#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1i9b s ASP 2 N 0.00 2.26 0.34 5.98 -4.77 -1.26 -4.56 116.67 114.66 1i9b s ASP 2 Ca 0.00 1.37 0.12 0.00 -3.30 0.00 0.00 52.55 50.73 1i9b s ASP 2 Cb 0.00 -2.06 0.92 0.00 -1.09 0.00 0.00 42.92 40.69 1i9b s ASP 2 CO 0.00 -3.38 1.76 0.03 0.70 0.00 0.00 175.17 174.27 1i9b h ARG 3 N -2.06 0.55 -0.12 2.11 2.47 -1.99 -0.09 114.38 115.24 1i9b h ARG 3 Ca -0.55 -0.03 -0.01 0.00 -1.26 0.00 0.00 59.98 58.13 1i9b h ARG 3 Cb 1.32 -0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 29.51 1i9b h ARG 3 CO 0.54 0.36 0.06 0.00 0.56 0.00 0.00 179.97 181.49 1i9b h ALA 4 N 1.67 0.16 -0.72 0.04 0.00 -1.99 -1.08 119.26 117.35 1i9b h ALA 4 Ca 0.61 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.42 1i9b h ALA 4 Cb 1.23 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 1i9b h ALA 4 CO -0.39 -0.27 0.40 -0.44 0.00 0.00 0.00 179.25 178.55 1i9b h ASP 5 N 0.06 0.88 0.29 0.00 3.32 -1.38 0.66 116.42 120.24 1i9b h ASP 5 Ca 0.04 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 57.01 1i9b h ASP 5 Cb 0.14 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.47 1i9b h ASP 5 CO -0.00 0.70 -0.14 0.40 -1.72 0.00 0.00 179.24 178.48 1i9b h ILE 6 N 1.00 0.74 -0.63 0.35 2.04 -0.92 -2.21 117.51 117.87 1i9b h ILE 6 Ca 0.26 -0.58 0.00 0.00 1.00 0.00 0.00 64.86 65.54 1i9b h ILE 6 Cb 0.01 1.04 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 1i9b h ILE 6 CO -0.04 0.12 0.41 -0.07 0.00 0.00 0.00 178.15 178.56 1i9b h LEU 7 N -0.71 0.73 -0.97 1.44 3.38 -1.09 -2.44 115.31 115.65 1i9b h LEU 7 Ca -0.04 -0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.01 1i9b h LEU 7 Cb 0.48 -0.18 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 1i9b h LEU 7 CO 0.06 0.54 0.61 0.22 0.09 0.00 0.00 178.44 179.96 1i9b h TYR 8 N 0.86 1.11 0.27 1.13 3.20 -0.85 -0.11 116.97 122.58 1i9b h TYR 8 Ca 0.23 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 62.12 1i9b h TYR 8 Cb -0.09 -0.35 0.00 0.00 1.54 0.00 0.00 36.73 37.83 1i9b h TYR 8 CO -0.03 0.48 -0.13 -0.91 -1.64 0.00 0.00 178.16 175.93 1i9b h ASN 9 N 1.01 -0.31 -0.82 -2.11 4.21 -0.98 -1.13 115.58 115.45 1i9b h ASN 9 Ca 0.46 -0.20 0.13 0.00 1.21 0.00 0.00 56.30 57.90 1i9b h ASN 9 Cb 0.38 0.08 -0.09 0.00 -1.12 0.00 0.00 38.32 37.57 1i9b h ASN 9 CO -0.24 0.07 0.42 0.40 -1.29 0.00 0.00 177.43 176.80 1i9b h ILE 10 N -0.73 0.77 -0.23 2.81 2.04 -1.17 0.95 117.51 121.95 1i9b h ILE 10 Ca -0.04 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.58 1i9b h ILE 10 Cb 0.49 0.08 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 1i9b h ILE 10 CO 0.06 0.12 0.06 -0.09 0.00 0.00 0.00 178.15 178.30 1i9b h ARG 11 N 0.64 0.36 0.00 2.37 2.43 -0.98 0.15 114.38 119.36 1i9b h ARG 11 Ca 0.43 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.45 1i9b h ARG 11 Cb 0.56 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.05 1i9b h ARG 11 CO -0.33 0.46 -0.33 0.37 -1.51 0.00 0.00 179.97 178.63 1i9b h GLN 12 N 0.20 0.00 0.00 0.20 5.75 -0.36 -3.34 115.11 117.56 1i9b h GLN 12 Ca 0.07 0.00 -0.00 0.00 -0.15 0.00 0.00 58.65 58.57 1i9b h GLN 12 Cb 0.26 0.00 -0.00 0.00 1.07 0.00 0.00 27.48 28.81 1i9b h GLN 12 CO -0.00 0.33 -1.53 0.25 -2.65 0.00 0.00 178.83 175.23 1i9b n THR 13 N -3.45 0.01 -1.49 2.39 -2.24 0.25 -5.04 114.28 104.71 1i9b n THR 13 Ca 0.00 -0.27 -0.32 0.00 -2.27 0.00 0.00 64.05 61.19 1i9b n THR 13 Cb 0.50 0.22 0.08 0.00 -2.10 0.00 0.00 70.33 69.02 1i9b n THR 13 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1i9b s SER 14 N -3.34 4.65 -0.33 3.42 0.15 0.54 -5.04 113.70 113.74 1i9b s SER 14 Ca -0.04 2.01 -0.01 0.00 0.70 0.00 0.00 55.95 58.60 1i9b s SER 14 Cb 0.07 -2.55 0.13 0.00 -1.71 0.00 0.00 66.02 61.96 1i9b s SER 14 CO 0.48 -1.94 0.18 -0.13 1.20 0.00 0.00 173.24 173.02 