#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i0r s ASP 2 N 0.00 6.70 0.55 6.12 2.15 -1.26 -4.94 116.67 126.00 1i0r s ASP 2 Ca 0.00 0.71 0.23 0.00 0.43 0.00 0.00 52.55 53.92 1i0r s ASP 2 Cb 0.00 -2.43 1.54 0.00 -0.30 0.00 0.00 42.92 41.73 1i0r s ASP 2 CO 0.00 -0.67 2.20 1.62 -0.17 0.00 0.00 175.17 178.15 1i0r h VAL 3 N 5.63 0.77 -0.08 1.11 3.04 -2.08 -2.16 116.25 122.48 1i0r h VAL 3 Ca -0.24 -0.02 0.02 0.00 -1.01 0.00 0.00 66.70 65.46 1i0r h VAL 3 Cb 1.09 1.01 -0.00 0.00 -2.01 0.00 0.00 31.29 31.38 1i0r h VAL 3 CO 0.91 0.00 0.08 -0.08 -1.01 0.00 0.00 177.57 177.48 1i0r h GLU 4 N 0.00 0.00 -0.61 4.17 4.81 -2.01 -0.93 114.58 120.01 1i0r h GLU 4 Ca -0.00 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 1i0r h GLU 4 Cb 0.01 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.36 1i0r h GLU 4 CO 0.00 0.00 0.28 0.00 -0.73 0.00 0.00 179.01 178.56 1i0r h ALA 5 N 1.91 1.36 0.00 2.92 0.00 -1.81 -1.84 119.26 121.80 1i0r h ALA 5 Ca 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 1i0r h ALA 5 Cb 0.21 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1i0r h ALA 5 CO -0.00 0.50 -0.09 0.74 0.00 0.00 0.00 179.25 180.40 1i0r h PHE 6 N 0.86 0.00 0.00 0.00 -1.00 -1.35 -2.00 116.94 113.45 1i0r h PHE 6 Ca 0.21 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.99 1i0r h PHE 6 Cb 0.10 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.66 1i0r h PHE 6 CO 0.01 0.09 0.00 0.66 -1.61 0.00 0.00 178.31 177.46 1i0r n TYR 7 N -3.31 0.00 1.05 -0.55 4.01 -0.69 -2.64 117.16 115.02 1i0r n TYR 7 Ca -0.01 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.86 1i0r n TYR 7 Cb 0.29 -0.15 0.34 0.00 -0.31 0.00 0.00 39.34 39.51 1i0r n TYR 7 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1i0r n LYS 8 N -1.15 0.12 -2.56 -0.72 4.76 -0.75 -4.85 118.16 113.01 1i0r n LYS 8 Ca 0.17 -0.06 -0.41 0.00 -2.87 0.00 0.00 58.31 55.14 1i0r n LYS 8 Cb 0.16 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 31.81 1i0r n LYS 8 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1i0r s ILE 9 N -2.92 3.98 0.01 -0.18 1.01 -1.08 -5.04 121.20 116.98 1i0r s ILE 9 Ca 0.14 1.72 -0.11 0.00 0.00 0.00 0.00 60.65 62.40 1i0r s ILE 9 Cb 0.18 -4.10 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 1i0r s ILE 9 CO 0.64 0.30 0.35 -0.44 0.00 0.00 0.00 174.94 175.79 1i0r s SER 10 N -0.18 6.65 0.12 3.58 0.01 -1.26 -5.02 113.70 117.60 1i0r s SER 10 Ca 0.48 0.78 -0.03 0.00 1.31 0.00 0.00 55.95 58.49 1i0r s SER 10 Cb -0.28 -2.18 -0.03 0.00 0.21 0.00 0.00 66.02 63.74 1i0r s SER 10 CO 0.34 0.28 0.10 -0.31 0.41 0.00 0.00 173.24 174.05 1i0r s TYR 11 N -1.21 0.65 0.01 2.43 1.51 -1.26 -5.07 117.35 114.41 1i0r s TYR 11 Ca 0.26 -1.06 0.00 0.00 -1.01 0.00 0.00 57.07 55.26 1i0r s TYR 11 Cb -0.15 -0.35 0.00 0.00 -0.11 0.00 0.00 41.96 41.36 1i0r s TYR 11 CO 0.14 -0.54 0.01 0.41 -1.11 0.00 0.00 175.55 174.46 1i0r n GLY 12 N -0.08 1.59 2.93 0.71 0.00 -1.25 -0.99 105.19 108.09 1i0r n GLY 12 Ca -0.08 -2.08 -0.21 0.00 0.00 0.00 0.00 46.02 43.65 1i0r n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1i0r s LEU 13 N 0.00 1.43 0.13 0.99 2.96 -1.04 -3.76 118.68 119.39 1i0r s LEU 13 Ca 0.01 -0.17 -0.02 0.00 -0.22 0.00 0.00 54.13 53.73 1i0r s LEU 13 Cb -0.00 -0.53 -0.03 0.00 0.50 0.00 0.00 46.19 46.12 1i0r s LEU 13 CO 0.01 -0.03 0.08 -0.31 -1.32 0.00 0.00 176.35 174.78 1i0r s TYR 14 N 0.82 0.74 -0.16 5.38 1.51 -0.20 -2.46 117.35 122.98 1i0r s TYR 14 Ca -0.12 -1.13 -0.03 0.00 -1.01 0.00 0.00 57.07 54.78 1i0r s TYR 14 Cb -0.15 -0.40 -0.02 0.00 -0.11 0.00 0.00 41.96 41.28 1i0r s TYR 14 CO 0.01 -0.53 -0.06 0.42 -1.11 0.00 0.00 175.55 174.28 1i0r s ILE 15 N -4.02 3.55 -0.18 2.71 1.01 -0.75 -0.96 121.20 122.56 1i0r s ILE 15 Ca 0.21 -0.47 -0.04 0.00 0.00 0.00 0.00 60.65 60.34 1i0r s ILE 15 Cb 0.07 -2.55 -0.03 0.00 0.01 0.00 0.00 42.46 39.96 1i0r s ILE 15 CO -0.00 0.48 -0.02 -0.69 0.00 0.00 0.00 174.94 174.72 1i0r s VAL 16 N 0.63 3.93 0.24 2.92 1.01 0.40 -0.80 120.40 128.73 1i0r s VAL 16 Ca -0.04 -0.33 0.10 0.00 0.00 0.00 0.00 61.98 61.71 1i0r s VAL 16 Cb -0.15 -2.75 -0.05 0.00 0.00 0.00 0.00 36.38 33.43 1i0r s VAL 16 CO 0.03 0.46 -0.18 0.42 0.00 0.00 0.00 175.10 175.82 1i0r s THR 17 N 0.69 2.18 0.28 3.92 -4.23 -0.03 -1.21 115.64 117.24 1i0r s THR 17 Ca -0.01 -2.28 -0.13 0.00 -1.18 0.00 0.00 61.69 58.09 1i0r s THR 17 Cb -0.14 -2.17 0.05 0.00 1.34 0.00 0.00 72.50 71.58 1i0r s THR 17 CO 0.02 -0.44 0.68 -0.24 -0.54 0.00 0.00 174.62 174.10 1i0r n SER 18 N -0.41 -1.74 -3.73 3.99 2.88 -0.71 -0.71 113.62 113.19 1i0r n SER 18 Ca -0.07 -2.15 -0.12 0.00 -1.33 0.00 0.00 58.87 55.20 1i0r n SER 18 Cb 0.60 2.88 -0.11 0.00 -0.75 0.00 0.00 64.21 66.82 1i0r n SER 18 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 1i0r s GLU 19 N -2.06 0.36 -0.08 -1.46 -6.30 -1.26 -0.99 118.70 106.91 1i0r s GLU 19 Ca 0.14 0.58 -0.05 0.00 -2.50 0.00 0.00 54.97 53.14 1i0r s GLU 19 Cb -0.04 0.06 0.03 0.00 0.00 0.00 0.00 34.13 34.19 1i0r s GLU 19 CO 0.08 -0.11 0.19 0.45 0.02 0.00 0.00 175.26 175.90 1i0r s SER 20 N 0.78 -0.19 -1.38 -1.70 0.15 -0.34 -4.57 113.70 106.46 1i0r s SER 20 Ca -0.05 0.40 -0.05 0.00 0.70 0.00 0.00 55.95 56.95 1i0r s SER 20 Cb -0.06 0.35 0.03 0.00 -1.71 0.00 0.00 66.02 64.63 1i0r s SER 20 CO -0.05 -0.11 0.87 0.59 1.20 0.00 0.00 173.24 175.73 1i0r n ASN 21 N 3.57 -2.94 -2.07 5.45 5.03 -1.26 -1.13 115.26 121.91 1i0r n ASN 21 Ca -0.19 -0.76 -0.21 0.00 0.87 0.00 0.00 54.58 54.29 1i0r n ASN 21 Cb 0.56 -4.20 -0.04 0.00 -1.02 0.00 0.00 39.78 35.08 1i0r n ASN 21 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1i0r n GLY 22 N -1.62 0.53 2.94 7.41 0.00 -1.26 -4.97 105.19 108.21 1i0r n GLY 22 Ca -0.16 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.60 1i0r n GLY 22 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1i0r s ARG 23 N -4.52 1.62 0.35 1.61 3.52 -0.29 -5.12 118.95 116.11 1i0r s ARG 23 Ca 0.00 -0.31 -0.27 0.00 -0.13 0.00 0.00 55.73 55.02 1i0r s ARG 23 Cb 0.00 -1.59 -0.09 0.00 -1.56 0.00 0.00 34.95 31.71 1i0r s ARG 23 CO 0.00 -0.21 1.12 0.15 -0.81 0.00 0.00 175.30 175.55 1i0r s LYS 24 N 1.48 4.34 0.07 5.12 1.02 -1.26 -1.20 119.74 129.31 1i0r s LYS 24 Ca 0.01 1.77 0.02 0.00 0.02 0.00 0.00 55.97 57.79 1i0r s LYS 24 Cb -0.13 -2.87 -0.03 0.00 -0.52 0.00 0.00 37.83 34.27 1i0r s LYS 24 CO -0.06 -0.05 -0.08 0.00 -0.92 0.00 0.00 175.35 174.24 1i0r s GLY 26 N -2.26 -0.35 0.04 0.00 0.00 -1.26 -1.75 107.32 101.74 1i0r s GLY 26 Ca 0.01 1.89 -0.13 0.00 0.00 0.00 0.00 44.72 46.49 1i0r s GLY 26 CO -0.02 1.10 0.28 -0.86 0.00 0.00 0.00 173.10 173.61 1i0r s GLN 27 N -0.97 0.77 0.33 2.90 -2.07 -0.35 -4.87 119.66 115.39 1i0r s GLN 27 Ca -0.04 -0.49 -0.26 0.00 -1.82 0.00 0.00 55.36 52.75 1i0r s GLN 27 Cb -0.01 0.33 -0.10 0.00 -1.09 0.00 0.00 33.01 32.15 1i0r s GLN 27 CO 0.03 -0.24 0.98 0.42 -1.32 0.00 0.00 175.29 175.16 1i0r s ILE 28 N -2.41 4.05 0.01 3.63 -1.09 -0.81 -0.45 121.20 124.13 1i0r s ILE 28 Ca -0.06 1.71 -0.12 0.00 -2.23 0.00 0.00 60.65 59.95 1i0r s ILE 28 Cb -0.01 -3.95 0.01 0.00 -1.58 0.00 0.00 42.46 36.93 1i0r s ILE 28 CO -0.03 0.14 0.26 0.00 -1.23 0.00 0.00 174.94 174.08 1i0r s ALA 29 N -1.58 -0.60 -0.27 9.38 0.00 -0.14 -4.88 121.76 123.67 1i0r s ALA 29 Ca 0.51 0.07 0.06 0.00 0.00 0.00 0.00 51.96 52.60 1i0r s ALA 29 Cb -0.20 0.17 -0.07 0.00 0.00 0.00 0.00 23.12 23.01 1i0r s ALA 29 CO 0.26 -0.30 0.26 0.27 0.00 0.00 0.00 175.76 176.25 1i0r n ASN 30 N 1.06 0.63 -4.33 0.00 6.94 -1.26 -1.03 115.26 117.27 1i0r n ASN 30 Ca -0.21 -0.59 -0.45 0.00 -0.02 0.00 0.00 54.58 53.32 1i0r n ASN 30 Cb 0.57 1.03 -0.01 0.00 -2.36 0.00 0.00 39.78 39.02 1i0r n ASN 30 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1i0r s THR 31 N -1.69 5.89 -0.05 5.53 2.01 -1.26 -3.93 115.64 122.14 1i0r s THR 31 Ca 0.02 -3.38 0.00 0.00 0.31 0.00 0.00 61.69 58.64 1i0r s THR 31 Cb 0.05 -4.55 0.02 0.00 0.01 0.00 0.00 72.50 68.04 1i0r s THR 31 CO 0.26 -1.17 -0.03 -0.69 -0.69 0.00 0.00 174.62 172.31 1i0r s VAL 32 N -1.17 0.44 -0.07 3.82 1.01 -1.26 -1.97 120.40 121.20 1i0r s VAL 32 Ca 0.30 -0.04 -0.22 0.00 0.00 0.00 0.00 61.98 62.02 1i0r s VAL 32 Cb -0.10 -0.50 0.05 0.00 0.00 0.00 0.00 36.38 35.83 1i0r s VAL 32 CO -0.08 0.21 0.50 -0.36 0.00 0.00 0.00 175.10 175.37 1i0r s PHE 33 N 1.12 -0.45 0.12 5.22 0.40 -0.73 -4.85 117.98 118.82 1i0r s PHE 33 Ca -0.08 0.84 -0.30 0.00 -0.60 0.00 0.00 56.93 56.79 1i0r s PHE 33 Cb -0.14 0.24 -0.06 0.00 0.51 0.00 0.00 43.02 43.57 1i0r s PHE 33 CO -0.01 -0.45 0.99 -1.14 0.70 0.00 0.00 175.22 175.31 1i0r s GLN 34 N -0.93 4.67 -0.25 0.44 0.74 -1.26 -0.42 119.66 122.65 1i0r s GLN 34 Ca -0.10 1.50 0.04 0.00 0.05 0.00 0.00 55.36 56.86 1i0r s GLN 34 Cb -0.03 -3.36 -0.18 0.00 1.10 0.00 0.00 33.01 30.54 1i0r s GLN 34 CO 0.06 0.18 -0.19 1.28 -0.55 0.00 0.00 175.29 176.06 1i0r n LEU 35 N 2.75 2.60 -4.09 3.68 4.77 0.22 -4.92 117.00 122.02 1i0r n LEU 35 Ca 0.03 -0.12 -0.09 0.00 -0.03 0.00 0.00 56.01 55.79 1i0r n LEU 35 Cb 0.49 -0.73 -0.09 0.00 -2.33 0.00 0.00 43.42 40.75 1i0r n LEU 35 CO 0.52 0.88 -0.23 0.42 -1.33 0.00 0.00 177.39 177.65 1i0r s THR 36 N -2.52 0.11 -0.13 -5.08 -4.23 -1.23 -5.00 115.64 97.56 1i0r s THR 36 Ca -0.32 -1.75 0.05 0.00 -1.18 0.00 0.00 61.69 58.50 1i0r s THR 36 Cb 0.09 -1.92 -0.07 0.00 1.34 0.00 0.00 72.50 71.94 1i0r s THR 36 CO 0.63 -0.48 0.18 -1.54 -0.54 0.00 0.00 174.62 172.86 1i0r n SER 37 N -0.10 1.99 -3.72 3.99 3.41 -1.26 -2.62 113.62 115.30 1i0r n SER 37 Ca -0.07 -0.31 -0.29 0.00 -0.26 0.00 0.00 58.87 57.94 1i0r n SER 37 Cb 0.63 1.13 -0.12 0.00 -0.26 0.00 0.00 64.21 65.58 1i0r n SER 37 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1i0r s LYS 38 N -1.95 1.53 0.80 4.33 1.02 -1.26 -2.95 119.74 121.25 1i0r s LYS 38 Ca 0.00 -2.35 -0.08 0.00 0.02 0.00 0.00 55.97 53.56 1i0r s LYS 38 Cb 0.04 -2.49 0.13 0.00 -0.52 0.00 0.00 37.83 34.98 1i0r s LYS 38 CO 0.23 -1.22 1.12 -1.25 -0.92 0.00 0.00 175.35 173.31 1i0r s PRO 39 N -0.12 1.52 -0.07 -1.68 0.04 -1.26 -5.05 135.00 128.38 1i0r s PRO 39 Ca 0.21 -0.53 -0.30 0.00 0.04 0.00 0.00 61.00 60.43 1i0r s PRO 39 Cb -0.16 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1i0r s PRO 39 CO -0.06 -1.71 1.46 0.08 0.04 0.00 0.00 177.00 176.81 1i0r s VAL 40 N -3.45 3.82 -0.02 -0.36 1.01 -1.15 -4.64 120.40 115.60 1i0r s VAL 40 Ca 0.67 1.07 0.06 0.00 0.00 0.00 0.00 61.98 63.77 1i0r s VAL 40 Cb -0.07 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 1i0r s VAL 40 CO 0.48 -0.06 -0.20 -1.10 0.00 0.00 0.00 175.10 174.21 1i0r s GLN 41 N 3.35 1.68 -0.05 2.72 -0.21 -1.08 -1.36 119.66 124.72 1i0r s GLN 41 Ca 0.65 -0.72 0.06 0.00 0.02 0.00 0.00 55.36 55.37 1i0r s GLN 41 Cb -0.29 -1.60 -0.01 0.00 1.00 0.00 0.00 33.01 32.11 1i0r s GLN 41 CO 0.24 0.41 -0.23 0.42 -2.12 0.00 0.00 175.29 174.02 1i0r s ILE 42 N -0.41 1.86 -0.05 1.08 -1.09 0.79 -0.61 121.20 122.78 1i0r s ILE 42 Ca 0.06 -0.96 0.00 0.00 -2.23 0.00 0.00 60.65 57.52 1i0r s ILE 42 Cb -0.08 -1.57 -0.03 0.00 -1.58 0.00 0.00 42.46 39.19 1i0r s ILE 42 CO -0.00 0.52 -0.03 0.00 -1.23 0.00 0.00 174.94 174.20 1i0r s ALA 43 N -0.17 3.15 -0.04 9.38 0.00 0.44 -0.04 121.76 134.48 1i0r s ALA 43 Ca -0.02 -0.89 0.02 0.00 0.00 0.00 0.00 51.96 51.07 1i0r s ALA 43 Cb -0.12 -1.32 0.01 0.00 0.00 0.00 0.00 23.12 21.69 1i0r s ALA 43 CO 0.03 0.60 -0.08 0.14 