 76 Ca 0.11 -1.11 0.03 0.00 0.01 0.00 0.00 55.36 54.40 2ill s GLN 76 Cb -0.10 -2.04 0.00 0.00 -1.01 0.00 0.00 33.01 29.86 2ill s GLN 76 CO 0.01 0.51 -0.17 0.54 0.01 0.00 0.00 175.29 176.19 2ill s VAL 77 N -0.90 1.51 -0.05 1.09 0.11 0.33 -0.70 120.40 121.80 2ill s VAL 77 Ca 0.13 -0.72 0.07 0.00 -2.93 0.00 0.00 61.98 58.53 2ill s VAL 77 Cb -0.10 -1.33 -0.01 0.00 -1.53 0.00 0.00 36.38 33.41 2ill s VAL 77 CO 0.04 0.44 -0.25 -0.60 -3.33 0.00 0.00 175.10 171.39 2ill s ARG 78 N 0.39 2.43 -0.12 1.54 3.52 0.52 -0.21 118.95 127.02 2ill s ARG 78 Ca -0.13 -0.91 0.03 0.00 -0.13 0.00 0.00 55.73 54.59 2ill s ARG 78 Cb -0.15 -2.13 0.00 0.00 -1.56 0.00 0.00 34.95 31.11 2ill s ARG 78 CO 0.05 0.43 -0.22 0.00 -0.81 0.00 0.00 175.30 174.75 2ill s ALA 79 N -0.29 2.23 -0.03 6.12 0.00 0.03 -1.30 121.76 128.52 2ill s ALA 79 Ca 0.00 -1.02 0.01 0.00 0.00 0.00 0.00 51.96 50.96 2ill s ALA 79 Cb -0.13 -0.92 0.02 0.00 0.00 0.00 0.00 23.12 22.09 2ill s ALA 79 CO 0.02 0.15 -0.05 0.99 0.00 0.00 0.00 175.76 176.88 2ill s THR 80 N 0.54 0.51 0.26 0.00 2.01 -0.18 -1.78 115.64 117.01 2ill s THR 80 Ca -0.13 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 61.76 2ill s THR 80 Cb -0.17 -0.52 -0.02 0.00 0.01 0.00 0.00 72.50 71.80 2ill s THR 80 CO 0.04 0.20 0.16 -0.46 -0.69 0.00 0.00 174.62 173.88 2ill n ASN 81 N 3.81 0.21 0.29 3.53 0.23 0.30 -1.27 115.26 122.36 2ill n ASN 81 Ca -0.23 -2.58 0.18 0.00 -0.53 0.00 0.00 54.58 51.41 2ill n ASN 81 Cb 0.52 1.01 0.79 0.00 -2.08 0.00 0.00 39.78 40.02 2ill n ASN 81 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2ill h GLN 82 N 0.00 0.00 0.00 -3.83 1.08 -1.93 -1.51 115.11 108.92 2ill h GLN 82 Ca -0.20 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.00 2ill h GLN 82 Cb 0.87 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.30 2ill h GLN 82 CO 0.30 0.01 0.00 0.41 -0.95 0.00 0.00 178.83 178.60 2ill n GLY 83 N -0.21 -1.41 0.00 3.46 0.00 -1.26 -5.02 105.19 100.75 2ill n GLY 83 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.91 2ill n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ill n GLY 84 N 1.35 -0.39 3.12 -0.02 0.00 -0.57 -4.68 105.19 104.00 2ill n GLY 84 Ca 0.09 -1.43 -0.12 0.00 0.00 0.00 0.00 46.02 44.55 2ill n GLY 84 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2ill s SER 85 N 0.00 -0.28 0.01 1.61 0.15 -1.26 -0.54 113.70 113.39 2ill s SER 85 Ca 0.00 0.54 -0.04 0.00 0.70 0.00 0.00 55.95 57.15 2ill s SER 85 Cb 0.00 0.50 -0.01 0.00 -1.71 0.00 0.00 66.02 64.80 2ill s SER 85 CO 0.00 -0.12 0.06 0.54 1.20 0.00 0.00 173.24 174.92 2ill s VAL 86 N 0.59 0.10 0.22 4.45 0.11 -0.73 -4.99 120.40 120.14 2ill s VAL 86 Ca -0.04 -0.81 0.11 0.00 -2.93 0.00 0.00 61.98 58.31 2ill s VAL 86 Cb -0.05 -0.37 -0.05 0.00 -1.53 0.00 0.00 36.38 34.38 2ill s VAL 86 CO -0.03 -0.44 -0.20 -0.94 -3.33 0.00 0.00 175.10 170.15 2ill s SER 87 N -1.45 3.22 0.28 3.54 1.04 -1.26 -0.79 113.70 118.29 2ill s SER 87 Ca -0.15 -0.93 0.11 0.00 0.48 0.00 0.00 55.95 55.46 2ill s SER 87 Cb -0.08 -0.23 -0.05 0.00 0.10 0.00 0.00 66.02 65.75 2ill s SER 87 CO 0.00 0.03 -0.18 -0.83 0.98 0.00 0.00 173.24 173.24 2ill s GLY 88 N -3.00 1.91 0.02 7.32 0.00 0.71 -4.96 107.32 109.31 2ill s GLY 88 Ca 0.23 -1.90 0.00 0.00 0.00 0.00 0.00 44.72 43.05 2ill s GLY 88 CO 0.10 -1.96 -0.03 -1.08 0.00 0.00 0.00 173.10 170.13 2ill s THR 89 N -2.56 0.16 0.07 0.90 -1.32 -1.26 -0.51 115.64 111.12 2ill s THR 89 Ca 0.30 -0.74 -0.09 0.00 -1.21 0.00 0.00 61.69 59.95 2ill s THR 89 Cb -0.04 -0.26 -0.00 0.00 -1.51 0.00 0.00 72.50 70.69 2ill s THR 89 CO 0.15 -0.37 0.19 0.00 -2.21 0.00 0.00 174.62 172.37 2ill s ALA 90 N -1.14 -0.25 -0.02 11.08 0.00 -0.44 -4.78 121.76 126.21 2ill s ALA 90 Ca -0.12 -0.54 0.01 0.00 0.00 0.00 0.00 51.96 51.31 2ill s ALA 90 Cb -0.08 0.43 -0.04 0.00 0.00 0.00 0.00 23.12 23.43 2ill s ALA 90 CO -0.01 -0.47 0.00 -1.54 0.00 0.00 0.00 175.76 173.75 2ill s SER 91 N -2.65 5.17 -0.17 0.00 1.04 -1.26 0.36 113.70 116.18 2ill s SER 91 Ca 0.02 0.03 -0.03 0.00 0.48 0.00 0.00 55.95 56.45 2ill s SER 