1i9b s ARG 15 N -4.35 0.47 0.65 5.44 0.52 -1.26 -4.99 118.95 115.43 1i9b s ARG 15 Ca 0.66 -1.08 0.35 0.00 -0.52 0.00 0.00 55.73 55.13 1i9b s ARG 15 Cb -0.21 -1.33 1.90 0.00 0.52 0.00 0.00 34.95 35.84 1i9b s ARG 15 CO 0.47 -1.14 2.11 -1.35 0.02 0.00 0.00 175.30 175.41 1i9b h PRO 16 N 7.51 0.00 -0.07 3.54 0.11 -1.81 -1.61 132.00 139.66 1i9b h PRO 16 Ca -0.04 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.07 1i9b h PRO 16 Cb 0.98 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1i9b h PRO 16 CO 0.34 0.00 0.00 -0.25 -0.21 0.00 0.00 178.00 177.88 1i9b n ASP 17 N -3.16 1.59 -4.13 -2.05 8.00 -1.26 -4.25 116.55 111.28 1i9b n ASP 17 Ca -0.01 -1.58 -0.33 0.00 0.71 0.00 0.00 54.79 53.58 1i9b n ASP 17 Cb 0.28 -0.04 -0.16 0.00 -0.02 0.00 0.00 41.12 41.18 1i9b n ASP 17 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1i9b s VAL 18 N -1.92 2.25 0.10 2.53 1.01 -0.61 -5.09 120.40 118.67 1i9b s VAL 18 Ca 0.36 -1.04 -0.31 0.00 0.00 0.00 0.00 61.98 60.99 1i9b s VAL 18 Cb 0.20 -2.04 -0.09 0.00 0.00 0.00 0.00 36.38 34.45 1i9b s VAL 18 CO 0.31 0.40 1.59 -0.51 0.00 0.00 0.00 175.10 176.89 1i9b s ILE 19 N 1.27 2.95 0.00 2.22 2.07 -1.26 -4.82 121.20 123.64 1i9b s ILE 19 Ca 0.02 0.54 -0.01 0.00 -1.41 0.00 0.00 60.65 59.79 1i9b s ILE 19 Cb -0.15 -3.35 -0.06 0.00 0.13 0.00 0.00 42.46 39.04 1i9b s ILE 19 CO -0.10 0.02 1.19 -2.65 -1.91 0.00 0.00 174.94 171.49 1i9b n PRO 20 N 4.91 0.50 -2.66 3.50 -0.02 -1.26 -4.89 135.00 135.08 1i9b n PRO 20 Ca 0.15 -0.22 -0.41 0.00 -2.02 0.00 0.00 63.50 61.00 1i9b n PRO 20 Cb 0.40 -1.58 -0.05 0.00 -0.02 0.00 0.00 33.50 32.26 1i9b n PRO 20 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1i9b s THR 21 N 2.23 4.20 -0.37 3.45 -1.32 -1.26 -4.87 115.64 117.70 1i9b s THR 21 Ca 0.15 1.92 -0.05 0.00 -1.21 0.00 0.00 61.69 62.50 1i9b s THR 21 Cb 0.07 -4.22 0.07 0.00 -1.51 0.00 0.00 72.50 66.91 1i9b s THR 21 CO 0.00 0.34 0.14 -1.10 -2.21 0.00 0.00 174.62 171.79 1i9b s GLN 22 N -0.37 2.37 3.34 7.08 -0.21 -1.24 -5.02 119.66 125.61 1i9b s GLN 22 Ca 0.47 -1.46 0.00 0.00 0.02 0.00 0.00 55.36 54.38 1i9b s GLN 22 Cb -0.26 -3.49 0.00 0.00 1.00 0.00 0.00 33.01 30.26 1i9b s GLN 22 CO 0.32 -0.84 0.00 0.54 -2.12 0.00 0.00 175.29 173.19 1i9b n ARG 23 N 4.71 0.00 0.00 2.91 3.00 -1.26 -1.99 116.66 124.03 1i9b n ARG 23 Ca -0.09 0.00 0.09 0.00 -0.01 0.00 0.00 57.85 57.84 1i9b n ARG 23 Cb 0.43 0.00 0.51 0.00 0.00 0.00 0.00 32.46 33.40 1i9b n ARG 23 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 1i9b n ASP 24 N -2.53 0.00 -4.70 0.55 8.00 -1.26 -4.76 116.55 111.85 1i9b n ASP 24 Ca 0.00 -0.36 -0.42 0.00 0.71 0.00 0.00 54.79 54.72 1i9b n ASP 24 Cb 0.00 -0.10 -0.03 0.00 -0.02 0.00 0.00 41.12 40.97 1i9b n ASP 24 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1i9b s ARG 25 N -2.21 4.26 0.95 -1.24 0.52 -0.84 -4.78 118.95 115.60 1i9b s ARG 25 Ca 0.24 2.18 -0.12 0.00 -0.52 0.00 0.00 55.73 57.50 1i9b s ARG 25 Cb 0.12 -3.38 0.16 0.00 0.52 0.00 0.00 34.95 32.37 1i9b s ARG 25 CO 0.23 -0.57 1.10 -2.14 0.02 0.00 0.00 175.30 173.94 1i9b s PRO 26 N 1.75 0.86 -0.15 3.54 0.02 -1.19 -3.68 135.00 136.15 1i9b s PRO 26 Ca 0.68 0.57 -0.18 0.00 0.02 0.00 0.00 61.00 62.09 1i9b s PRO 26 Cb -0.38 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.32 1i9b s PRO 26 CO 0.30 -2.45 0.46 0.08 -0.33 0.00 0.00 177.00 175.07 1i9b s VAL 27 N -3.02 5.18 -0.53 3.83 1.01 0.29 -4.79 120.40 122.38 1i9b s VAL 27 Ca 0.64 0.90 -0.24 0.00 0.00 0.00 0.00 61.98 63.29 1i9b s VAL 27 Cb -0.18 -3.80 0.04 0.00 0.00 0.00 0.00 36.38 32.45 1i9b s VAL 27 CO 0.57 0.29 0.90 0.00 0.00 0.00 0.00 175.10 176.86 1i9b s ALA 28 N 0.88 3.20 -0.18 5.51 0.00 -1.26 -1.93 121.76 127.97 1i9b s ALA 28 Ca 0.24 -1.24 -0.04 0.00 0.00 0.00 0.00 51.96 50.92 1i9b s ALA 28 Cb -0.15 -3.67 -0.02 0.00 0.00 0.00 0.00 23.12 19.28 1i9b s ALA 28 CO 0.09 -2.29 -0.02 0.08 0.00 0.00 0.00 175.76 173.63 1i9b s VAL 29 N 3.75 3.89 -0.14 0.00 1.01 -0.38 -4.29 120.40 124.25 1i9b s VAL 29 Ca 0.29 -0.34 -0.04 0.00 0.00 0.00 0.00 61.98 61.89 1i9b s VAL 29 Cb -0.13 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 1i9b s VAL 29 CO 0.19 0.46 -0.01 -0.94 0.00 0.00 0.00 175.10 174.80 1i9b s SER 30 N 0.73 5.08 0.01 3.32 1.04 0.24 -1.77 113.70 122.36 1i9b s SER 30 Ca -0.01 -0.01 0.07 0.00 0.48 0.00 0.00 55.95 56.48 1i9b s SER 30 Cb -0.14 -1.71 -0.03 0.00 0.10 0.00 0.00 66.02 64.23 1i9b s SER 30 CO 0.02 0.23 -0.19 -0.69 0.98 0.00 0.00 173.24 173.59 1i9b s VAL 31 N -0.02 2.66 -0.25 5.02 1.01 -0.97 -1.38 120.40 126.48 1i9b s VAL 31 Ca 0.03 -1.09 -0.03 0.00 0.00 0.00 0.00 61.98 60.88 1i9b s VAL 31 Cb -0.13 -2.07 0.14 0.00 0.00 0.00 0.00 36.38 34.33 1i9b s VAL 31 CO 0.02 0.44 0.46 -0.55 0.00 0.00 0.00 175.10 175.47 1i9b s SER 32 N -1.12 -0.35 -0.02 3.32 0.15 -0.31 -4.17 113.70 111.20 1i9b s SER 32 Ca 0.13 0.60 -0.20 0.00 0.70 0.00 0.00 55.95 57.18 1i9b s SER 32 Cb -0.10 1.50 -0.05 0.00 -1.71 0.00 0.00 66.02 65.65 1i9b s SER 32 CO 0.03 -0.27 0.56 -0.76 1.20 0.00 0.00 173.24 174.00 1i9b s LEU 33 N 2.66 4.41 -0.27 3.45 1.43 -1.26 -1.57 118.68 127.53 1i9b s LEU 33 Ca 0.11 1.10 0.03 0.00 -1.03 0.00 0.00 54.13 54.34 1i9b s LEU 33 Cb -0.15 -2.86 0.07 0.00 0.03 0.00 0.00 46.19 43.28 1i9b s LEU 33 CO -0.17 0.11 -0.07 -0.54 0.23 0.00 0.00 176.35 175.92 1i9b s LYS 34 N -0.19 1.94 0.14 1.70 -0.14 -0.84 -4.93 119.74 117.42 1i9b s LYS 34 Ca 0.30 -1.33 -0.31 0.00 -1.36 0.00 0.00 55.97 53.27 1i9b s LYS 34 Cb -0.18 -2.84 -0.08 0.00 -1.68 0.00 0.00 37.83 33.05 1i9b s LYS 34 CO 0.16 -0.64 1.34 -0.06 -0.76 0.00 0.00 175.35 175.39 1i9b s PHE 35 N 1.15 3.28 -0.13 3.18 0.40 -1.26 -0.95 117.98 123.65 1i9b s PHE 35 Ca -0.05 1.09 0.13 0.00 -0.60 0.00 0.00 56.93 57.50 1i9b s PHE 35 Cb -0.20 -3.62 -0.18 0.00 0.51 0.00 0.00 43.02 39.54 1i9b s PHE 35 CO -0.06 -2.07 0.07 -0.89 0.70 0.00 0.00 175.22 172.97 1i9b n ILE 36 N 3.50 0.88 -3.56 0.64 2.08 -0.50 -3.41 119.36 118.98 1i9b n ILE 36 Ca 0.09 -0.57 -0.08 0.00 0.56 0.00 0.00 62.75 62.75 1i9b n ILE 36 Cb 0.43 -0.57 -0.03 0.00 -0.75 0.00 0.00 39.64 38.72 1i9b n ILE 36 CO 0.00 0.00 0.00 0.21 0.56 0.00 0.00 176.55 177.32 1i9b s ASN 37 N -4.63 -0.31 -0.22 4.38 3.84 -1.02 -0.82 114.94 116.16 1i9b s ASN 37 Ca -0.07 0.17 0.01 0.00 0.21 0.00 0.00 52.86 53.18 1i9b s ASN 37 Cb 0.05 0.29 0.05 0.00 -0.55 0.00 0.00 41.25 41.09 1i9b s ASN 37 CO 0.57 -0.40 -0.07 -0.63 -2.79 0.00 0.00 177.10 173.78 1i9b s ILE 38 N -2.03 1.59 -0.19 -5.21 1.01 -1.26 -0.52 121.20 114.59 1i9b s ILE 38 Ca 0.03 -1.17 -0.08 0.00 0.00 0.00 0.00 60.65 59.43 1i9b s ILE 38 Cb -0.01 -1.79 -0.21 0.00 0.01 0.00 0.00 42.46 40.46 1i9b s ILE 38 CO -0.04 -0.01 0.10 0.18 0.00 0.00 0.00 174.94 175.17 1i9b n LEU 39 N 4.66 2.51 -3.84 2.97 4.77 0.91 -4.51 117.00 124.47 1i9b n LEU 39 Ca -0.13 0.17 -0.13 0.00 -0.03 0.00 0.00 56.01 55.90 1i9b n LEU 39 Cb 0.45 -1.00 -0.14 0.00 -2.33 0.00 0.00 43.42 40.39 1i9b n LEU 39 CO 0.19 0.74 -0.35 -1.61 -1.33 0.00 0.00 177.39 175.02 1i9b s GLU 40 N -2.51 -0.01 0.04 3.23 2.02 -1.08 -4.97 118.70 115.42 1i9b s GLU 40 Ca -0.29 0.05 0.04 0.00 0.02 0.00 0.00 54.97 54.80 1i9b s GLU 40 Cb 0.08 -0.06 -0.02 0.00 0.10 0.00 0.00 34.13 34.23 1i9b s GLU 40 CO 0.66 -0.04 -0.13 0.08 0.02 0.00 0.00 175.26 175.85 1i9b s VAL 41 N 0.27 0.98 -0.25 2.63 1.01 -1.26 -1.05 120.40 122.72 1i9b s VAL 41 Ca -0.02 -0.94 -0.03 0.00 0.00 0.00 0.00 61.98 60.99 1i9b s VAL 41 Cb -0.03 -0.90 0.10 0.00 0.00 0.00 0.00 36.38 35.55 1i9b s VAL 41 CO -0.01 -0.03 0.19 0.21 0.00 0.00 0.00 175.10 175.46 1i9b s ASN 42 N -1.10 2.34 0.45 3.32 3.84 -1.03 -5.00 114.94 117.76 1i9b