0.00 0.00 0.00 175.76 176.45 1i0r s VAL 44 N -0.92 0.75 -0.28 0.00 -7.23 -0.67 -1.77 120.40 110.28 1i0r s VAL 44 Ca 0.15 -0.28 -0.06 0.00 -1.81 0.00 0.00 61.98 59.97 1i0r s VAL 44 Cb -0.11 -0.71 0.01 0.00 0.56 0.00 0.00 36.38 36.13 1i0r s VAL 44 CO 0.04 0.26 0.06 0.00 -0.31 0.00 0.00 175.10 175.15 1i0r s LEU 46 N 1.49 2.28 0.18 0.00 1.43 -0.67 -4.76 118.68 118.63 1i0r s LEU 46 Ca 0.03 -0.44 -0.30 0.00 -1.03 0.00 0.00 54.13 52.39 1i0r s LEU 46 Cb -0.17 -1.39 -0.08 0.00 0.03 0.00 0.00 46.19 44.58 1i0r s LEU 46 CO 0.01 0.30 1.27 0.21 0.23 0.00 0.00 176.35 178.38 1i0r s ASN 47 N -0.88 6.97 0.63 2.29 3.84 -1.26 -1.49 114.94 125.03 1i0r s ASN 47 Ca 0.11 2.32 0.41 0.00 0.21 0.00 0.00 52.86 55.91 1i0r s ASN 47 Cb -0.10 -2.61 2.22 0.00 -0.55 0.00 0.00 41.25 40.21 1i0r s ASN 47 CO 0.01 -0.48 2.25 0.11 -2.79 0.00 0.00 177.10 176.20 1i0r h LYS 48 N 5.47 0.00 -0.00 0.43 1.57 -1.68 -1.80 116.57 120.55 1i0r h LYS 48 Ca -0.44 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.34 1i0r h LYS 48 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 1i0r h LYS 48 CO 0.77 0.00 -0.21 0.39 -0.57 0.00 0.00 179.45 179.83 1i0r n GLU 49 N -2.97 0.00 -3.03 3.15 1.02 -1.26 -4.80 120.64 112.76 1i0r n GLU 49 Ca -0.03 -0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.76 1i0r n GLU 49 Cb 0.10 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 29.96 1i0r n GLU 49 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 1i0r s ASN 50 N -3.00 7.07 0.36 1.62 0.01 -0.68 -4.98 114.94 115.34 1i0r s ASN 50 Ca 0.13 1.49 0.07 0.00 -0.71 0.00 0.00 52.86 53.84 1i0r s ASN 50 Cb 0.18 -2.45 0.68 0.00 0.41 0.00 0.00 41.25 40.07 1i0r s ASN 50 CO 0.60 -0.03 1.88 0.44 -1.51 0.00 0.00 177.10 178.48 1i0r h ASP 51 N 3.15 0.35 -0.41 -1.22 3.32 -1.90 -2.44 116.42 117.28 1i0r h ASP 51 Ca -0.48 -0.07 -0.08 0.00 0.02 0.00 0.00 57.03 56.42 1i0r h ASP 51 Cb 1.19 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.63 1i0r h ASP 51 CO 0.65 0.48 -0.04 0.74 -1.72 0.00 0.00 179.24 179.35 1i0r h THR 52 N 0.35 1.25 -0.15 0.35 2.02 -1.93 -0.72 112.91 114.08 1i0r h THR 52 Ca 0.07 -1.09 0.03 0.00 0.77 0.00 0.00 66.41 66.20 1i0r h THR 52 Cb 0.38 0.93 -0.03 0.00 -1.74 0.00 0.00 68.15 67.69 1i0r h THR 52 CO 0.02 0.38 -0.05 -0.74 0.37 0.00 0.00 175.52 175.50 1i0r h HIS 53 N 0.76 -0.12 -0.19 3.16 -0.00 -1.69 -0.51 115.15 116.56 1i0r h HIS 53 Ca 0.14 0.01 -0.06 0.00 -0.00 0.00 0.00 60.37 60.46 1i0r h HIS 53 Cb 0.52 0.07 -0.01 0.00 -0.00 0.00 0.00 27.41 27.99 1i0r h HIS 53 CO 0.03 -0.09 -0.17 -0.91 -0.00 0.00 0.00 177.93 176.79 1i0r h ASN 54 N -0.03 0.31 -0.50 3.26 2.35 -1.27 -0.16 115.58 119.54 1i0r h ASN 54 Ca 0.08 -0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 55.63 1i0r h ASN 54 Cb 0.14 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 1i0r h ASN 54 CO -0.17 0.50 -0.16 0.00 -1.65 0.00 0.00 177.43 175.95 1i0r h ALA 55 N 1.53 0.75 -0.33 -0.83 0.00 -0.58 -1.24 119.26 118.57 1i0r h ALA 55 Ca 0.06 -0.37 -0.16 0.00 0.00 0.00 0.00 54.91 54.44 1i0r h ALA 55 Cb 0.48 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.08 1i0r h ALA 55 CO 0.03 0.67 -0.42 0.28 0.00 0.00 0.00 179.25 179.81 1i0r h VAL 56 N 0.87 1.28 -0.86 0.00 2.07 -0.73 -0.52 116.25 118.37 1i0r h VAL 56 Ca 0.13 -1.60 0.00 0.00 0.82 0.00 0.00 66.70 66.05 1i0r h VAL 56 Cb 0.73 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 1i0r h VAL 56 CO 0.06 0.52 0.55 0.50 0.02 0.00 0.00 177.57 179.22 1i0r h LYS 57 N 0.66 1.14 0.06 1.57 3.64 -0.72 -1.11 116.57 121.82 1i0r h LYS 57 Ca 0.05 -0.08 -0.12 0.00 -1.27 0.00 0.00 60.65 59.22 1i0r h LYS 57 Cb 0.99 -0.25 0.01 0.00 -0.41 0.00 0.00 32.23 32.57 1i0r h LYS 57 CO 0.10 0.77 -0.51 0.93 -2.27 0.00 0.00 179.45 178.47 1i0r h GLU 58 N 1.17 0.25 0.00 1.90 5.08 -1.11 -3.37 114.58 118.50 1i0r h GLU 58 Ca 0.31 -0.34 -0.13 0.00 -1.00 0.00 0.00 59.36 58.20 1i0r h GLU 58 Cb -0.10 0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1i0r h GLU 58 CO -0.06 1.10 -0.61 0.66 -1.00 0.00 0.00 179.01 179.10 1i0r h SER 59 N -0.44 0.00 -0.38 1.42 4.64 -1.11 -3.48 113.55 114.21 1i0r h SER 59 Ca -0.08 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 61.13 1i0r h SER 59 Cb 1.32 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.38 1i0r h SER 59 CO 0.10 0.60 -0.11 0.61 -0.87 0.00 0.00 176.83 177.16 1i0r n GLY 60 N 1.25 0.66 3.26 -0.77 0.00 -0.42 -5.00 105.19 104.18 1i0r n GLY 60 Ca 0.01 -0.78 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 1i0r n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i0r s ALA 61 N -2.22 -0.69 0.11 4.61 0.00 -1.26 -0.75 121.76 121.55 1i0r s ALA 61 Ca 0.00 -0.04 -0.17 0.00 0.00 0.00 0.00 51.96 51.75 1i0r s ALA 61 Cb 0.00 0.38 0.04 0.00 0.00 0.00 0.00 23.12 23.54 1i0r s ALA 61 CO 0.00 -0.45 0.41 -0.59 0.00 0.00 0.00 175.76 175.13 1i0r s PHE 62 N -2.83 -0.23 0.19 0.00 -0.12 -0.72 -4.61 117.98 109.67 1i0r s PHE 62 Ca -0.03 -0.02 0.11 0.00 -0.05 0.00 0.00 56.93 56.93 1i0r s PHE 62 Cb 0.00 0.26 -0.04 0.00 -0.63 0.00 0.00 43.02 42.60 1i0r s PHE 62 CO -0.05 -0.68 -0.22 0.20 -0.05 0.00 0.00 175.22 174.42 1i0r s GLY 63 N -2.62 1.64 -0.07 1.99 0.00 0.12 -1.14 107.32 107.24 1i0r s GLY 63 Ca 0.01 -1.62 0.01 0.00 0.00 0.00 0.00 44.72 43.12 1i0r s GLY 63 CO -0.10 -1.65 -0.06 0.14 0.00 0.00 0.00 173.10 171.43 1i0r s VAL 64 N -1.83 0.75 -0.21 1.40 1.01 0.08 -0.85 120.40 120.74 1i0r s VAL 64 Ca 0.20 -0.20 -0.05 0.00 0.00 0.00 0.00 61.98 61.93 1i0r s VAL 64 Cb -0.07 -0.77 -0.02 0.00 0.00 0.00 0.00 36.38 35.51 1i0r s VAL 64 CO 0.09 0.29 0.01 -0.44 0.00 0.00 0.00 175.10 175.06 1i0r s SER 65 N 1.22 4.84 -0.40 3.32 0.01 0.02 -1.09 113.70 