91 Cb 0.03 -1.38 -0.02 0.00 0.10 0.00 0.00 66.02 64.76 2ill s SER 91 CO -0.09 0.30 -0.05 -0.22 0.98 0.00 0.00 173.24 174.16 2ill s LEU 92 N -1.42 3.06 -0.12 2.42 2.96 -0.16 -0.13 118.68 125.29 2ill s LEU 92 Ca 0.18 -0.24 0.01 0.00 -0.22 0.00 0.00 54.13 53.86 2ill s LEU 92 Cb -0.11 -1.75 -0.01 0.00 0.50 0.00 0.00 46.19 44.82 2ill s LEU 92 CO 0.09 0.11 -0.16 -1.61 -1.32 0.00 0.00 176.35 173.45 2ill s GLU 93 N 0.73 3.24 -0.24 1.98 2.02 -0.28 -1.88 118.70 124.27 2ill s GLU 93 Ca -0.02 -0.74 -0.06 0.00 0.02 0.00 0.00 54.97 54.16 2ill s GLU 93 Cb -0.15 -2.52 -0.02 0.00 0.10 0.00 0.00 34.13 31.55 2ill s GLU 93 CO 0.02 0.22 0.03 0.08 0.02 0.00 0.00 175.26 175.64 2ill s VAL 94 N 0.29 3.96 -0.22 2.63 1.01 -1.26 -1.10 120.40 125.71 2ill s VAL 94 Ca -0.12 -0.32 -0.25 0.00 0.00 0.00 0.00 61.98 61.29 2ill s VAL 94 Cb -0.16 -2.85 -0.01 0.00 0.00 0.00 0.00 36.38 33.36 2ill s VAL 94 CO 0.06 0.35 0.85 -1.61 0.00 0.00 0.00 175.10 174.75 2ill s GLU 95 N 1.56 4.22 -0.21 2.72 2.02 0.22 -4.76 118.70 124.47 2ill s GLU 95 Ca 0.06 1.00 0.00 0.00 0.02 0.00 0.00 54.97 56.05 2ill s GLU 95 Cb -0.15 -3.62 0.03 0.00 0.10 0.00 0.00 34.13 30.48 2ill s GLU 95 CO 0.01 -0.47 -0.14 0.08 0.02 0.00 0.00 175.26 174.76 2ill s VAL 96 N 2.66 2.38 0.40 2.63 1.01 -1.14 -2.00 120.40 126.35 2ill s VAL 96 Ca 0.37 -1.04 -0.25 0.00 0.00 0.00 0.00 61.98 61.05 2ill s VAL 96 Cb -0.16 -2.13 -0.11 0.00 0.00 0.00 0.00 36.38 33.99 2ill s VAL 96 CO 0.09 0.35 1.12 -2.65 0.00 0.00 0.00 175.10 174.01 2ill n PRO 97 N 4.61 1.60 -1.83 2.72 -0.02 -1.26 0.29 135.00 141.12 2ill n PRO 97 Ca -0.18 0.57 -0.41 0.00 -2.02 0.00 0.00 63.50 61.45 2ill n PRO 97 Cb 0.48 -2.16 -0.01 0.00 -0.02 0.00 0.00 33.50 31.78 2ill n PRO 97 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2ill s ALA 98 N -1.22 3.68 -0.21 3.55 0.00 -1.26 -4.07 121.76 122.24 2ill s ALA 98 Ca 0.62 1.53 -0.18 0.00 0.00 0.00 0.00 51.96 53.93 2ill s ALA 98 Cb -0.55 -3.62 0.06 0.00 0.00 0.00 0.00 23.12 19.00 2ill s ALA 98 CO 0.58 -0.96 0.55 0.21 0.00 0.00 0.00 175.76 176.14 2ill s LYS 99 N -0.90 0.62 -0.17 0.00 2.47 0.11 -4.16 119.74 117.71 2ill s LYS 99 Ca 0.60 0.80 -0.12 0.00 -1.56 0.00 0.00 55.97 55.69 2ill s LYS 99 Cb -0.46 0.27 -0.05 0.00 -1.46 0.00 0.00 37.83 36.13 2ill s LYS 99 CO 0.51 -0.09 0.22 0.42 0.16 0.00 0.00 175.35 176.57 2ill s ILE 100 N 0.50 5.35 -0.56 5.43 -1.09 -1.26 0.08 121.20 129.65 2ill s ILE 100 Ca -0.02 0.40 0.04 0.00 -2.23 0.00 0.00 60.65 58.84 2ill s ILE 100 Cb -0.04 -3.56 0.14 0.00 -1.58 0.00 0.00 42.46 37.42 2ill s ILE 100 CO -0.02 0.43 0.32 -1.00 -1.23 0.00 0.00 174.94 173.44 2ill s HIS 101 N 0.26 3.28 -0.17 3.97 3.76 -0.57 -4.99 115.29 120.83 2ill s HIS 101 Ca 0.13 -3.22 -0.29 0.00 -0.15 0.00 0.00 55.06 51.54 2ill s HIS 101 Cb -0.12 -2.79 -0.04 0.00 1.11 0.00 0.00 32.58 30.73 2ill s HIS 101 CO 0.02 -0.69 1.84 -0.51 -0.85 0.00 0.00 174.74 174.54 2ill s LEU 102 N -0.58 3.89 0.21 0.89 1.43 -1.26 -3.87 118.68 119.39 2ill s LEU 102 Ca 0.19 1.90 -0.09 0.00 -1.03 0.00 0.00 54.13 55.10 2ill s LEU 102 Cb -0.21 -3.53 0.27 0.00 0.03 0.00 0.00 46.19 42.75 2ill s LEU 102 CO -0.04 -1.39 1.78 -0.65 0.23 0.00 0.00 176.35 176.28 2ill h PRO 103 N 11.78 0.54 -4.03 1.29 0.11 -1.95 -3.44 132.00 136.31 2ill h PRO 103 Ca -0.39 -0.03 -0.31 0.00 0.11 0.00 0.00 66.00 65.38 2ill h PRO 103 Cb 1.19 -0.12 -0.30 0.00 0.11 0.00 0.00 31.00 31.88 2ill h PRO 103 CO 0.98 0.36 -0.74 0.15 -0.21 0.00 0.00 178.00 178.53 2ill s LYS 104 N -6.09 0.31 0.05 1.05 1.02 -1.26 -5.15 119.74 109.67 2ill s LYS 104 Ca -0.13 -0.08 0.06 0.00 0.02 0.00 0.00 55.97 55.84 2ill s LYS 104 Cb 0.17 -0.34 -0.03 0.00 -0.52 0.00 0.00 37.83 37.11 2ill s LYS 104 CO 0.75 0.03 -0.17 0.95 -0.92 0.00 0.00 175.35 175.99 2ill s THR 105 N 0.18 1.38 -0.09 2.17 -4.23 -1.26 -4.46 115.64 109.33 2ill s THR 105 Ca -0.02 -1.17 0.03 0.00 -1.18 0.00 0.00 61.69 59.35 2ill s THR 105 Cb -0.04 -1.23 0.01 0.00 1.34 0.00 0.00 72.50 72.57 2ill s THR 105 CO -0.00 0.04 -0.18 -0.22 -0.54 0.00 0.00 174.62 173.71 2ill s LEU 106 N -1.32 