s ASN 42 Ca 0.00 -0.80 0.25 0.00 0.21 0.00 0.00 52.86 52.52 1i9b s ASN 42 Cb -0.08 0.08 0.91 0.00 -0.55 0.00 0.00 41.25 41.61 1i9b s ASN 42 CO 0.01 -0.39 1.82 -0.08 -2.79 0.00 0.00 177.10 175.67 1i9b h GLU 43 N 8.35 0.00 -0.19 0.43 4.81 -1.89 0.33 114.58 126.41 1i9b h GLU 43 Ca -0.17 0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 58.96 1i9b h GLU 43 Cb 1.08 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.46 1i9b h GLU 43 CO 0.35 0.19 -0.27 0.82 -0.73 0.00 0.00 179.01 179.37 1i9b h ILE 44 N 0.00 1.34 -0.01 2.32 1.08 -1.97 -3.29 117.51 116.97 1i9b h ILE 44 Ca -0.00 -1.48 0.00 0.00 -0.39 0.00 0.00 64.86 62.99 1i9b h ILE 44 Cb 0.76 1.83 0.00 0.00 -3.07 0.00 0.00 36.82 36.34 1i9b h ILE 44 CO 0.02 0.45 -0.63 0.35 -0.69 0.00 0.00 178.15 177.66 1i9b n THR 45 N -4.37 0.00 -3.53 -0.27 -2.24 -1.15 -5.00 114.28 97.72 1i9b n THR 45 Ca -0.06 -0.15 -0.20 0.00 -2.27 0.00 0.00 64.05 61.37 1i9b n THR 45 Cb 0.46 1.03 0.06 0.00 -2.10 0.00 0.00 70.33 69.77 1i9b n THR 45 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 1i9b n ASN 46 N -0.64 -3.39 -4.04 3.42 5.03 0.11 -4.94 115.26 110.80 1i9b n ASN 46 Ca 0.08 -0.78 -0.21 0.00 0.87 0.00 0.00 54.58 54.53 1i9b n ASN 46 Cb 0.41 -4.47 -0.15 0.00 -1.02 0.00 0.00 39.78 34.54 1i9b n ASN 46 CO 0.00 0.00 0.00 -1.61 -1.83 0.00 0.00 177.26 173.82 1i9b s GLU 47 N -5.45 1.10 0.03 3.52 2.02 -1.11 -2.59 118.70 116.22 1i9b s GLU 47 Ca 0.19 -0.39 0.07 0.00 0.02 0.00 0.00 54.97 54.87 1i9b s GLU 47 Cb -0.04 -1.02 -0.02 0.00 0.10 0.00 0.00 34.13 33.15 1i9b s GLU 47 CO 0.78 0.18 -0.21 0.08 0.02 0.00 0.00 175.26 176.11 1i9b s VAL 48 N 0.03 1.70 -0.31 2.63 1.01 -0.21 -2.47 120.40 122.78 1i9b s VAL 48 Ca -0.01 -1.13 0.01 0.00 0.00 0.00 0.00 61.98 60.85 1i9b s VAL 48 Cb -0.08 -1.46 0.07 0.00 0.00 0.00 0.00 36.38 34.92 1i9b s VAL 48 CO 0.00 0.29 0.00 -0.62 0.00 0.00 0.00 175.10 174.78 1i9b s ASP 49 N -0.99 4.76 0.16 3.32 -1.08 -0.22 -0.62 116.67 121.99 1i9b s ASP 49 Ca 0.08 -1.64 0.06 0.00 -0.52 0.00 0.00 52.55 50.53 1i9b s ASP 49 Cb -0.09 -1.65 -0.04 0.00 -1.46 0.00 0.00 42.92 39.68 1i9b s ASP 49 CO 0.01 -0.30 -0.13 0.54 0.52 0.00 0.00 175.17 175.81 1i9b s VAL 50 N 1.10 1.44 -0.02 1.11 0.11 -0.81 -0.06 120.40 123.26 1i9b s VAL 50 Ca -0.01 -2.00 0.08 0.00 -2.93 0.00 0.00 61.98 57.11 1i9b s VAL 50 Cb -0.20 -1.82 -0.02 0.00 -1.53 0.00 0.00 36.38 32.81 1i9b s VAL 50 CO -0.05 -0.58 -0.25 -0.69 -3.33 0.00 0.00 175.10 170.20 1i9b s VAL 51 N -2.79 2.12 0.17 2.04 1.01 0.32 -0.81 120.40 122.45 1i9b s VAL 51 Ca 0.16 -1.08 -0.23 0.00 0.00 0.00 0.00 61.98 60.83 1i9b s VAL 51 Cb -0.01 -1.73 0.06 0.00 0.00 0.00 0.00 36.38 34.69 1i9b s VAL 51 CO 0.04 0.58 0.73 0.72 0.00 0.00 0.00 175.10 177.16 1i9b s PHE 52 N -0.59 -0.35 -0.33 5.22 -0.12 0.46 -1.42 117.98 120.86 1i9b s PHE 52 Ca 0.09 0.05 -0.12 0.00 -0.05 0.00 0.00 56.93 56.90 1i9b s PHE 52 Cb -0.10 0.62 -0.02 0.00 -0.63 0.00 0.00 43.02 42.89 1i9b s PHE 52 CO -0.01 -0.93 0.23 -1.58 -0.05 0.00 0.00 175.22 172.88 1i9b s TRP 53 N -3.66 3.22 -1.28 3.49 0.51 -0.12 0.68 118.94 121.79 1i9b s TRP 53 Ca 0.06 -0.23 -0.12 0.00 -2.12 0.00 0.00 56.10 53.69 1i9b s TRP 53 Cb -0.03 -2.46 0.15 0.00 -0.81 0.00 0.00 33.47 30.33 1i9b s TRP 53 CO -0.04 -0.36 1.77 0.94 -0.51 0.00 0.00 176.95 178.75 1i9b n GLN 54 N 5.09 3.45 -1.78 4.98 7.27 -0.52 -1.99 117.38 133.88 1i9b n GLN 54 Ca -0.13 -3.52 -0.40 0.00 0.07 0.00 0.00 57.00 53.01 1i9b n GLN 54 Cb 0.50 -3.03 -0.03 0.00 2.41 0.00 0.00 30.24 30.09 1i9b n GLN 54 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 1i9b s GLN 55 N 1.25 2.84 0.06 3.69 0.74 -0.61 -3.98 119.66 123.66 1i9b s GLN 55 Ca 0.42 1.45 0.08 0.00 0.05 0.00 0.00 55.36 57.36 1i9b s GLN 55 Cb 0.06 -4.38 -0.03 0.00 1.10 0.00 0.00 33.01 29.76 1i9b s GLN 55 CO -0.00 -2.44 -0.18 0.99 -0.55 0.00 0.00 175.29 173.10 1i9b s THR 56 N 9.02 2.78 -0.12 -0.34 2.01 0.66 -1.17 115.64 128.48 1i9b s THR 56 Ca 0.88 -1.28 -0.11 0.00 0.31 0.00 0.00 61.69 61.49 1i9b s THR 56 Cb -0.22 -2.19 0.03 0.00 0.01 0.00 0.00 72.50 70.12 1i9b s THR 56 CO 0.30 0.28 0.32 -0.89 -0.69 0.00 0.00 174.62 173.93 1i9b s THR 57 N -0.98 -0.00 0.37 -0.82 2.01 -0.48 -1.18 115.64 114.57 1i9b s THR 57 Ca 0.15 0.00 -0.16 0.00 0.31 0.00 0.00 61.69 61.99 1i9b s THR 57 Cb -0.10 -0.45 0.05 0.00 0.01 0.00 0.00 72.50 72.01 1i9b s THR 57 CO 0.06 0.00 0.80 -1.66 -0.69 0.00 0.00 174.62 173.14 1i9b s TRP 58 N 0.17 0.10 -0.06 4.92 -2.14 -0.80 -0.59 118.94 120.54 1i9b s TRP 58 Ca -0.00 -0.75 0.04 0.00 2.66 0.00 0.00 56.10 58.05 1i9b s TRP 58 Cb -0.02 0.83 0.00 0.00 -3.10 0.00 0.00 33.47 31.18 1i9b s TRP 58 CO 0.00 -1.51 -0.16 0.45 -2.66 0.00 0.00 176.95 173.07 1i9b s SER 59 N -3.08 2.15 -0.35 -2.66 0.15 -1.26 0.00 113.70 108.65 1i9b s SER 59 Ca 0.15 -0.36 0.00 0.00 0.70 0.00 0.00 55.95 56.45 1i9b s SER 59 Cb -0.05 -0.79 0.11 0.00 -1.71 0.00 0.00 66.02 63.58 1i9b s SER 59 CO 0.11 0.11 0.15 -0.62 1.20 0.00 0.00 173.24 174.19 1i9b s ASP 60 N 0.30 3.83 0.54 5.45 -1.08 0.28 -4.86 116.67 121.13 1i9b s ASP 60 Ca -0.10 -2.00 0.36 0.00 -0.52 0.00 0.00 52.55 50.29 1i9b s ASP 60 Cb -0.14 -0.89 1.79 0.00 -1.46 0.00 0.00 42.92 42.22 1i9b s ASP 60 CO 0.04 -0.36 2.08 0.03 0.52 0.00 0.00 175.17 177.48 1i9b h ARG 61 N 7.56 0.00 0.00 4.34 3.08 -1.85 -2.34 114.38 125.17 1i9b h ARG 61 Ca -0.08 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1i9b h ARG 61 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.03 1i9b h ARG 61 CO 0.46 0.00 0.00 0.25 -1.07 0.00 0.00 179.97 179.61 1i9b n THR 62 N -2.86 0.31 0.75 2.04 -2.24 -1.26 -1.84 114.28 109.18 1i9b n THR 62 Ca -0.01 0.08 0.10 0.00 -2.27 0.00 0.00 64.05 61.95 1i9b n THR 62 Cb 0.15 -0.72 -0.13 0.00 -2.10 0.00 0.00 70.33 67.53 1i9b n THR 62 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1i9b n LEU 63 N -1.26 0.75 -4.76 3.22 4.77 -0.88 -4.97 117.00 113.88 1i9b n LEU 63 Ca 0.11 -0.38 -0.38 0.00 -0.03 0.00 0.00 56.01 55.32 1i9b n LEU 63 Cb 0.16 0.00 0.02 0.00 -2.33 0.00 0.00 43.42 41.27 1i9b n LEU 63 CO 0.16 0.19 0.96 0.00 -1.33 0.00 0.00 177.39 177.37 1i9b s ALA 64 N -3.09 2.99 0.14 -1.18 0.00 -0.76 -4.69 121.76 115.16 1i9b s ALA 64 Ca 0.04 1.25 0.03 0.00 0.00 0.00 0.00 51.96 53.28 1i9b s ALA 64 Cb 0.15 -3.52 -0.01 0.00 0.00 0.00 0.00 23.12 19.74 1i9b s ALA 64 CO 0.87 -1.10 0.10 -2.67 0.00 0.00 0.00 175.76 172.95 1i9b n TRP 65 N -0.59 -0.24 -3.42 0.00 2.14 -0.54 -4.95 117.44 109.83 1i9b n TRP 65 Ca 0.08 -1.08 -0.44 0.00 2.07 0.00 0.00 57.50 58.13 1i9b n TRP 65 Cb 0.45 0.09 -0.07 0.00 -0.81 0.00 0.00 31.31 30.97 1i9b n TRP 65 CO 0.00 0.00 0.00 1.21 2.07 0.00 0.00 177.69 180.97 1i9b s ASN 66 N -1.92 6.03 0.00 -0.67 3.04 -1.26 -4.76 114.94 115.40 1i9b s ASN 66 Ca 0.14 -1.51 0.20 0.00 0.04 0.00 0.00 52.86 51.73 1i9b s ASN 66 Cb 0.01 -2.14 0.70 0.00 -1.54 0.00 0.00 41.25 38.28 1i9b s ASN 66 CO 0.10 -0.68 1.52 -1.54 -3.04 0.00 0.00 177.10 173.46 1i9b n SER 67 N 5.14 1.79 0.00 -4.21 3.41 -1.26 -4.44 113.62 114.05 1i9b n SER 67 Ca -0.12 -1.74 0.00 0.00 -0.26 0.00 0.00 58.87 56.75 1i9b n SER 67 Cb 0.42 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.25 1i9b n SER 67 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1i9b n SER 68 N 0.41 0.00 0.00 4.04 7.64 -1.26 -0.80 113.62 123.65 1i9b n SER 68 Ca 0.16 0.10 0.00 0.00 1.01 0.00 0.00 58.87 60.14 1i9b n SER 68 Cb 0.34 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.45 1i9b n SER 68 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 1i9b n HIS 69 N -0.94 0.00 -4.41 1.43 -0.00 -1.26 -5.14 115.22 104.89 1i9b n HIS 69 Ca 0.00 0.00 -0.21 0.00 -0.00 0.00 0.00 