121.62 1i0r s SER 65 Ca -0.05 -0.22 -0.22 0.00 1.31 0.00 0.00 55.95 56.76 1i0r s SER 65 Cb -0.14 -1.84 0.02 0.00 0.21 0.00 0.00 66.02 64.27 1i0r s SER 65 CO -0.02 0.03 0.74 -0.69 0.41 0.00 0.00 173.24 173.72 1i0r s VAL 66 N 1.19 4.74 0.35 3.43 1.01 -0.26 -1.82 120.40 129.03 1i0r s VAL 66 Ca 0.03 0.56 -0.27 0.00 0.00 0.00 0.00 61.98 62.30 1i0r s VAL 66 Cb -0.14 -4.23 -0.09 0.00 0.00 0.00 0.00 36.38 31.91 1i0r s VAL 66 CO 0.01 -0.54 1.21 -0.76 0.00 0.00 0.00 175.10 175.02 1i0r s LEU 67 N 3.07 4.36 0.53 3.92 1.43 -1.03 -0.40 118.68 130.58 1i0r s LEU 67 Ca 0.29 2.46 -0.16 0.00 -1.03 0.00 0.00 54.13 55.69 1i0r s LEU 67 Cb -0.13 -3.79 -0.07 0.00 0.03 0.00 0.00 46.19 42.23 1i0r s LEU 67 CO 0.19 -0.51 1.00 -1.83 0.23 0.00 0.00 176.35 175.43 1i0r s GLU 68 N -1.92 3.87 0.33 1.70 -1.05 -0.02 -1.31 118.70 120.30 1i0r s GLU 68 Ca 0.51 0.94 0.10 0.00 -0.15 0.00 0.00 54.97 56.37 1i0r s GLU 68 Cb -0.35 -2.12 0.86 0.00 -0.44 0.00 0.00 34.13 32.08 1i0r s GLU 68 CO 0.45 -0.34 1.78 1.25 0.95 0.00 0.00 175.26 179.34 1i0r h LEU 69 N 0.71 0.67 -2.61 1.83 5.85 -0.69 -1.87 115.31 119.20 1i0r h LEU 69 Ca -0.46 0.10 -0.04 0.00 0.84 0.00 0.00 57.88 58.31 1i0r h LEU 69 Cb 1.19 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 42.17 1i0r h LEU 69 CO 0.61 0.21 0.05 -0.62 -0.34 0.00 0.00 178.44 178.35 1i0r n GLU 70 N -4.74 3.14 -1.75 1.25 1.02 -1.26 -4.82 120.64 113.48 1i0r n GLU 70 Ca 0.24 -1.87 -0.42 0.00 -0.02 0.00 0.00 57.16 55.08 1i0r n GLU 70 Cb 0.66 -1.93 -0.03 0.00 -0.02 0.00 0.00 31.44 30.12 1i0r n GLU 70 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1i0r s THR 71 N -2.04 2.39 0.35 2.62 2.01 -0.70 -4.93 115.64 115.34 1i0r s THR 71 Ca 0.33 0.10 -0.29 0.00 0.31 0.00 0.00 61.69 62.14 1i0r s THR 71 Cb 0.25 -3.06 -0.11 0.00 0.01 0.00 0.00 72.50 69.59 1i0r s THR 71 CO 0.09 0.00 1.48 -2.84 -0.69 0.00 0.00 174.62 172.66 1i0r s PRO 72 N 2.06 4.15 0.50 4.92 0.02 -1.26 -4.89 135.00 140.50 1i0r s PRO 72 Ca 0.77 2.51 0.17 0.00 0.02 0.00 0.00 61.00 64.47 1i0r s PRO 72 Cb -0.47 -3.00 1.21 0.00 0.02 0.00 0.00 34.50 32.26 1i0r s PRO 72 CO 0.34 -0.50 2.08 0.52 -0.33 0.00 0.00 177.00 179.11 1i0r h MET 73 N 3.51 0.13 -0.45 5.54 2.86 -2.00 -1.07 114.93 123.45 1i0r h MET 73 Ca -0.50 -0.01 -0.08 0.00 -2.06 0.00 0.00 59.70 57.06 1i0r h MET 73 Cb 1.23 -0.03 -0.02 0.00 0.06 0.00 0.00 31.60 32.84 1i0r h MET 73 CO 0.68 0.09 -0.05 1.05 1.06 0.00 0.00 176.91 179.74 1i0r h GLU 74 N 0.13 0.78 -0.33 1.72 9.09 -1.98 0.69 114.58 124.67 1i0r h GLU 74 Ca 0.12 -0.23 -0.06 0.00 0.05 0.00 0.00 59.36 59.24 1i0r h GLU 74 Cb 0.30 -0.08 -0.01 0.00 -1.65 0.00 0.00 28.75 27.30 1i0r h GLU 74 CO -0.02 0.82 -0.03 0.35 0.05 0.00 0.00 179.01 180.18 1i0r h PHE 75 N 0.72 0.66 -0.54 2.06 3.57 -1.58 -1.73 116.94 120.10 1i0r h PHE 75 Ca 0.13 -0.13 -0.04 0.00 3.53 0.00 0.00 57.97 61.47 1i0r h PHE 75 Cb 0.51 -0.17 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 1i0r h PHE 75 CO 0.03 0.74 0.18 0.82 -2.23 0.00 0.00 178.31 177.85 1i0r h ILE 76 N 0.40 1.21 -0.49 1.41 2.04 -1.19 -2.38 117.51 118.51 1i0r h ILE 76 Ca 0.09 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 1i0r h ILE 76 Cb 0.50 0.60 -0.02 0.00 -0.74 0.00 0.00 36.82 37.15 1i0r h ILE 76 CO 0.02 0.26 0.26 1.23 0.00 0.00 0.00 178.15 179.93 1i0r h GLY 77 N 0.93 0.71 0.92 5.37 0.00 -0.20 -2.53 103.07 108.27 1i0r h GLY 77 Ca 0.18 -0.31 0.06 0.00 0.00 0.00 0.00 47.33 47.27 1i0r h GLY 77 CO -0.01 0.29 0.56 3.21 0.00 0.00 0.00 176.54 180.59 1i0r h ARG 78 N 0.68 0.95 -0.63 4.80 3.08 -0.78 -1.83 114.38 120.65 1i0r h ARG 78 Ca 0.17 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.17 1i0r h ARG 78 Cb 0.03 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.86 1i0r h ARG 78 CO -0.03 0.63 0.00 1.19 -1.07 0.00 0.00 179.97 180.69 1i0r n PHE 79 N -4.48 1.17 -0.84 3.04 3.01 -0.96 -4.22 117.46 114.18 1i0r n PHE 79 Ca 0.13 -0.46 0.08 0.00 1.01 0.00 0.00 57.45 58.21 1i0r n PHE 79 Cb 0.19 -0.22 0.14 0.00 -0.01 0.00 0.00 39.48 39.57 1i0r n PHE 79 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1i0r n GLY 80 N 0.87 4.35 3.61 1.37 0.00 -0.69 -1.93 105.19 112.78 1i0r n GLY 80 Ca 0.19 -0.90 -0.38 0.00 0.00 0.00 0.00 46.02 44.93 1i0r n GLY 80 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1i0r s PHE 81 N -2.48 3.25 -0.83 1.61 0.08 -1.25 -4.93 117.98 113.44 1i0r s PHE 81 Ca 0.28 0.28 0.14 0.00 0.12 0.00 0.00 56.93 57.74 1i0r s PHE 81 Cb 0.24 -2.45 0.60 0.00 -0.57 0.00 0.00 43.02 40.83 1i0r s PHE 81 CO 0.04 -0.14 1.42 -2.13 -0.10 0.00 0.00 175.22 174.31 1i0r n ARG 82 N 5.01 0.05 -3.54 0.44 3.00 -1.26 -4.25 116.66 116.12 1i0r n ARG 82 Ca -0.12 0.38 -0.25 0.00 -0.00 0.00 0.00 57.85 57.86 1i0r n ARG 82 Cb 0.51 -1.61 -0.15 0.00 0.00 0.00 0.00 32.46 31.21 1i0r n ARG 82 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 1i0r s LYS 83 N -3.11 0.17 -0.06 -0.14 -0.14 -1.26 -4.97 119.74 110.22 1i0r s LYS 83 Ca 0.04 -0.27 -0.29 0.00 -1.36 0.00 0.00 55.97 54.09 1i0r s LYS 83 Cb 0.07 -1.30 0.10 0.00 -1.68 0.00 0.00 37.83 35.03 1i0r s LYS 83 CO 0.22 -0.88 0.86 -1.54 -0.76 0.00 0.00 175.35 173.26 1i0r s SER 84 N 2.17 -0.44 0.62 2.83 1.04 -1.26 -5.17 113.70 113.48 1i0r s SER 84 Ca 0.07 0.31 -0.09 0.00 0.48 0.00 0.00 55.95 56.71 1i0r s SER 84 Cb -0.16 0.40 -0.01 0.00 0.10 0.00 0.00 66.02 66.35 1i0r s SER 84 CO -0.26 -0.54 0.98 -0.94 0.98 0.00 0.00 173.24 173.47 1i0r s SER 85 N -1.70 5.85 0.45 7.02 1.04 -1.26 -4.93 113.70 120.17 1i0r s SER 85 Ca -0.01 1.10 0.10 0.00 0.48 0.00 0.00 55.95 57.62 1i0r s SER 85 Cb -0.01 -2.10 0.99 0.00 0.10 0.00 0.00 66.02 65.01 1i0r s SER 85 CO -0.01 -1.01 2.08 -0.08 0.98 0.00 