1.87 -1.31 4.79 2.96 0.09 -4.79 118.68 120.97 2ill s LEU 106 Ca 0.04 -0.45 -0.11 0.00 -0.22 0.00 0.00 54.13 53.39 2ill s LEU 106 Cb -0.09 -1.15 0.09 0.00 0.50 0.00 0.00 46.19 45.54 2ill s LEU 106 CO 0.02 0.09 0.51 -0.62 -1.32 0.00 0.00 176.35 175.03 2ill n GLU 107 N 3.76 -3.22 0.00 1.98 1.02 -1.26 -2.17 120.64 120.75 2ill n GLU 107 Ca -0.20 0.42 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 2ill n GLU 107 Cb 0.52 -5.12 0.00 0.00 -0.02 0.00 0.00 31.44 26.82 2ill n GLU 107 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2ill n GLY 108 N -1.17 1.56 3.26 0.62 0.00 -1.26 -5.04 105.19 103.16 2ill n GLY 108 Ca 0.01 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 2ill n GLY 108 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2ill s MET 109 N -0.08 1.58 0.75 1.61 -1.94 -0.92 -5.01 119.30 115.28 2ill s MET 109 Ca 0.00 -1.89 -0.11 0.00 -1.71 0.00 0.00 55.69 51.98 2ill s MET 109 Cb 0.00 0.30 0.04 0.00 2.01 0.00 0.00 34.83 37.18 2ill s MET 109 CO 0.00 -0.56 1.08 0.20 -0.01 0.00 0.00 175.02 175.73 2ill s GLY 110 N -3.31 1.64 -0.16 -0.03 0.00 -0.32 -0.73 107.32 104.42 2ill s GLY 110 Ca 0.40 -0.12 -0.09 0.00 0.00 0.00 0.00 44.72 44.91 2ill s GLY 110 CO 0.22 0.26 0.38 0.00 0.00 0.00 0.00 173.10 173.97 2ill s ALA 111 N -3.14 -0.96 -0.05 3.20 0.00 -1.26 0.34 121.76 119.90 2ill s ALA 111 Ca 0.60 1.38 0.02 0.00 0.00 0.00 0.00 51.96 53.95 2ill s ALA 111 Cb -0.14 -0.83 0.02 0.00 0.00 0.00 0.00 23.12 22.16 2ill s ALA 111 CO 0.54 -0.24 -0.07 0.08 0.00 0.00 0.00 175.76 176.07 2ill s VAL 112 N 1.17 0.74 -0.20 0.00 1.01 -0.18 -4.93 120.40 118.02 2ill s VAL 112 Ca -0.08 -0.25 -0.05 0.00 0.00 0.00 0.00 61.98 61.60 2ill s VAL 112 Cb -0.08 -0.72 -0.02 0.00 0.00 0.00 0.00 36.38 35.57 2ill s VAL 112 CO -0.10 0.27 -0.02 -1.00 0.00 0.00 0.00 175.10 174.25 2ill s HIS 113 N 0.77 3.01 0.13 5.22 0.09 -1.26 -0.97 115.29 122.27 2ill s HIS 113 Ca -0.12 -0.54 0.04 0.00 -0.00 0.00 0.00 55.06 54.44 2ill s HIS 113 Cb -0.15 -2.07 -0.04 0.00 -0.00 0.00 0.00 32.58 30.32 2ill s HIS 113 CO 0.01 -0.28 -0.10 0.00 -0.00 0.00 0.00 174.74 174.37 2ill s ALA 114 N 1.02 1.31 0.08 -1.40 0.00 -0.12 -4.98 121.76 117.66 2ill s ALA 114 Ca 0.01 -1.39 0.01 0.00 0.00 0.00 0.00 51.96 50.60 2ill s ALA 114 Cb -0.14 0.05 -0.04 0.00 0.00 0.00 0.00 23.12 22.99 2ill s ALA 114 CO 0.01 -0.09 0.18 -0.51 0.00 0.00 0.00 175.76 175.35 2ill s LEU 115 N -2.93 4.20 0.20 0.00 1.43 -1.26 0.15 118.68 120.47 2ill s LEU 115 Ca 0.13 0.18 -0.32 0.00 -1.03 0.00 0.00 54.13 53.08 2ill s LEU 115 Cb 0.01 -2.82 -0.14 0.00 0.03 0.00 0.00 46.19 43.27 2ill s LEU 115 CO -0.00 0.16 1.32 0.54 0.23 0.00 0.00 176.35 178.60 2ill n ARG 116 N 0.25 1.65 -0.92 1.70 1.74 -0.95 -1.55 116.66 118.58 2ill n ARG 116 Ca -0.06 0.59 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 2ill n ARG 116 Cb 0.51 -2.19 0.00 0.00 -1.02 0.00 0.00 32.46 29.76 2ill n ARG 116 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2ill n GLY 117 N 2.21 0.87 3.77 -0.13 0.00 0.55 -4.91 105.19 107.54 2ill n GLY 117 Ca 0.14 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.76 2ill n GLY 117 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2ill s GLU 118 N -0.08 4.66 -0.88 1.61 2.12 -0.60 -4.32 118.70 121.21 2ill s GLU 118 Ca 0.00 1.27 -0.22 0.00 0.36 0.00 0.00 54.97 56.38 2ill s GLU 118 Cb 0.00 -3.26 0.09 0.00 0.26 0.00 0.00 34.13 31.21 2ill s GLU 118 CO 0.00 0.55 1.20 0.08 -0.54 0.00 0.00 175.26 176.56 2ill s VAL 119 N -1.16 4.32 0.20 3.70 1.01 -1.26 -0.75 120.40 126.45 2ill s VAL 119 Ca 0.38 -0.91 -0.25 0.00 0.00 0.00 0.00 61.98 61.20 2ill s VAL 119 Cb -0.24 -4.86 -0.08 0.00 0.00 0.00 0.00 36.38 31.20 2ill s VAL 119 CO 0.28 -1.66 0.80 -0.69 0.00 0.00 0.00 175.10 173.83 2ill s VAL 120 N 3.92 4.36 -0.13 2.92 1.01 -1.26 -4.89 120.40 126.34 2ill s VAL 120 Ca 0.35 1.67 0.02 0.00 0.00 0.00 0.00 61.98 64.02 2ill s VAL 120 Cb -0.06 -4.09 0.01 0.00 0.00 0.00 0.00 36.38 32.24 2ill s VAL 120 CO -0.03 0.43 -0.21 -0.44 0.00 0.00 0.00 175.10 174.85 2ill s SER 121 N -1.29 2.97 -0.53 3.32 0.01 -1.26 -1.27 113.70 115.65 2ill s SER 121 Ca 0.39 -0.57 -0.18 0.00 1.31 0.00 0.00 55.95 56.90 2ill s SER 121 Cb -0.22 -1.37 0.09 0.00 0.21 0.00 0.00 66.02 64.73 2ill s SER 121 CO 0.25 0.07 0.58 -0.63 0.41 0.00 0.00 173.24 173.93 2ill s ILE 122 N 0.81 4.99 -0.26 1.44 1.01 0.68 -4.93 121.20 124.94 2ill s ILE 122 Ca -0.08 -0.94 -0.10 0.00 0.00 0.00 0.00 60.65 59.53 2ill s ILE 122 Cb -0.16 -4.33 -0.04 0.00 0.01 0.00 0.00 42.46 37.94 2ill s ILE 122 CO -0.01 -0.87 0.14 -0.75 0.00 0.00 0.00 174.94 173.45 2ill s LYS 123 N 2.27 3.89 -0.25 2.79 2.20 -1.26 -1.38 119.74 128.01 2ill s LYS 123 Ca 0.10 -0.36 -0.01 0.00 -0.36 0.00 0.00 55.97 55.34 2ill s LYS 123 Cb -0.24 -3.52 0.07 0.00 -1.51 0.00 0.00 37.83 32.63 2ill s LYS 123 CO 0.07 -0.12 0.02 0.42 -0.36 0.00 0.00 175.35 175.38 2ill s ILE 124 N 1.53 1.09 0.47 5.43 -1.09 0.12 -4.91 121.20 123.84 2ill s ILE 124 Ca 0.07 -1.11 -0.24 0.00 -2.23 0.00 0.00 60.65 57.13 2ill s ILE 124 Cb -0.15 -1.57 -0.07 0.00 -1.58 0.00 0.00 42.46 39.09 2ill s ILE 124 CO 0.07 -0.30 1.28 -2.84 -1.23 0.00 0.00 174.94 171.93 2ill s PRO 125 N 1.57 3.65 0.16 2.79 0.02 -1.25 -1.20 135.00 140.74 2ill s PRO 125 Ca 0.00 2.08 -0.03 0.00 0.02 0.00 0.00 61.00 63.07 2ill s PRO 125 Cb -0.18 -2.50 -0.03 0.00 0.02 0.00 0.00 34.50 31.81 2ill s PRO 125 CO -0.11 -0.73 0.13 -0.59 -0.33 0.00 0.00 177.00 175.37 2ill s PHE 126 N -1.36 0.85 0.20 6.54 -0.12 -0.48 -1.51 117.98 122.09 2ill s PHE 126 Ca 0.63 -1.17 0.08 0.00 -0.05 0.00 0.00 56.93 56.42 2ill s PHE 126 Cb -0.36 -0.40 -0.05 0.00 -0.63 0.00 0.00 43.02 41.58 2ill s PHE 126 CO 0.45 -0.61 -0.15 -1.54 -0.05 0.00 0.00 175.22 173.32 2ill s SER 127 N -3.06 2.57 0.00 1.98 1.04 0.11 -4.68 113.70 111.65 2ill s SER 127 Ca 0.27 -0.99 0.00 0.00 0.48 0.00 0.00 55.95 55.71 2ill s SER 127 Cb 0.06 -0.14 0.00 0.00 0.10 0.00 0.00 66.02 66.05 2ill s SER 127 CO 0.05 -0.15 0.00 0.61 0.98 0.00 0.00 173.24 174.72 2ill n GLY 128 N -0.27 3.73 2.68 7.32 0.00 -1.26 0.06 105.19 117.45 2ill n GLY 128 Ca -0.09 -0.20 -0.21 0.00 0.00 0.00 0.00 46.02 45.51 2ill n GLY 128 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ill s LYS 129 N -1.11 0.00 0.64 1.61 -0.14 0.15 -3.27 119.74 117.61 2ill s LYS 129 Ca 0.00 0.24 -0.17 0.00 -1.36 0.00 0.00 55.97 54.68 2ill s LYS 129 Cb 0.00 -0.96 -0.04 0.00 -1.68 0.00 0.00 37.83 35.15 2ill s LYS 129 CO 0.00 -0.46 0.91 -2.30 -0.76 0.00 0.00 175.35 172.74 2ill n PRO 130 N 5.30 0.73 -1.57 -1.68 -0.02 -1.26 -2.90 135.00 133.60 2ill n PRO 130 Ca -0.05 0.29 -0.53 0.00 -2.02 0.00 0.00 63.50 61.20 2ill n PRO 130 Cb 0.50 -2.13 -0.06 0.00 -0.02 0.00 0.00 33.50 31.79 2ill n PRO 130 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2ill n ASP 131 N -0.90 1.26 -4.89 2.55 8.00 -1.20 -4.81 116.55 116.57 2ill n ASP 131 Ca 0.13 1.13 -0.29 0.00 0.71 0.00 0.00 54.79 56.47 2ill n ASP 131 Cb 0.48 -1.15 0.02 0.00 -0.02 0.00 0.00 41.12 40.45 2ill n ASP 131 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2ill s PRO 132 N 0.22 3.38 0.14 -0.24 0.04 -1.26 -4.89 135.00 132.39 2ill s PRO 132 Ca 0.83 0.47 -0.29 0.00 0.04 0.00 0.00 61.00 62.05 2ill s PRO 132 Cb -0.99 -2.17 -0.07 0.00 0.04 0.00 0.00 34.50 31.31 2ill s PRO 132 CO 0.50 -0.57 0.91 0.08 0.04 0.00 0.00 177.00 177.95 2ill s VAL 133 N -3.07 4.42 -0.11 -0.36 1.01 -0.27 -4.84 120.40 117.18 2ill s VAL 133 Ca 0.53 1.97 0.00 0.00 0.00 0.00 0.00 61.98 64.49 2ill s VAL 133 Cb -0.11 -4.27 -0.02 0.00 0.00 0.00 0.00 36.38 31.98 2ill s VAL 133 CO 0.50 0.39 -0.12 -0.63 0.00 0.00 0.00 175.10 175.24 2ill s ILE 134 N -0.42 3.20 0.05 2.22 -1.09 -1.26 -1.66 121.20 122.25 2ill s ILE 134 Ca 0.43 -0.63 0.04 0.00 -2.23 0.00 0.00 60.65 58.26 2ill s ILE 134 Cb -0.24 -2.33 -0.03 0.00 -1.58 0.00 0.00 42.46 38.29 2ill s ILE 134 CO 0.29 0.54 -0.11 0.42 -1.23 0.00 0.00 174.94 174.86 2ill s THR 135 N -0.01 0.81 0.06 2.92 -4.23 -0.43 -4.99 115.64 109.77 2ill s THR 135 Ca -0.03 -1.13 0.09 0.00 -1.18 0.00 0.00 61.69 59.44 2ill s THR 135 Cb -0.14 -0.82 -0.03 0.00 1.34 0.00 0.00 72.50 72.85 2ill