57.72 57.51 1i9b n HIS 69 Cb 0.15 0.11 -0.10 0.00 -0.00 0.00 0.00 29.99 30.15 1i9b n HIS 69 CO 0.00 0.00 0.00 -1.54 -0.00 0.00 0.00 176.34 174.80 1i9b s SER 70 N 0.00 2.64 0.54 0.26 1.04 0.02 -4.76 113.70 113.45 1i9b s SER 70 Ca 0.00 -1.19 -0.20 0.00 0.48 0.00 0.00 55.95 55.04 1i9b s SER 70 Cb 0.00 -0.14 -0.08 0.00 0.10 0.00 0.00 66.02 65.90 1i9b s SER 70 CO 0.00 -0.36 0.84 -2.65 0.98 0.00 0.00 173.24 172.05 1i9b n PRO 71 N -0.56 0.89 -0.00 4.02 -0.02 -1.26 -4.65 135.00 133.42 1i9b n PRO 71 Ca -0.05 0.34 0.11 0.00 -2.02 0.00 0.00 63.50 61.87 1i9b n PRO 71 Cb 0.63 -1.98 -0.15 0.00 -0.02 0.00 0.00 33.50 31.98 1i9b n PRO 71 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1i9b n ASP 72 N -0.03 0.14 -4.23 2.55 5.68 -1.26 -4.72 116.55 114.68 1i9b n ASP 72 Ca 0.12 -0.06 -0.20 0.00 -0.50 0.00 0.00 54.79 54.15 1i9b n ASP 72 Cb 0.45 1.80 -0.12 0.00 -1.14 0.00 0.00 41.12 42.11 1i9b n ASP 72 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 1i9b s GLN 73 N -3.46 0.99 0.08 0.11 -0.21 -1.26 0.20 119.66 116.10 1i9b s GLN 73 Ca -0.06 -1.11 -0.11 0.00 0.02 0.00 0.00 55.36 54.10 1i9b s GLN 73 Cb 0.14 -1.06 0.01 0.00 1.00 0.00 0.00 33.01 33.10 1i9b s GLN 73 CO 0.90 0.23 0.24 0.14 -2.12 0.00 0.00 175.29 174.68 1i9b s VAL 74 N -1.45 0.11 -0.28 1.09 -7.23 -0.76 -4.98 120.40 106.90 1i9b s VAL 74 Ca 0.04 -0.94 -0.13 0.00 -1.81 0.00 0.00 61.98 59.14 1i9b s VAL 74 Cb -0.09 -1.16 -0.04 0.00 0.56 0.00 0.00 36.38 35.66 1i9b s VAL 74 CO 0.03 -0.52 0.28 -0.44 -0.31 0.00 0.00 175.10 174.15 1i9b s SER 75 N -2.55 6.13 -0.07 4.85 0.01 -1.26 -0.95 113.70 119.86 1i9b s SER 75 Ca 0.01 0.07 0.03 0.00 1.31 0.00 0.00 55.95 57.37 1i9b s SER 75 Cb 0.02 -2.17 -0.02 0.00 0.21 0.00 0.00 66.02 64.07 1i9b s SER 75 CO -0.08 -0.14 -0.15 -0.69 0.41 0.00 0.00 173.24 172.58 1i9b s VAL 76 N 1.91 2.96 0.33 3.43 1.01 -0.00 -4.91 120.40 125.13 1i9b s VAL 76 Ca 0.11 -0.74 -0.29 0.00 0.00 0.00 0.00 61.98 61.06 1i9b s VAL 76 Cb -0.16 -2.17 -0.10 0.00 0.00 0.00 0.00 36.38 33.94 1i9b s VAL 76 CO 0.11 0.57 1.34 -2.84 0.00 0.00 0.00 175.10 174.27 1i9b s PRO 77 N -0.39 4.32 0.48 2.72 0.02 -1.26 0.32 135.00 141.20 1i9b s PRO 77 Ca 0.04 2.27 0.23 0.00 0.02 0.00 0.00 61.00 63.56 1i9b s PRO 77 Cb -0.12 -3.06 1.27 0.00 0.02 0.00 0.00 34.50 32.61 1i9b s PRO 77 CO 0.02 -0.24 1.90 0.82 -0.33 0.00 0.00 177.00 179.17 1i9b h ILE 78 N 3.06 0.66 0.00 2.83 1.08 -1.57 -0.83 117.51 122.73 1i9b h ILE 78 Ca -0.49 -0.07 0.00 0.00 -0.39 0.00 0.00 64.86 63.91 1i9b h ILE 78 Cb 1.23 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 35.42 1i9b h ILE 78 CO 0.66 0.04 0.00 -1.54 -0.69 0.00 0.00 178.15 176.62 1i9b n SER 79 N -4.40 0.31 -0.94 1.72 3.41 -1.26 -2.58 113.62 109.87 1i9b n SER 79 Ca 0.17 0.57 0.11 0.00 -0.26 0.00 0.00 58.87 59.46 1i9b n SER 79 Cb 0.75 -0.64 0.12 0.00 -0.26 0.00 0.00 64.21 64.19 1i9b n SER 79 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1i9b n SER 80 N -1.84 2.99 -4.42 4.04 7.64 -0.32 -4.81 113.62 116.91 1i9b n SER 80 Ca 0.03 -1.93 -0.21 0.00 1.01 0.00 0.00 58.87 57.77 1i9b n SER 80 Cb 0.21 -0.07 -0.10 0.00 -1.01 0.00 0.00 64.21 63.23 1i9b n SER 80 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1i9b s LEU 81 N -1.71 2.47 0.20 -3.43 1.43 -1.07 -4.57 118.68 112.00 1i9b s LEU 81 Ca 0.29 -1.18 -0.22 0.00 -1.03 0.00 0.00 54.13 51.99 1i9b s LEU 81 Cb 0.19 -0.62 -0.08 0.00 0.03 0.00 0.00 46.19 45.72 1i9b s LEU 81 CO 0.28 -0.34 0.74 0.86 0.23 0.00 0.00 176.35 178.12 1i9b s TRP 82 N -3.04 3.74 0.01 0.29 -0.00 -1.26 -4.39 118.94 114.29 1i9b s TRP 82 Ca 0.29 1.47 0.02 0.00 -0.00 0.00 0.00 56.10 57.88 1i9b s TRP 82 Cb 0.04 -2.67 -0.01 0.00 -0.00 0.00 0.00 33.47 30.83 1i9b s TRP 82 CO 0.11 0.40 -0.06 0.08 -0.00 0.00 0.00 176.95 177.48 1i9b s VAL 83 N -1.39 0.48 0.24 5.86 