0.00 173.24 175.19 1i0r h GLU 86 N -0.31 0.32 -0.18 4.02 4.81 -2.00 -1.85 114.58 119.39 1i0r h GLU 86 Ca -0.45 -0.02 -0.10 0.00 -0.13 0.00 0.00 59.36 58.66 1i0r h GLU 86 Cb 1.23 -0.07 -0.00 0.00 0.63 0.00 0.00 28.75 30.54 1i0r h GLU 86 CO 0.62 0.24 -0.27 0.35 -0.73 0.00 0.00 179.01 179.21 1i0r h PHE 87 N 0.33 0.63 -0.91 0.92 3.57 -1.95 -1.54 116.94 117.99 1i0r h PHE 87 Ca 0.09 -0.21 0.03 0.00 3.53 0.00 0.00 57.97 61.40 1i0r h PHE 87 Cb 0.00 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 38.57 1i0r h PHE 87 CO 0.00 0.92 0.60 0.93 -2.23 0.00 0.00 178.31 178.52 1i0r h GLU 88 N 0.16 1.13 -0.01 1.11 5.08 -1.77 0.50 114.58 120.78 1i0r h GLU 88 Ca 0.02 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.27 1i0r h GLU 88 Cb 0.85 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1i0r h GLU 88 CO 0.06 0.75 -0.13 0.87 -1.00 0.00 0.00 179.01 179.56 1i0r h LYS 89 N 1.16 0.11 0.00 2.33 1.57 -1.30 -3.38 116.57 117.07 1i0r h LYS 89 Ca 0.35 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 59.03 1i0r h LYS 89 Cb -0.03 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1i0r h LYS 89 CO -0.10 0.81 -0.87 1.19 -0.57 0.00 0.00 179.45 179.91 1i0r n PHE 90 N -4.62 0.00 -1.65 -1.35 3.01 -0.59 -4.83 117.46 107.44 1i0r n PHE 90 Ca -0.09 0.00 -0.44 0.00 1.01 0.00 0.00 57.45 57.93 1i0r n PHE 90 Cb 0.42 -0.07 -0.04 0.00 -0.01 0.00 0.00 39.48 39.78 1i0r n PHE 90 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1i0r n ASP 91 N -1.51 3.74 0.00 4.37 2.03 0.16 -1.19 116.55 124.15 1i0r n ASP 91 Ca 0.04 0.77 0.00 0.00 0.52 0.00 0.00 54.79 56.12 1i0r n ASP 91 Cb 0.33 -1.48 0.00 0.00 -0.72 0.00 0.00 41.12 39.25 1i0r n ASP 91 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1i0r n GLY 92 N 4.83 0.69 3.83 0.27 0.00 -1.26 -5.01 105.19 108.54 1i0r n GLY 92 Ca 0.23 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.89 1i0r n GLY 92 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1i0r s VAL 93 N -2.44 5.45 -0.13 1.61 1.01 -0.34 -5.06 120.40 120.50 1i0r s VAL 93 Ca 0.00 0.25 -0.29 0.00 0.00 0.00 0.00 61.98 61.94 1i0r s VAL 93 Cb 0.00 -3.44 -0.01 0.00 0.00 0.00 0.00 36.38 32.93 1i0r s VAL 93 CO 0.00 0.56 1.03 -0.70 0.00 0.00 0.00 175.10 176.00 1i0r s GLU 94 N -0.62 4.37 0.29 2.72 2.12 -1.26 -5.00 118.70 121.31 1i0r s GLU 94 Ca 0.14 1.41 -0.18 0.00 0.36 0.00 0.00 54.97 56.70 1i0r s GLU 94 Cb -0.12 -3.57 0.02 0.00 0.26 0.00 0.00 34.13 30.72 1i0r s GLU 94 CO 0.03 -0.41 0.66 1.52 -0.54 0.00 0.00 175.26 176.52 1i0r s TYR 95 N 2.35 0.03 0.19 5.30 -0.85 -1.26 -1.68 117.35 121.43 1i0r s TYR 95 Ca 0.48 -0.49 -0.05 0.00 -0.52 0.00 0.00 57.07 56.48 1i0r s TYR 95 Cb -0.18 0.57 -0.03 0.00 0.38 0.00 0.00 41.96 42.71 1i0r s TYR 95 CO 0.15 -1.22 0.22 -1.59 -1.52 0.00 0.00 175.55 171.59 1i0r s LYS 96 N -3.69 1.20 -0.16 -3.49 -2.85 -0.70 -4.93 119.74 105.12 1i0r s LYS 96 Ca 0.15 -1.41 -0.02 0.00 -1.00 0.00 0.00 55.97 53.70 1i0r s LYS 96 Cb -0.04 0.33 -0.01 0.00 -2.06 0.00 0.00 37.83 36.04 1i0r s LYS 96 CO 0.09 -0.42 -0.09 0.99 0.10 0.00 0.00 175.35 176.01 1i0r s THR 97 N -4.06 3.25 0.83 3.79 2.01 -1.26 0.15 115.64 120.34 1i0r s THR 97 Ca 0.27 -0.57 -0.12 0.00 0.31 0.00 0.00 61.69 61.59 1i0r s THR 97 Cb 0.05 -2.41 0.11 0.00 0.01 0.00 0.00 72.50 70.26 1i0r s THR 97 CO 0.06 0.49 1.18 -0.83 -0.69 0.00 0.00 174.62 174.84 1i0r s GLY 98 N 0.74 1.67 0.53 4.40 0.00 -0.96 -4.92 107.32 108.78 1i0r s GLY 98 Ca -0.04 -0.90 0.20 0.00 0.00 0.00 0.00 44.72 43.99 1i0r s GLY 98 CO 0.02 -0.34 2.09 0.50 0.00 0.00 0.00 173.10 175.37 1i0r h LYS 99 N -1.12 0.00 0.00 2.90 1.57 -2.00 -0.30 116.57 117.63 1i0r h LYS 99 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1i0r h LYS 99 Cb 1.30 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.61 1i0r h LYS 99 CO 0.56 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.69 1i0r n THR 100 N -4.45 0.56 -0.03 -0.16 -2.24 -1.26 -4.89 114.28 101.80 1i0r n THR 100 Ca 0.02 0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 1i0r n THR 100 Cb 0.30 -0.78 0.00 0.00 -2.10 0.00 0.00 70.33 67.75 1i0r n THR 100 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1i0r n GLY 101 N 0.74 0.46 3.83 3.38 0.00 -0.12 -4.96 105.19 108.53 1i0r n GLY 101 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1i0r n GLY 101 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1i0r s VAL 102 N -2.17 4.53 -0.13 1.61 -7.23 -1.26 -4.72 120.40 111.01 1i0r s VAL 102 Ca 0.00 1.23 -0.28 0.00 -1.81 0.00 0.00 61.98 61.12 1i0r s VAL 102 Cb 0.00 -3.61 -0.01 0.00 0.56 0.00 0.00 36.38 33.32 1i0r s VAL 102 CO 0.00 -0.27 0.97 -2.16 -0.31 0.00 0.00 175.10 173.32 1i0r s PRO 103 N -3.12 4.38 -0.42 4.82 0.04 -1.26 -2.26 135.00 137.17 1i0r s PRO 103 Ca 0.58 1.29 -0.14 0.00 0.04 0.00 0.00 61.00 62.77 1i0r s PRO 103 Cb -0.10 -3.56 0.04 0.00 0.04 0.00 0.00 34.50 30.92 1i0r s PRO 103 CO 0.16 -0.35 0.31 -0.51 0.04 0.00 0.00 177.00 176.65 1i0r s LEU 104 N 2.16 5.19 -0.21 -3.56 1.43 0.12 -4.70 118.68 119.11 1i0r s LEU 104 Ca 0.45 -1.05 -0.29 0.00 -1.03 0.00 0.00 54.13 52.22 1i0r s LEU 104 Cb -0.17 -2.14 -0.00 0.00 0.03 0.00 0.00 46.19 43.90 1i0r s LEU 104 CO 0.15 -0.50 1.22 -0.69 0.23 0.00 0.00 176.35 176.76 1i0r s VAL 105 N 1.64 4.35 -0.26 -1.59 1.01 -1.26 -1.72 120.40 122.56 1i0r s VAL 105 Ca 0.04 1.60 0.22 0.00 0.00 0.00 0.00 61.98 63.84 1i0r s VAL 105 Cb -0.21 -4.11 -0.29 0.00 0.00 0.00 0.00 36.38 31.77 1i0r s VAL 105 CO 0.08 -0.23 0.61 0.35 0.00 0.00 0.00 175.10 175.92 1i0r n THR 106 N 5.55 0.03 -1.98 3.92 -2.24 -0.68 -4.73 114.28 114.15 1i0r n THR 106 Ca 0.14 -0.39 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 1i0r n THR 106 