s THR 135 CO 0.04 -0.27 -0.26 0.26 -0.54 0.00 0.00 174.62 173.85 2ill s TRP 136 N -1.25 2.24 0.05 3.99 0.52 -1.26 -0.01 118.94 123.23 2ill s TRP 136 Ca -0.05 -0.40 -0.03 0.00 0.02 0.00 0.00 56.10 55.64 2ill s TRP 136 Cb -0.10 -1.31 -0.03 0.00 -1.15 0.00 0.00 33.47 30.88 2ill s TRP 136 CO 0.01 0.17 0.02 -0.65 0.02 0.00 0.00 176.95 176.52 2ill s GLN 137 N -1.42 0.63 -0.17 4.98 -0.21 0.08 -0.88 119.66 122.68 2ill s GLN 137 Ca 0.12 -1.08 0.01 0.00 0.02 0.00 0.00 55.36 54.43 2ill s GLN 137 Cb -0.10 0.23 0.01 0.00 1.00 0.00 0.00 33.01 34.15 2ill s GLN 137 CO 0.03 -0.14 -0.20 0.21 -2.12 0.00 0.00 175.29 173.07 2ill s LYS 138 N -3.59 3.03 0.00 2.91 2.20 -0.13 -1.44 119.74 122.73 2ill s LYS 138 Ca 0.04 -0.82 0.00 0.00 -0.36 0.00 0.00 55.97 54.82 2ill s LYS 138 Cb 0.05 -2.55 0.00 0.00 -1.51 0.00 0.00 37.83 33.82 2ill s LYS 138 CO -0.09 -0.14 0.00 0.41 -0.36 0.00 0.00 175.35 175.17 2ill n GLY 139 N 4.43 0.61 2.28 5.54 0.00 -0.26 -1.38 105.19 116.41 2ill n GLY 139 Ca -0.20 0.79 -0.24 0.00 0.00 0.00 0.00 46.02 46.36 2ill n GLY 139 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ill n GLN 140 N 0.00 0.54 -3.72 1.61 6.02 -1.26 -4.67 117.38 115.91 2ill n GLN 140 Ca 0.00 -3.13 -0.18 0.00 -0.01 0.00 0.00 57.00 53.67 2ill n GLN 140 Cb 0.00 -1.37 -0.17 0.00 1.02 0.00 0.00 30.24 29.72 2ill n GLN 140 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2ill s ASP 141 N -0.78 0.79 0.60 1.08 1.11 -0.48 -5.16 116.67 113.83 2ill s ASP 141 Ca 0.34 0.05 -0.19 0.00 0.18 0.00 0.00 52.55 52.94 2ill s ASP 141 Cb 0.13 -0.14 -0.03 0.00 1.07 0.00 0.00 42.92 43.95 2ill s ASP 141 CO -0.14 -0.20 1.22 -0.76 1.18 0.00 0.00 175.17 176.46 2ill s LEU 142 N 1.76 3.66 -0.13 1.23 1.02 -1.26 -0.96 118.68 124.00 2ill s LEU 142 Ca -0.00 2.41 0.00 0.00 0.02 0.00 0.00 54.13 56.56 2ill s LEU 142 Cb -0.12 -4.60 -0.01 0.00 0.02 0.00 0.00 46.19 41.47 2ill s LEU 142 CO -0.03 -1.63 -0.14 -0.63 0.02 0.00 0.00 176.35 173.94 2ill s ILE 143 N -1.58 2.90 0.53 -0.59 1.01 -0.06 -4.83 121.20 118.58 2ill s ILE 143 Ca 0.78 -0.71 0.03 0.00 0.00 0.00 0.00 60.65 60.75 2ill s ILE 143 Cb -0.31 -2.21 0.02 0.00 0.01 0.00 0.00 42.46 39.96 2ill s ILE 143 CO 0.34 0.52 0.22 -1.81 0.00 0.00 0.00 174.94 174.21 2ill s ASP 144 N 0.46 4.40 -0.02 3.58 1.01 -1.26 -4.40 116.67 120.44 2ill s ASP 144 Ca -0.10 -1.44 -0.30 0.00 0.71 0.00 0.00 52.55 51.42 2ill s ASP 144 Cb -0.16 0.47 -0.06 0.00 1.01 0.00 0.00 42.92 44.18 2ill s ASP 144 CO 0.05 -0.99 1.68 0.20 0.21 0.00 0.00 175.17 176.31 2ill s ASN 145 N -4.10 6.64 0.00 0.27 0.01 -1.26 -4.75 114.94 111.75 2ill s ASN 145 Ca 0.21 2.33 0.00 0.00 -0.71 0.00 0.00 52.86 54.68 2ill s ASN 145 Cb -0.01 -2.54 0.00 0.00 0.41 0.00 0.00 41.25 39.11 2ill s ASN 145 CO 0.13 -0.92 0.00 -0.46 -1.51 0.00 0.00 177.10 174.33 2ill n ASN 146 N 6.80 0.00 -0.28 -1.22 0.23 -1.20 -5.03 115.26 114.56 2ill n ASN 146 Ca 0.17 0.00 0.14 0.00 -0.53 0.00 0.00 54.58 54.36 2ill n ASN 146 Cb 0.42 0.00 0.53 0.00 -2.08 0.00 0.00 39.78 38.65 2ill n ASN 146 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2ill n GLY 147 N 2.98 -0.49 0.55 4.83 0.00 -1.26 -4.28 105.19 107.51 2ill n GLY 147 Ca 0.00 -0.37 -0.09 0.00 0.00 0.00 0.00 46.02 45.56 2ill n GLY 147 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2ill n HIS 148 N -0.44 0.00 -4.15 1.61 -0.00 -1.26 -4.96 115.22 106.02 2ill n HIS 148 Ca 0.16 0.00 -0.28 0.00 -0.00 0.00 0.00 57.72 57.60 2ill n HIS 148 Cb 0.32 -0.32 -0.08 0.00 -0.00 0.00 0.00 29.99 29.91 2ill n HIS 148 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.34 177.05 2ill s TYR 149 N -2.16 2.96 -0.08 1.57 1.51 -1.26 -4.25 117.35 115.63 2ill s TYR 149 Ca -0.12 -0.06 0.01 0.00 -1.01 0.00 0.00 57.07 55.89 2ill s TYR 149 Cb 0.04 -1.48 0.02 0.00 -0.11 0.00 0.00 41.96 40.43 2ill s TYR 149 CO 0.17 0.50 -0.10 -1.14 -1.11 0.00 0.00 175.55 173.86 2ill s GLN 150 N -2.63 1.63 -0.23 -0.62 2.00 -0.50 -3.24 119.66 116.07 2ill s GLN 150 Ca 0.27 -0.35 -0.12 0.00 -2.00 0.00 0.00 55.36 53.16 2ill s GLN 150 Cb -0.11 -1.48 -0.05 0.00 0.80 