Cb 0.45 0.20 -0.03 0.00 -2.10 0.00 0.00 70.33 68.85 1i0r n THR 106 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 1i0r s GLN 107 N -3.39 4.23 -2.02 -0.78 0.74 -1.03 -2.20 119.66 115.20 1i0r s GLN 107 Ca -0.04 2.30 0.00 0.00 0.05 0.00 0.00 55.36 57.67 1i0r s GLN 107 Cb 0.14 -3.23 0.00 0.00 1.10 0.00 0.00 33.01 31.02 1i0r s GLN 107 CO 0.89 -0.59 0.00 0.72 -0.55 0.00 0.00 175.29 175.76 1i0r n HIS 108 N 4.18 -0.05 -4.15 1.67 8.25 -1.26 -4.98 115.22 118.87 1i0r n HIS 108 Ca 0.14 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.25 1i0r n HIS 108 Cb 0.39 -3.27 -0.10 0.00 1.12 0.00 0.00 29.99 28.13 1i0r n HIS 108 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1i0r s ALA 109 N -2.73 3.31 0.08 -1.41 0.00 -0.94 -0.84 121.76 119.24 1i0r s ALA 109 Ca 0.00 -0.77 0.08 0.00 0.00 0.00 0.00 51.96 51.28 1i0r s ALA 109 Cb 0.00 -1.76 -0.16 0.00 0.00 0.00 0.00 23.12 21.20 1i0r s ALA 109 CO 0.00 0.28 1.31 0.28 0.00 0.00 0.00 175.76 177.63 1i0r h VAL 110 N 4.78 1.58 -3.08 0.00 2.07 -1.01 -3.37 116.25 117.21 1i0r h VAL 110 Ca -0.39 -3.22 -0.03 0.00 0.82 0.00 0.00 66.70 63.88 1i0r h VAL 110 Cb 1.18 2.77 -0.12 0.00 -1.52 0.00 0.00 31.29 33.60 1i0r h VAL 110 CO 0.66 0.90 0.13 0.00 0.02 0.00 0.00 177.57 179.28 1i0r s ALA 111 N -2.76 -1.43 0.02 1.67 0.00 -1.25 -0.23 121.76 117.79 1i0r s ALA 111 Ca 0.01 0.37 0.03 0.00 0.00 0.00 0.00 51.96 52.38 1i0r s ALA 111 Cb 0.10 0.81 -0.02 0.00 0.00 0.00 0.00 23.12 24.01 1i0r s ALA 111 CO 0.81 -0.73 -0.10 0.14 0.00 0.00 0.00 175.76 175.88 1i0r s VAL 112 N -3.69 0.75 -0.01 0.00 -7.23 -0.69 -1.11 120.40 108.43 1i0r s VAL 112 Ca 0.01 -0.78 0.03 0.00 -1.81 0.00 0.00 61.98 59.43 1i0r s VAL 112 Cb -0.00 -0.70 -0.01 0.00 0.56 0.00 0.00 36.38 36.23 1i0r s VAL 112 CO -0.12 -0.06 -0.10 -0.63 -0.31 0.00 0.00 175.10 173.89 1i0r s ILE 113 N -0.76 0.76 -0.06 -0.62 1.01 -0.25 -1.37 121.20 119.91 1i0r s ILE 113 Ca -0.01 -0.43 0.05 0.00 0.00 0.00 0.00 60.65 60.26 1i0r s ILE 113 Cb -0.07 -0.64 -0.02 0.00 0.01 0.00 0.00 42.46 41.75 1i0r s ILE 113 CO 0.00 0.20 -0.22 -0.70 0.00 0.00 0.00 174.94 174.23 1i0r s GLU 114 N -0.26 2.55 0.01 2.79 2.12 -0.34 -0.74 118.70 124.82 1i0r s GLU 114 Ca 0.03 -0.85 -0.02 0.00 0.36 0.00 0.00 54.97 54.49 1i0r s GLU 114 Cb -0.04 -2.23 -0.01 0.00 0.26 0.00 0.00 34.13 32.11 1i0r s GLU 114 CO -0.00 0.45 0.03 0.00 -0.54 0.00 0.00 175.26 175.19 1i0r s ALA 115 N -0.31 -0.04 -0.14 6.30 0.00 -0.29 -0.49 121.76 126.79 1i0r s ALA 115 Ca 0.01 -0.39 -0.04 0.00 0.00 0.00 0.00 51.96 51.54 1i0r s ALA 115 Cb -0.13 0.12 -0.03 0.00 0.00 0.00 0.00 23.12 23.08 1i0r s ALA 115 CO 0.02 -0.17 0.00 -1.59 0.00 0.00 0.00 175.76 174.03 1i0r s LYS 116 N -1.34 3.56 0.07 0.00 -2.85 -0.48 -1.76 119.74 116.95 1i0r s LYS 116 Ca -0.15 -0.44 -0.31 0.00 -1.00 0.00 0.00 55.97 54.08 1i0r s LYS 116 Cb -0.09 -2.96 -0.08 0.00 -2.06 0.00 0.00 37.83 32.64 1i0r s LYS 116 CO -0.00 0.39 1.54 0.08 0.10 0.00 0.00 175.35 177.45 1i0r s VAL 117 N -0.00 3.19 -0.18 1.79 1.01 0.07 -0.05 120.40 126.23 1i0r s VAL 117 Ca 0.03 0.70 0.04 0.00 0.00 0.00 0.00 61.98 62.75 1i0r s VAL 117 Cb -0.13 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 1i0r s VAL 117 CO 0.02 0.01 0.16 1.33 0.00 0.00 0.00 175.10 176.63 1i0r n VAL 118 N 4.49 0.00 -3.56 2.92 0.24 0.44 -4.91 118.33 117.95 1i0r n VAL 118 Ca 0.14 -0.39 -0.14 0.00 -2.04 0.00 0.00 64.34 61.91 1i0r n VAL 118 Cb 0.41 0.97 -0.06 0.00 -1.47 0.00 0.00 33.84 33.69 1i0r n VAL 118 CO 0.00 0.00 0.00 -0.75 -2.14 0.00 0.00 176.83 173.94 1i0r s LYS 119 N -1.42 0.82 -0.06 7.34 2.20 -1.11 -5.02 119.74 122.49 1i0r s LYS 119 Ca 0.01 0.27 0.04 0.00 -0.36 0.00 0.00 55.97 55.93 1i0r s LYS 119 Cb 0.03 0.39 0.00 0.00 -1.51 0.00 0.00 37.83 36.74 1i0r s LYS 119 CO 0.16 -0.24 -0.18 -1.21 -0.36 0.00 0.00 175.35 173.52 1i0r s GLU 120 N -1.00 2.16 -0.34 4.03 2.02 -1.26 -0.59 118.70 123.72 1i0r s GLU 120 Ca -0.06 -0.66 0.00 0.00 0.02 0.00 0.00 54.97 54.28 1i0r s GLU 120 Cb -0.01 -1.76 0.09 0.00 0.10 0.00 0.00 34.13 32.55 1i0r s GLU 120 CO 0.05 0.19 0.06 0.00 0.02 0.00 0.00 175.26 175.58 1i0r s ASP 122 N 1.29 7.02 -0.23 0.00 -1.08 -1.26 -0.66 116.67 121.74 1i0r s ASP 122 Ca 0.04 1.39 0.11 0.00 -0.52 0.00 0.00 52.55 53.57 1i0r s ASP 122 Cb -0.20 -2.54 0.45 0.00 -1.46 0.00 0.00 42.92 39.17 1i0r s ASP 122 CO -0.05 -0.74 1.33 1.33 0.52 0.00 0.00 175.17 177.56 1i0r n VAL 123 N 5.45 2.33 0.00 1.11 0.24 -0.67 -4.98 118.33 121.81 1i0r n VAL 123 Ca 0.13 -2.83 0.00 0.00 -2.04 0.00 0.00 64.34 59.59 1i0r n VAL 123 Cb 0.46 -0.27 0.00 0.00 -1.47 0.00 0.00 33.84 32.55 1i0r n VAL 123 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1i0r n GLY 124 N -1.11 0.89 0.13 7.63 0.00 -1.26 -4.40 105.19 107.06 1i0r n GLY 124 Ca 0.25 -0.76 0.13 0.00 0.00 0.00 0.00 46.02 45.64 1i0r n GLY 124 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1i0r h THR 125 N 0.00 0.00 -3.86 2.61 1.35 -1.97 -3.46 112.91 107.58 1i0r h THR 125 Ca 0.00 -0.42 -0.31 0.00 -0.55 0.00 0.00 66.41 65.13 1i0r h THR 125 Cb 0.00 1.33 -0.15 0.00 -1.73 0.00 0.00 68.15 67.60 1i0r h THR 125 CO 0.00 0.00 -0.64 -1.00 -0.25 0.00 0.00 175.52 173.63 1i0r s HIS 126 N -3.20 1.33 -0.07 4.73 3.76 -1.26 -1.75 115.29 118.83 1i0r s HIS 126 Ca 0.08 -1.12 0.04 0.00 -0.15 0.00 0.00 55.06 53.91 1i0r s HIS 126 Cb 0.11 -0.76 -0.00 0.00 1.11 0.00 0.00 32.58 33.04 1i0r s HIS 126 CO 0.53 -0.31 -0.20 0.99 -0.85 0.00 0.00 174.74 174.90 1i0r s THR 127 N -3.75 1.70 -0.34 1.30 2.01 -0.56 -1.67 115.64 114.34 1i0r s THR 127 Ca 0.31 -0.84 -0.15 0.00 0.31 0.00 0.00 61.69 61.32 1i0r s THR 127 Cb 0.07 -1.47 -0.01 0.00 0.01 0.00 0.00 72.50 71.09 1i0r s THR 127 CO 0.09 0.48 0.35 -0.22 -0.69 0.00 0.00 174.62 174.63 1i0r s LEU 128 N 0.22 4.40 -0.16 4.42 2.96 0.16 -1.67 118.68 129.01 1i0r s LEU 128 Ca -0.11 -0.20 -0.15 0.00 -0.22 0.00 0.00 54.13 53.45 1i0r s LEU 128 Cb -0.15 -2.33 -0.04 0.00 0.50 0.00 0.00 46.19 44.16 1i0r s LEU 128 CO 0.05 -0.32 0.34 -0.36 -1.32 0.00 0.00 176.35 174.74 1i0r s PHE 129 N 2.00 3.46 -0.30 5.38 0.40 0.08 -0.75 117.98 128.26 1i0r s PHE 129 Ca 0.12 0.65 -0.10 0.00 -0.60 0.00 0.00 56.93 57.00 1i0r s PHE 129 Cb -0.16 -2.41 -0.02 0.00 0.51 0.00 0.00 43.02 40.94 1i0r s PHE 129 CO 0.11 0.19 0.15 0.08 0.70 0.00 0.00 175.22 176.46 1i0r s VAL 130 N 0.61 4.74 0.03 -0.44 1.01 0.25 -1.67 120.40 124.93 1i0r s VAL 130 Ca 0.19 -0.24 0.06 0.00 0.00 0.00 0.00 61.98 61.98 1i0r s VAL 130 Cb -0.14 -3.35 -0.03 0.00 0.00 0.00 0.00 36.38 32.86 1i0r s VAL 130 CO 0.06 0.15 -0.16 -0.83 0.00 0.00 0.00 175.10 174.32 1i0r s GLY 131 N 1.65 1.60 -0.15 4.51 0.00 0.95 -0.42 107.32 115.45 1i0r s GLY 131 Ca 0.06 -1.14 -0.20 0.00 0.00 0.00 0.00 44.72 43.43 1i0r s GLY 131 CO 0.07 -1.02 0.59 1.85 0.00 0.00 0.00 173.10 174.59 1i0r s GLU 132 N -1.38 4.28 0.12 2.90 2.12 0.93 -0.15 118.70 127.53 1i0r s GLU 132 Ca 0.15 0.60 -0.31 0.00 0.36 0.00 0.00 54.97 55.77 1i0r s GLU 132 Cb -0.11 -3.52 -0.09 0.00 0.26 0.00 0.00 34.13 30.68 1i0r s GLU 132 CO 0.05 -0.08 1.48 0.00 -0.54 0.00 0.00 175.26 176.17 1i0r s ALA 133 N 1.37 3.67 -0.13 6.30 0.00 -0.47 -1.38 121.76 131.12 1i0r s ALA 133 Ca 0.29 1.21 0.09 0.00 0.00 0.00 0.00 51.96 53.54 1i0r s ALA 133 Cb -0.16 -3.58 -0.12 0.00 0.00 0.00 0.00 23.12 19.25 1i0r s ALA 133 CO 0.12 -0.73 0.24 1.33 0.00 0.00 0.00 175.76 176.72 1i0r n VAL 134 N 4.06 0.00 -3.46 0.00 0.24 0.36 -4.89 118.33 114.64 1i0r n VAL 134 Ca 0.13 -0.23 -0.13 0.00 -2.04 0.00 0.00 64.34 62.07 1i0r n VAL 134 Cb 0.41 0.52 -0.03 0.00 -1.47 0.00 0.00 33.84 33.26 1i0r n VAL 134 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1i0r s ASP 135 N -2.64 -0.56 -0.27 -1.34 3.68 -1.18 -5.00 116.67 109.37 1i0r s ASP 135 Ca -0.01 0.11 -0.25 0.00 2.13 0.00 0.00 52.55 54.53 1i0r s ASP 135 Cb 0.06 0.58 0.13 0.00 -1.45 0.00 0.00 42.92 42.23 1i0r s ASP 135 CO 0.36 -0.89 1.05 0.00 0.13 0.00 0.00 175.17 175.82 1i0r s ALA 136 N -3.24 -1.98 -0.05 3.66 0.00 -1.26 -1.20 121.76 117.69 1i0r s ALA 136 Ca -0.01 1.84 -0.14 0.00 0.00 0.00 0.00 51.96 53.65 1i0r s ALA 136 Cb -0.01 -1.39 0.03 0.00 0.00 0.00 0.00 23.12 21.75 1i0r s ALA 136 CO -0.08 -0.24 0.32 -1.83 0.00 0.00 0.00 175.76 173.93 1i0r s GLU 137 N 0.11 0.57 -0.14 0.00 -1.05 -0.47 -5.01 118.70 112.71 1i0r s GLU 137 Ca 0.03 0.04 -0.18 0.00 -0.15 0.00 0.00 54.97 54.71 1i0r s GLU 137 Cb -0.05 0.26 -0.04 0.00 -0.44 0.00 0.00 34.13 33.86 1i0r s GLU 137 CO -0.06 -0.14 0.47 0.08 0.95 0.00 0.00 175.26 176.56 1i0r s VAL 138 N -0.80 5.19 -0.12 1.83 1.01 -1.26 -1.70 120.40 124.55 1i0r s VAL 138 Ca -0.09 0.91 0.12 0.00 0.00 0.00 0.00 61.98 62.93 1i0r s VAL 138 Cb -0.04 -3.80 -0.18 0.00 0.00 0.00 0.00 36.38 32.36 1i0r s VAL 138 CO 0.03 0.31 0.08 0.18 0.00 0.00 0.00 175.10 175.70 1i0r n LEU 139 N 3.85 0.00 -4.05 3.92 4.77 0.68 -4.96 117.00 121.21 1i0r n LEU 139 Ca -0.07 0.00 -0.07 0.00 -0.03 0.00 0.00 56.01 55.83 1i0r n LEU 139 Cb 0.51 0.29 -0.10 0.00 -2.33 0.00 0.00 43.42 41.80 1i0r n LEU 139 CO 0.43 0.29 -0.31 -0.54 -1.33 0.00 0.00 177.39 175.92 1i0r s LYS 140 N -2.42 0.65 0.00 3.23 1.02 -1.04 -5.02 119.74 116.15 1i0r s LYS 140 Ca -0.07 -1.16 0.28 0.00 0.02 0.00 0.00 55.97 55.05 1i0r s LYS 140 Cb 0.05 0.23 1.05 0.00 -0.52 0.00 0.00 37.83 38.64 1i0r s LYS 140 CO 0.56 -0.14 1.78 -3.47 -0.92 0.00 0.00 175.35 173.17 1i0r n ASP 141 N 0.11 0.25 -4.69 2.83 -0.08 -1.26 -4.85 116.55 108.86 1i0r n ASP 141 Ca -0.14 -0.00 -0.33 0.00 -1.51 0.00 0.00 54.79 52.80 1i0r n ASP 141 Cb 0.61 -0.18 0.13 0.00 2.34 0.00 0.00 41.12 44.03 1i0r n ASP 141 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1i0r s ALA 142 N -2.85 1.77 0.50 -1.67 0.00 -1.26 -5.02 121.76 113.23 1i0r s ALA 142 Ca 0.18 0.80 -0.19 0.00 0.00 0.00 0.00 51.96 52.75 1i0r s ALA 142 Cb 0.19 -3.49 -0.08 0.00 0.00 0.00 0.00 23.12 19.74 1i0r s ALA 142 CO 0.56 -2.39 1.02 -1.21 0.00 0.00 0.00 175.76 173.74 1i0r s GLU 143 N -4.23 3.80 0.41 0.00 0.41 -1.26 -4.92 118.70 112.91 1i0r s GLU 143 Ca 0.72 1.25 -0.06 0.00 -0.41 0.00 0.00 54.97 56.47 1i0r s GLU 143 Cb -0.28 -2.10 -0.05 0.00 -1.78 0.00 0.00 34.13 29.93 1i0r s GLU 143 CO 0.52 -0.42 0.72 0.14 -0.49 0.00 0.00 175.26 175.73 1i0r s VAL 144 N -2.17 4.92 -0.23 2.63 -7.23 -1.26 -0.15 120.40 116.91 1i0r s VAL 144 Ca 0.65 0.21 -0.17 0.00 -1.81 0.00 0.00 61.98 60.86 1i0r s VAL 144 Cb -0.14 -3.81 -0.03 0.00 0.56 0.00 0.00 36.38 32.95 1i0r s VAL 144 CO 0.23 -0.65 0.44 -0.22 -0.31 0.00 0.00 175.10 174.60 1i0r s LEU 145 N -4.27 4.10 0.39 1.32 2.96 -0.43 -4.09 118.68 118.67 1i0r s LEU 145 Ca 0.47 0.49 0.00 0.00 -0.22 0.00 0.00 54.13 54.88 1i0r s LEU 145 Cb -0.10 -2.56 -0.02 0.00 0.50 0.00 0.00 46.19 44.01 1i0r s LEU 145 CO 0.38 -0.17 0.61 0.42 -1.32 0.00 0.00 176.35 176.27 1i0r s THR 146 N 1.78 4.59 0.21 3.68 -4.23 -1.26 -2.49 115.64 117.92 1i0r s THR 146 Ca 0.19 -0.48 -0.08 0.00 -1.18 0.00 0.00 61.69 60.15 1i0r s THR 146 Cb -0.15 -3.68 0.16 0.00 1.34 0.00 0.00 72.50 70.16 1i0r s THR 146 CO 0.09 -0.46 1.78 0.22 -0.54 0.00 0.00 174.62 175.71 1i0r h TYR 147 N 0.59 1.21 -0.60 3.99 3.20 -1.15 -1.58 116.97 122.62 1i0r h TYR 147 Ca -0.48 -0.09 -0.06 0.00 3.14 0.00 0.00 58.73 61.24 1i0r h TYR 147 Cb 1.23 -0.36 -0.03 0.00 1.54 0.00 0.00 36.73 39.12 1i0r h TYR 147 CO 0.48 0.91 0.14 0.00 -1.64 0.00 0.00 178.16 178.05 1i0r h ALA 148 N 1.17 1.10 0.23 1.82 0.00 -1.93 -1.61 