0.00 0.00 33.01 32.18 2ill s GLN 150 CO 0.19 -0.09 0.25 0.08 -0.50 0.00 0.00 175.29 175.21 2ill s VAL 151 N 1.08 5.30 -0.18 1.34 1.01 -1.26 -0.50 120.40 127.19 2ill s VAL 151 Ca -0.07 0.37 -0.09 0.00 0.00 0.00 0.00 61.98 62.20 2ill s VAL 151 Cb -0.14 -3.58 -0.05 0.00 0.00 0.00 0.00 36.38 32.61 2ill s VAL 151 CO -0.01 0.31 0.11 -0.63 0.00 0.00 0.00 175.10 174.87 2ill s ILE 152 N 1.19 5.21 -0.15 2.22 1.01 0.06 -4.98 121.20 125.75 2ill s ILE 152 Ca 0.12 0.11 -0.01 0.00 0.00 0.00 0.00 60.65 60.87 2ill s ILE 152 Cb -0.14 -3.35 0.04 0.00 0.01 0.00 0.00 42.46 39.02 2ill s ILE 152 CO 0.06 0.47 -0.02 -0.69 0.00 0.00 0.00 174.94 174.76 2ill s VAL 153 N 0.15 0.83 0.21 2.92 1.01 -1.26 -0.63 120.40 123.63 2ill s VAL 153 Ca 0.08 -0.43 0.02 0.00 0.00 0.00 0.00 61.98 61.64 2ill s VAL 153 Cb -0.12 -1.06 0.02 0.00 0.00 0.00 0.00 36.38 35.22 2ill s VAL 153 CO -0.01 0.11 0.14 0.35 0.00 0.00 0.00 175.10 175.69 2ill n THR 154 N 4.97 0.00 0.11 3.92 -2.24 -0.42 -5.02 114.28 115.60 2ill n THR 154 Ca -0.10 -0.84 0.05 0.00 -2.27 0.00 0.00 64.05 60.89 2ill n THR 154 Cb 0.48 -0.27 0.51 0.00 -2.10 0.00 0.00 70.33 68.95 2ill n THR 154 CO 0.00 0.00 0.00 0.03 -0.57 0.00 0.00 175.07 174.53 2ill h ARG 155 N 0.00 0.32 0.00 -0.78 3.08 -2.01 -3.36 114.38 111.63 2ill h ARG 155 Ca -0.14 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.89 2ill h ARG 155 Cb 0.49 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.47 2ill h ARG 155 CO 0.22 0.22 0.00 -1.13 -1.07 0.00 0.00 179.97 178.20 2ill n SER 156 N -4.49 0.16 -3.99 7.04 3.41 -1.26 -4.98 113.62 109.51 2ill n SER 156 Ca 0.01 -0.49 -0.09 0.00 -0.26 0.00 0.00 58.87 58.03 2ill n SER 156 Cb 0.08 0.53 -0.08 0.00 -0.26 0.00 0.00 64.21 64.49 2ill n SER 156 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 2ill s PHE 157 N -0.53 0.47 0.03 7.33 -0.12 -1.26 -1.39 117.98 122.51 2ill s PHE 157 Ca 0.00 -0.84 0.07 0.00 -0.05 0.00 0.00 56.93 56.11 2ill s PHE 157 Cb 0.00 -0.15 -0.02 0.00 -0.63 0.00 0.00 43.02 42.21 2ill s PHE 157 CO 0.00 -0.65 -0.21 -0.08 -0.05 0.00 0.00 175.22 174.24 2ill s THR 158 N -3.97 1.65 -0.06 -4.49 -1.32 -0.34 -1.30 115.64 105.82 2ill s THR 158 Ca 0.17 -1.15 0.03 0.00 -1.21 0.00 0.00 61.69 59.53 2ill s THR 158 Cb 0.04 -1.43 0.00 0.00 -1.51 0.00 0.00 72.50 69.61 2ill s THR 158 CO -0.01 0.24 -0.16 -0.44 -2.21 0.00 0.00 174.62 172.04 2ill s SER 159 N -1.08 2.11 -0.29 8.08 0.01 0.20 0.12 113.70 122.84 2ill s SER 159 Ca 0.07 -0.36 -0.18 0.00 1.31 0.00 0.00 55.95 56.79 2ill s SER 159 Cb -0.09 -0.79 -0.02 0.00 0.21 0.00 0.00 66.02 65.34 2ill s SER 159 CO 0.01 0.11 0.54 -0.22 0.41 0.00 0.00 173.24 174.09 2ill s LEU 160 N 0.32 4.14 0.08 2.44 2.96 -0.48 -0.76 118.68 127.38 2ill s LEU 160 Ca -0.10 0.37 0.07 0.00 -0.22 0.00 0.00 54.13 54.25 2ill s LEU 160 Cb -0.14 -2.68 -0.04 0.00 0.50 0.00 0.00 46.19 43.84 2ill s LEU 160 CO 0.04 -0.38 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.85 2ill s VAL 161 N 2.40 3.01 -0.83 1.68 1.01 0.35 -0.23 120.40 127.78 2ill s VAL 161 Ca 0.21 -1.28 0.01 0.00 0.00 0.00 0.00 61.98 60.93 2ill s VAL 161 Cb -0.15 -2.34 0.25 0.00 0.00 0.00 0.00 36.38 34.14 2ill s VAL 161 CO 0.11 0.21 0.94 0.49 0.00 0.00 0.00 175.10 176.85 2ill n PHE 162 N 1.11 3.44 0.33 5.22 3.01 -0.40 -1.41 117.46 128.76 2ill n PHE 162 Ca -0.15 -3.75 0.22 0.00 1.01 0.00 0.00 57.45 54.78 2ill n PHE 162 Cb 0.52 -0.91 1.16 0.00 -0.01 0.00 0.00 39.48 40.25 2ill n PHE 162 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2ill h PRO 163 N 5.08 0.00 -0.02 -1.08 0.13 -1.85 -1.21 132.00 133.05 2ill h PRO 163 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2ill h PRO 163 Cb 0.70 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.83 2ill h PRO 163 CO 0.97 0.00 -0.04 0.09 -0.23 0.00 0.00 178.00 178.78 2ill n ASN 164 N -3.06 1.78 0.00 1.44 3.02 -1.26 -4.96 115.26 112.22 2ill n ASN 164 Ca -0.03 -1.54 0.00 0.00 -0.03 0.00 0.00 54.58 52.98 2ill n ASN 164 Cb 0.09 0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 2ill n ASN 164 