119.26 120.04 1i0r h ALA 148 Ca 0.27 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 1i0r h ALA 148 Cb 0.21 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1i0r h ALA 148 CO -0.02 0.60 -0.11 -0.44 0.00 0.00 0.00 179.25 179.27 1i0r h ASP 149 N 0.90 -0.26 -0.61 0.00 3.45 -1.84 -1.62 116.42 116.45 1i0r h ASP 149 Ca 0.19 0.01 0.11 0.00 0.43 0.00 0.00 57.03 57.77 1i0r h ASP 149 Cb 0.34 0.07 -0.08 0.00 -0.56 0.00 0.00 39.33 39.09 1i0r h ASP 149 CO 0.00 -0.18 0.16 0.22 -1.57 0.00 0.00 179.24 177.86 1i0r h TYR 150 N -0.31 0.26 -0.12 4.55 3.20 -0.99 0.16 116.97 123.72 1i0r h TYR 150 Ca -0.03 0.03 -0.00 0.00 3.14 0.00 0.00 58.73 61.87 1i0r h TYR 150 Cb 0.24 -0.02 -0.01 0.00 1.54 0.00 0.00 36.73 38.48 1i0r h TYR 150 CO -0.06 -0.00 0.07 1.25 -1.64 0.00 0.00 178.16 177.78 1i0r h HIS 151 N 0.30 0.16 0.66 -3.82 2.76 -0.99 0.27 115.15 114.49 1i0r h HIS 151 Ca 0.32 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.45 1i0r h HIS 151 Cb 0.46 -0.05 0.01 0.00 1.55 0.00 0.00 27.41 29.37 1i0r h HIS 151 CO -0.23 0.15 -0.32 -0.07 -1.30 0.00 0.00 177.93 176.17 1i0r h LEU 152 N 0.12 -0.76 -0.22 0.26 3.38 -0.78 -2.37 115.31 114.96 1i0r h LEU 152 Ca 0.04 0.02 0.06 0.00 0.09 0.00 0.00 57.88 58.09 1i0r h LEU 152 Cb 0.04 0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.91 1i0r h LEU 152 CO -0.01 -0.53 -0.30 0.24 0.09 0.00 0.00 178.44 177.94 1i0r h MET 153 N -0.92 -0.31 -0.70 1.13 2.86 -0.91 -0.01 114.93 116.07 1i0r h MET 153 Ca -0.09 0.02 0.14 0.00 -2.06 0.00 0.00 59.70 57.71 1i0r h MET 153 Cb 0.69 0.07 -0.13 0.00 0.06 0.00 0.00 31.60 32.29 1i0r h MET 153 CO 0.15 -0.21 -0.21 -0.22 1.06 0.00 0.00 176.91 177.48 1i0r h LYS 154 N -0.32 -0.03 -0.06 1.72 3.64 -0.38 0.26 116.57 121.39 1i0r h LYS 154 Ca 0.12 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.50 1i0r h LYS 154 Cb 0.52 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.34 1i0r h LYS 154 CO -0.40 -0.02 0.03 0.87 -2.27 0.00 0.00 179.45 177.66 1i0r h LYS 155 N -0.03 0.09 0.00 1.90 1.57 -0.78 -3.47 116.57 115.85 1i0r h LYS 155 Ca 0.33 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.09 1i0r h LYS 155 Cb 0.54 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.83 1i0r h LYS 155 CO -0.74 0.17 0.00 0.41 -0.57 0.00 0.00 179.45 178.72 1i0r n GLY 156 N -0.81 0.68 3.32 3.86 0.00 0.08 -5.12 105.19 107.19 1i0r n GLY 156 Ca -0.06 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.67 1i0r n GLY 156 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1i0r n LYS 157 N 0.00 -2.89 -3.55 1.61 4.76 -0.75 -4.88 118.16 112.46 1i0r n LYS 157 Ca 0.00 -0.83 -0.37 0.00 -2.87 0.00 0.00 58.31 54.23 1i0r n LYS 157 Cb 0.00 -1.93 -0.06 0.00 -1.84 0.00 0.00 35.03 31.20 1i0r n LYS 157 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 1i0r s THR 158 N -2.26 5.22 1.04 -0.18 -1.32 -1.26 -4.05 115.64 112.82 1i0r s THR 158 Ca 0.62 0.66 -0.18 0.00 -1.21 0.00 0.00 61.69 61.58 1i0r s THR 158 Cb -0.18 -3.65 0.01 0.00 -1.51 0.00 0.00 72.50 67.17 1i0r s THR 158 CO 0.61 0.49 -0.21 -2.65 -2.21 0.00 0.00 174.62 170.65 1i0r n PRO 159 N 2.69 -0.79 -0.34 7.08 -0.02 -1.26 -4.77 135.00 137.59 1i0r n PRO 159 Ca -0.13 -0.21 0.10 0.00 -2.02 0.00 0.00 63.50 61.23 1i0r n PRO 159 Cb 0.52 -1.56 0.27 0.00 -0.02 0.00 0.00 33.50 32.72 1i0r n PRO 159 CO 0.00 0.00 0.00 -0.09 1.98 0.00 0.00 175.50 177.39 1i0r h ARG 160 N -1.64 0.74 0.00 -0.52 2.43 -1.93 -1.70 114.38 111.76 1i0r h ARG 160 Ca -0.47 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.65 1i0r h ARG 160 Cb 1.34 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.72 1i0r h ARG 160 CO 0.33 0.49 0.51 -2.37 -1.51 0.00 0.00 179.97 177.42 1i0r n THR 161 N -4.77 0.31 0.10 0.20 5.66 -1.26 -0.08 114.28 114.43 1i0r n THR 161 Ca 0.20 0.64 0.03 0.00 -3.05 0.00 0.00 64.05 61.87 1i0r n THR 161 Cb 0.48 -1.64 -0.01 0.00 -1.55 0.00 0.00 70.33 67.60 1i0r n THR 161 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1i0r h ALA 162 N 0.43 0.66 0.00 1.79 0.00 -1.61 -3.41 119.26 117.13 1i0r h ALA 162 Ca 0.00 -0.55 -0.08 0.00 0.00 0.00 0.00 54.91 54.29 1i0r h ALA 162 Cb 1.01 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.85 1i0r h ALA 162 CO 0.00 0.66 -1.28 0.25 0.00 0.00 0.00 179.25 178.88 1i0r n THR 163 N -3.05 0.29 -2.82 0.00 -2.24 0.88 -4.99 114.28 102.35 1i0r n THR 163 Ca -0.03 -0.13 -0.42 0.00 -2.27 0.00 0.00 64.05 61.20 1i0r n THR 163 Cb 0.75 -0.76 -0.04 0.00 -2.10 0.00 0.00 70.33 68.19 1i0r n THR 163 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1i0r s VAL 164 N -2.10 4.76 -0.09 2.28 1.01 -1.03 -5.03 120.40 120.20 1i0r s VAL 164 Ca -0.05 1.64 0.02 0.00 0.00 0.00 0.00 61.98 63.59 1i0r s VAL 164 Cb 0.02 -4.20 0.01 0.00 0.00 0.00 0.00 36.38 32.21 1i0r s VAL 164 CO 0.13 -0.16 -0.15 -0.47 0.00 0.00 0.00 175.10 174.46 1i0r s TYR 165 N 3.02 1.84 -0.31 5.22 5.04 -1.26 -4.74 117.35 126.15 1i0r s TYR 165 Ca 0.38 -0.80 -0.08 0.00 -2.44 0.00 0.00 57.07 54.13 1i0r s TYR 165 Cb -0.15 -1.32 0.01 0.00 0.35 0.00 0.00 41.96 40.84 1i0r s TYR 165 CO 0.08 -0.41 0.12 -0.06 -1.34 0.00 0.00 175.55 173.95 1i0r s PHE 166 N 0.85 3.17 0.15 4.97 0.40 -1.26 -5.09 117.98 121.17 1i0r s PHE 166 Ca -0.10 -0.86 0.06 0.00 -0.60 0.00 0.00 56.93 55.44 1i0r s PHE 166 Cb -0.15 -2.31 -0.04 0.00 0.51 0.00 0.00 43.02 41.03 1i0r s PHE 166 CO 0.01 -0.55 0.02 -2.00 0.70 0.00 0.00 175.22 173.40 1i0r s GLU 167 N 1.54 2.50 0.00 0.44 -6.30 -1.26 -5.34 118.70 110.29 1i0r s GLU 167 Ca 0.03 -0.99 0.27 0.00 -2.50 0.00 0.00 54.97 51.78 1i0r s GLU 167 Cb -0.17 -2.45 0.91 0.00 0.00 0.00 0.00 34.13 32.41 1i0r s GLU 167 CO 0.04 0.49 1.66 -1.13 0.02 0.00 0.00 175.26 176.34