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2ill n GLY 165 N 1.24 0.21 3.78 7.41 0.00 -0.46 -4.96 105.19 112.40 2ill n GLY 165 Ca 0.17 -1.37 -0.36 0.00 0.00 0.00 0.00 46.02 44.46 2ill n GLY 165 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2ill s VAL 166 N -1.05 3.22 0.16 1.61 -7.23 0.07 -4.66 120.40 112.52 2ill s VAL 166 Ca 0.00 0.81 0.09 0.00 -1.81 0.00 0.00 61.98 61.07 2ill s VAL 166 Cb 0.00 -3.36 -0.04 0.00 0.56 0.00 0.00 36.38 33.54 2ill s VAL 166 CO 0.00 -0.12 -0.13 -1.61 -0.31 0.00 0.00 175.10 172.93 2ill s GLU 167 N -3.08 1.93 0.38 4.82 2.02 -1.26 -0.33 118.70 123.17 2ill s GLU 167 Ca 0.69 -1.26 0.16 0.00 0.02 0.00 0.00 54.97 54.58 2ill s GLU 167 Cb -0.25 -2.12 1.04 0.00 0.10 0.00 0.00 34.13 32.90 2ill s GLU 167 CO 0.29 0.45 1.76 0.00 0.02 0.00 0.00 175.26 177.77 2ill h ARG 168 N 3.21 0.44 0.00 1.61 3.08 -1.96 0.20 114.38 120.96 2ill h ARG 168 Ca -0.48 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 59.55 2ill h ARG 168 Cb 1.19 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 31.14 2ill h ARG 168 CO 0.51 0.29 0.00 0.36 -1.07 0.00 0.00 179.97 180.06 2ill n LYS 169 N -4.69 0.12 0.10 0.04 2.85 -1.26 -2.65 118.16 112.67 2ill n LYS 169 Ca 0.26 0.44 0.11 0.00 -1.05 0.00 0.00 58.31 58.07 2ill n LYS 169 Cb 0.83 -1.77 0.45 0.00 -0.65 0.00 0.00 35.03 33.90 2ill n LYS 169 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2ill n ASP 170 N -2.01 0.56 -4.76 -5.58 8.00 0.71 -4.76 116.55 108.71 2ill n ASP 170 Ca 0.01 0.61 -0.39 0.00 0.71 0.00 0.00 54.79 55.74 2ill n ASP 170 Cb 0.15 -0.74 0.02 0.00 -0.02 0.00 0.00 41.12 40.53 2ill n ASP 170 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2ill s ALA 171 N -3.21 3.13 0.00 2.24 0.00 -1.09 -4.84 121.76 117.99 2ill s ALA 171 Ca 0.06 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.40 2ill s ALA 171 Cb 0.10 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.66 2ill s ALA 171 CO 0.42 -1.16 0.00 0.41 0.00 0.00 0.00 175.76 175.43 2ill n GLY 172 N 0.62 0.02 3.21 0.00 0.00 -0.75 -4.99 105.19 103.30 2ill n GLY 172 Ca 0.06 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.20 2ill n GLY 172 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ill s PHE 173 N -2.75 3.15 -0.16 1.61 0.40 -1.26 -0.49 117.98 118.48 2ill s PHE 173 Ca 0.00 -1.60 -0.07 0.00 -0.60 0.00 0.00 56.93 54.66 2ill s PHE 173 Cb 0.00 -2.10 -0.04 0.00 0.51 0.00 0.00 43.02 41.39 2ill s PHE 173 CO 0.00 -0.74 0.08 0.71 0.70 0.00 0.00 175.22 175.97 2ill s TYR 174 N 1.32 3.32 -0.21 0.36 1.51 -0.48 -1.10 117.35 122.07 2ill s TYR 174 Ca -0.02 0.21 -0.05 0.00 -1.01 0.00 0.00 57.07 56.21 2ill s TYR 174 Cb -0.18 -2.02 -0.02 0.00 -0.11 0.00 0.00 41.96 39.64 2ill s TYR 174 CO -0.02 0.33 -0.02 0.08 -1.11 0.00 0.00 175.55 174.82 2ill s VAL 175 N -0.10 3.74 -0.08 0.71 1.01 -0.52 0.06 120.40 125.22 2ill s VAL 175 Ca 0.07 -0.38 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 2ill s VAL 175 Cb -0.12 -2.69 -0.03 0.00 0.00 0.00 0.00 36.38 33.54 2ill s VAL 175 CO 0.01 0.43 -0.05 0.54 0.00 0.00 0.00 175.10 176.03 2ill s VAL 176 N 1.16 3.90 -0.02 2.92 0.11 -0.67 -0.74 120.40 127.07 2ill s VAL 176 Ca 0.03 -0.40 0.01 0.00 -2.93 0.00 0.00 61.98 58.68 2ill s VAL 176 Cb -0.14 -2.61 0.01 0.00 -1.53 0.00 0.00 36.38 32.11 2ill s VAL 176 CO 0.01 0.60 -0.01 0.00 -3.33 0.00 0.00 175.10 172.36 2ill s ALA 178 N 0.50 2.03 -0.05 0.00 0.00 -0.12 -1.31 121.76 122.80 2ill s ALA 178 Ca -0.05 -0.92 0.00 0.00 0.00 0.00 0.00 51.96 50.99 2ill s ALA 178 Cb -0.08 -0.71 0.02 0.00 0.00 0.00 0.00 23.12 22.36 2ill s ALA 178 CO -0.01 0.32 -0.02 0.21 0.00 0.00 0.00 175.76 176.25 2ill s LYS 179 N 0.17 0.65 0.00 0.00 2.20 -0.66 -0.78 119.74 121.31 2ill s LYS 179 Ca -0.12 -0.00 0.00 0.00 -0.36 0.00 0.00 55.97 55.49 2ill s LYS 179 Cb -0.16 -0.79 0.00 0.00 -1.51 0.00 0.00 37.83 35.37 2ill s LYS 179 CO 0.06 -0.16 0.00 0.27 -0.36 0.00 0.00 175.35 175.17 2ill n ASN 180 N 4.38 0.33 0.13 1.43 0.23 -0.05 -1.11 115.26 120.59 2ill n ASN 180 Ca -0.20 -0.71 0.13 0.00 -0.53 0.00 0.00 54.58 53.27 2ill n ASN 180 Cb 0.50 0.00 0.34 0.00 -2.08 0.00 0.00 39.78 38.55 2ill n ASN 180 CO 0.00 0.00 0.00 0.08 -0.93 0.00 0.00 177.26 176.41 2ill h ARG 181 N 0.00 0.00 -0.10 -3.83 0.11 -1.93 -1.52 114.38 107.12 2ill h ARG 181 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2ill h ARG 181 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 2ill h ARG 181 CO 0.00 0.00 0.00 1.19 0.10 0.00 0.00 179.97 181.26 2ill n PHE 182 N -2.43 0.13 0.00 4.08 3.72 -1.26 -5.01 117.46 116.69 2ill n PHE 182 Ca 0.05 -0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 2ill n PHE 182 Cb 0.45 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.99 2ill n PHE 182 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2ill n GLY 183 N 0.99 1.90 3.18 1.37 0.00 -0.57 -4.63 105.19 107.43 2ill n GLY 183 Ca 0.15 -1.89 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 2ill n GLY 183 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ill s ILE 184 N -1.41 1.30 -0.10 -0.61 1.01 -1.26 -0.87 121.20 119.26 2ill s ILE 184 Ca 0.00 -1.10 -0.09 0.00 0.00 0.00 0.00 60.65 59.46 2ill s ILE 184 Cb 0.00 -1.16 0.03 0.00 0.01 0.00 0.00 42.46 41.33 2ill s ILE 184 CO 0.00 0.05 0.26 -0.62 0.00 0.00 0.00 174.94 174.63 2ill s ASP 185 N -1.22 -0.27 0.06 3.58 2.15 0.04 -4.99 116.67 116.02 2ill s ASP 185 Ca 0.03 0.53 0.02 0.00 0.43 0.00 0.00 52.55 53.57 2ill s ASP 185 Cb -0.08 0.54 -0.03 0.00 -0.30 0.00 0.00 42.92 43.04 2ill s ASP 185 CO 0.02 -0.09 -0.08 0.00 -0.17 0.00 0.00 175.17 174.85 2ill s GLN 186 N 0.14 0.63 0.04 4.34 -2.07 -1.26 -0.94 119.66 120.54 2ill s GLN 186 Ca -0.00 -0.93 -0.02 0.00 -1.82 0.00 0.00 55.36 52.59 2ill s GLN 186 Cb -0.02 -0.31 -0.03 0.00 -1.09 0.00 0.00 33.01 31.57 2ill s GLN 186 CO 0.00 0.04 0.00 0.15 -1.32 0.00 0.00 175.29 174.16 2ill s LYS 187 N -2.22 0.52 -0.10 9.60 -0.14 -0.26 -5.00 119.74 122.15 2ill s LYS 187 Ca -0.03 -0.93 -0.03 0.00 -1.36 0.00 0.00 55.97 53.62 2ill s LYS 187 Cb -0.06 0.19 -0.03 0.00 -1.68 0.00 0.00 37.83 36.25 2ill s LYS 187 CO -0.01 -0.10 0.01 0.99 -0.76 0.00 0.00 175.35 175.48 2ill s THR 188 N -2.91 4.42 -0.15 2.17 2.01 -1.26 -1.66 115.64 118.26 2ill s THR 188 Ca -0.02 -0.20 0.02 0.00 0.31 0.00 0.00 61.69 61.79 2ill s THR 188 Cb 0.01 -2.87 0.02 0.00 0.01 0.00 0.00 72.50 69.66 2ill s THR 188 CO -0.06 0.60 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.59 2ill s VAL 189 N -0.79 1.85 -0.13 3.82 1.01 0.11 -1.18 120.40 125.09 2ill s VAL 189 Ca 0.12 -0.83 -0.29 0.00 0.00 0.00 0.00 61.98 60.98 2ill s VAL 189 Cb -0.12 -1.67 -0.01 0.00 0.00 0.00 0.00 36.38 34.59 2ill s VAL 189 CO 0.02 0.51 1.02 -0.70 0.00 0.00 0.00 175.10 175.95 2ill s GLU 190 N 1.10 4.39 -0.15 2.72 2.12 0.15 -1.39 118.70 127.64 2ill s GLU 190 Ca -0.02 1.39 -0.11 0.00 0.36 0.00 0.00 54.97 56.60 2ill s GLU 190 Cb -0.14 -3.56 -0.05 0.00 0.26 0.00 0.00 34.13 30.64 2ill s GLU 190 CO -0.06 -0.38 0.22 -1.17 -0.54 0.00 0.00 175.26 173.32 2ill s LEU 191 N 2.25 4.29 0.14 2.70 2.96 0.36 -1.01 118.68 130.37 2ill s LEU 191 Ca 0.48 0.45 0.11 0.00 -0.22 0.00 0.00 54.13 54.94 2ill s LEU 191 Cb -0.18 -2.23 -0.04 0.00 0.50 0.00 0.00 46.19 44.24 2ill s LEU 191 CO 0.16 0.22 -0.26 1.51 -1.32 0.00 0.00 176.35 176.65 2ill s ASP 192 N -0.04 3.29 -0.13 3.68 -4.77 -0.14 -1.82 116.67 116.74 2ill s ASP 192 Ca 0.14 -0.76 0.00 0.00 -3.30 0.00 0.00 52.55 48.63 2ill s ASP 192 Cb -0.12 -0.22 0.02 0.00 -1.09 0.00 0.00 42.92 41.51 2ill s ASP 192 CO 0.03 0.17 -0.12 -0.69 0.70 0.00 0.00 175.17 175.25 2ill s VAL 193 N -1.14 1.39 -0.08 2.11 1.01 -1.25 -0.95 120.40 121.48 2ill s VAL 193 Ca 0.14 -0.53 -0.08 0.00 0.00 0.00 0.00 61.98 61.51 2ill s VAL 193 Cb -0.10 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 2ill s VAL 193 CO 0.06 0.43 0.21 0.00 0.00 0.00 0.00 175.10 175.80 2ill s ALA 194 N 1.47 3.84 0.00 5.51 0.00 0.39 -4.89 121.76 128.08 2ill s ALA 194 Ca 0.03 -0.55 0.00 0.00 0.00 0.00 0.00 51.96 51.44 2ill s ALA 194 Cb -0.13 -2.06 0.00 0.00 0.00 0.00 0.00 23.12 20.93 2ill s ALA 194 CO -0.09 0.60 0.37 -0.40 0.00 0.00 0.00 175.76 176.24