1.01 -1.26 -5.03 120.40 120.31 1i9b s VAL 83 Ca 0.40 -0.53 -0.31 0.00 0.00 0.00 0.00 61.98 61.54 1i9b s VAL 83 Cb -0.19 -0.46 -0.13 0.00 0.00 0.00 0.00 36.38 35.61 1i9b s VAL 83 CO 0.22 -0.05 1.55 -2.65 0.00 0.00 0.00 175.10 174.17 1i9b n PRO 84 N 2.42 2.41 -1.53 2.72 -0.02 -1.26 -4.86 135.00 134.88 1i9b n PRO 84 Ca -0.16 0.86 -0.32 0.00 -2.02 0.00 0.00 63.50 61.86 1i9b n PRO 84 Cb 0.57 -2.61 -0.05 0.00 -0.02 0.00 0.00 33.50 31.39 1i9b n PRO 84 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1i9b n ASP 85 N 2.60 7.44 -4.77 2.55 5.75 -1.26 -4.95 116.55 123.90 1i9b n ASP 85 Ca 0.12 -2.88 -0.34 0.00 -0.01 0.00 0.00 54.79 51.67 1i9b n ASP 85 Cb 0.34 -1.40 0.01 0.00 -1.03 0.00 0.00 41.12 39.04 1i9b n ASP 85 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1i9b s LEU 86 N -1.14 3.64 -0.15 -2.12 1.43 -1.26 -1.33 118.68 117.74 1i9b s LEU 86 Ca 0.62 2.11 -0.13 0.00 -1.03 0.00 0.00 54.13 55.69 1i9b s LEU 86 Cb 0.25 -4.57 0.04 0.00 0.03 0.00 0.00 46.19 41.94 1i9b s LEU 86 CO -0.10 -1.33 0.39 0.00 0.23 0.00 0.00 176.35 175.55 1i9b s ALA 87 N -1.97 -0.97 -0.52 4.21 0.00 -0.83 -4.86 121.76 116.83 1i9b s ALA 87 Ca 0.71 1.13 -0.25 0.00 0.00 0.00 0.00 51.96 53.55 1i9b s ALA 87 Cb -0.22 -0.66 0.03 0.00 0.00 0.00 0.00 23.12 22.27 1i9b s ALA 87 CO 0.31 -0.19 0.97 0.00 0.00 0.00 0.00 175.76 176.85 1i9b s ALA 88 N 0.32 3.17 0.43 0.00 0.00 -1.26 -2.18 121.76 122.24 1i9b s ALA 88 Ca -0.01 -1.01 0.23 0.00 0.00 0.00 0.00 51.96 51.17 1i9b s ALA 88 Cb -0.03 -3.73 1.22 0.00 0.00 0.00 0.00 23.12 20.57 1i9b s ALA 88 CO -0.01 -2.29 1.77 1.88 0.00 0.00 0.00 175.76 177.11 1i9b h TYR 89 N 9.25 0.51 -0.41 0.00 0.05 -0.34 -1.05 116.97 124.97 1i9b h TYR 89 Ca -0.25 0.02 -0.10 0.00 0.05 0.00 0.00 58.73 58.45 1i9b h TYR 89 Cb 1.07 -0.15 -0.06 0.00 1.01 0.00 0.00 36.73 38.61 1i9b h TYR 89 CO 0.91 0.02 0.05 0.27 -1.05 0.00 0.00 178.16 178.37 1i9b n ASN 90 N -4.54 3.87 -4.74 3.88 6.94 -1.26 -4.98 115.26 114.43 1i9b n ASN 90 Ca 0.26 -3.24 -0.41 0.00 -0.02 0.00 0.00 54.58 51.17 1i9b n ASN 90 Cb 0.99 -0.62 -0.03 0.00 -2.36 0.00 0.00 39.78 37.76 1i9b n ASN 90 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1i9b s ALA 91 N -2.97 3.47 -0.87 -2.53 0.00 -0.40 -1.26 121.76 117.20 1i9b s ALA 91 Ca 0.46 1.02 0.19 0.00 0.00 0.00 0.00 51.96 53.63 1i9b s ALA 91 Cb 0.38 -3.43 -0.22 0.00 0.00 0.00 0.00 23.12 19.85 1i9b s ALA 91 CO 0.08 -0.43 0.81 -0.89 0.00 0.00 0.00 175.76 175.33 1i9b n ILE 92 N 2.34 0.00 -4.12 0.00 5.41 0.17 -4.88 119.36 118.28 1i9b n ILE 92 Ca 0.04 -0.06 -0.10 0.00 1.00 0.00 0.00 62.75 63.62 1i9b n ILE 92 Cb 0.44 0.94 -0.09 0.00 -0.71 0.00 0.00 39.64 40.22 1i9b n ILE 92 CO 0.00 0.00 0.00 -0.94 0.00 0.00 0.00 176.55 175.61 1i9b s SER 93 N -2.94 0.18 0.59 4.38 1.04 -1.22 -4.95 113.70 110.78 1i9b s SER 93 Ca 0.06 -1.18 -0.08 0.00 0.48 0.00 0.00 55.95 55.23 1i9b s SER 93 Cb 0.15 0.37 -0.02 0.00 0.10 0.00 0.00 66.02 66.62 1i9b s SER 93 CO 0.81 -0.82 0.95 -1.59 0.98 0.00 0.00 173.24 173.56 1i9b s LYS 94 N -4.07 3.29 0.14 4.02 -2.85 -1.26 -4.63 119.74 114.39 1i9b s LYS 94 Ca 0.27 0.38 -0.31 0.00 -1.00 0.00 0.00 55.97 55.31 1i9b s LYS 94 Cb 0.06 -2.19 -0.09 0.00 -2.06 0.00 0.00 37.83 33.54 1i9b s LYS 94 CO 0.05 -0.59 1.55 -2.14 0.10 0.00 0.00 175.35 174.33 1i9b s PRO 95 N -5.05 4.23 -0.66 1.78 0.02 -1.26 -4.80 135.00 129.25 1i9b s PRO 95 Ca 0.53 2.30 -0.12 0.00 0.02 0.00 0.00 61.00 63.73 1i9b s PRO 95 Cb -0.11 -3.25 0.17 0.00 0.02 0.00 0.00 34.50 31.33 1i9b s PRO 95 CO 0.49 -0.60 0.58 -2.00 -0.33 0.00 0.00 177.00 175.14 1i9b s GLU 96 N 1.41 3.12 -0.22 5.54 2.12 -0.78 -4.98 118.70 124.92 1i9b s GLU 96 Ca 0.70 -2.15 -0.29 0.00 0.36 0.00 0.00 54.97 53.59 1i9b s GLU 96 Cb -0.42 -4.22 -0.02 0.00 0.26 0.00 0.00 34.13 29.73 1i9b s GLU 96 CO 0.31 -1.27 1.55 0.08 -0.54 0.00 0.00 175.26 175.39 1i9b s VAL 97 N 0.73 3.79 -0.87 3.70 1.01 -1.26 -2.21 120.40 125.28 1i9b s VAL 97 Ca 0.12 0.89 0.25 0.00 0.00 0.00 0.00 61.98 63.24 1i9b s VAL 97 Cb -0.20 -3.78 0.06 0.00 0.00 0.00 0.00 36.38 32.47 1i9b s VAL 97 CO -0.04 -0.30 1.46 0.18 0.00 0.00 0.00 175.10 176.40 1i9b n LEU 98 N 8.16 0.51 -4.55 3.92 4.77 0.29 -4.94 117.00 125.16 1i9b n LEU 98 Ca 0.18 0.16 -0.25 0.00 -0.03 0.00 0.00 56.01 56.06 1i9b n LEU 98 Cb 0.45 -0.26 -0.10 0.00 -2.33 0.00 0.00 43.42 41.18 1i9b n LEU 98 CO 0.64 0.04 -0.38 0.42 -1.33 0.00 0.00 177.39 176.78 1i9b s THR 99 N -3.06 2.35 0.23 -5.08 -4.23 -1.26 -4.97 115.64 99.63 1i9b s THR 99 Ca 0.10 -2.18 -0.31 0.00 -1.18 0.00 0.00 61.69 58.12 1i9b s THR 99 Cb 0.16 -2.64 -0.14 0.00 1.34 0.00 0.00 72.50 71.22 1i9b s THR 99 CO 0.68 -0.22 1.26 -2.65 -0.54 0.00 0.00 174.62 173.14 1i9b n PRO 100 N -0.81 1.65 -2.00 3.99 -0.02 -1.26 -4.82 135.00 131.73 1i9b n PRO 100 Ca -0.05 0.58 -0.41 0.00 -2.02 0.00 0.00 63.50 61.61 1i9b n PRO 100 Cb 0.63 -2.14 -0.00 0.00 -0.02 0.00 0.00 33.50 31.97 1i9b n PRO 100 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1i9b n GLN 101 N 1.62 4.04 -4.52 -0.52 6.02 -1.26 -4.90 117.38 117.86 1i9b n GLN 101 Ca 0.12 -3.26 -0.31 0.00 -0.01 0.00 0.00 57.00 53.54 1i9b n GLN 101 Cb 0.30 -2.80 -0.11 0.00 1.02 0.00 0.00 30.24 28.65 1i9b n GLN 101 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1i9b s LEU 102 N -0.88 2.93 0.38 1.08 1.43 -1.26 -1.42 118.68 120.94 1i9b s LEU 102 Ca 0.51 -0.28 0.08 0.00 -1.03 0.00 0.00 54.13 53.41 1i9b s LEU 102 Cb 0.15 -1.70 -0.05 0.00 0.03 0.00 0.00 46.19 44.62 1i9b s LEU 102 CO -0.06 0.26 0.13 0.00 0.23 0.00 0.00 176.35 176.92 1i9b s ALA 103 N -0.99 3.47 -0.15 4.21 0.00 0.15 -4.70 121.76 123.76 1i9b s ALA 103 Ca 0.16 -2.02 -0.00 0.00 0.00 0.00 0.00 51.96 50.11 1i9b s ALA 103 Cb -0.11 -0.45 -0.01 0.00 0.00 0.00 0.00 23.12 22.55 1i9b s ALA 103 CO 0.07 -0.07 -0.14 0.50 0.00 0.00 0.00 175.76 176.13 1i9b s ARG 104 N -3.85 3.30 -0.16 0.00 6.06 0.21 -0.82 118.95 123.69 1i9b s ARG 104 Ca 0.39 -0.71 0.01 0.00 -2.50 0.00 0.00 55.73 52.91 1i9b s ARG 104 Cb 0.02 -2.65 0.00 0.00 0.06 0.00 0.00 34.95 32.38 1i9b s ARG 104 CO 0.22 0.09 -0.17 0.08 -2.50 0.00 0.00 175.30 173.02 1i9b s VAL 105 N 0.65 2.47 0.05 7.11 1.01 -0.13 -0.91 120.40 130.65 1i9b s VAL 105 Ca -0.07 -0.83 -0.16 0.00 0.00 0.00 0.00 61.98 60.92 1i9b s VAL 105 Cb -0.16 -2.03 -0.06 0.00 0.00 0.00 0.00 36.38 34.13 1i9b s VAL 105 CO 0.02 0.52 0.47 -0.69 0.00 0.00 0.00 175.10 175.43 1i9b s VAL 106 N 0.93 4.92 0.63 2.92 1.01 -0.26 -1.83 120.40 128.72 1i9b s VAL 106 Ca -0.04 0.92 0.21 0.00 0.00 0.00 0.00 61.98 63.07 1i9b s VAL 106 Cb -0.15 -3.77 0.27 0.00 0.00 0.00 0.00 36.38 32.74 1i9b s VAL 106 CO -0.03 0.50 1.48 0.77 0.00 0.00 0.00 175.10 177.82 1i9b h SER 107 N 4.42 0.00 -0.26 3.32 4.64 0.20 0.25 113.55 126.12 1i9b h SER 107 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1i9b h SER 107 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1i9b h SER 107 CO 0.63 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.69 1i9b n ASP 108 N -3.09 1.49 0.00 4.97 5.75 -1.26 -1.47 116.55 122.93 1i9b n ASP 108 Ca 0.09 -1.96 0.00 0.00 -0.01 0.00 0.00 54.79 52.92 1i9b n ASP 108 Cb 0.98 -0.18 0.00 0.00 -1.03 0.00 0.00 41.12 40.90 1i9b n ASP 108 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1i9b n GLY 109 N 0.96 0.74 3.73 6.12 0.00 0.89 -4.73 105.19 112.90 1i9b n GLY 109 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1i9b n GLY 109 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1i9b s GLU 110 N -0.44 4.69 -0.08 1.61 2.56 -1.20 0.10 118.70 125.95 1i9b s GLU 110 Ca 0.00 1.41 0.05 0.00 0.00 0.00 0.00 54.97 56.43 1i9b s GLU 110 Cb 0.00 -3.36 -0.01 0.00 2.00 0.00 0.00 34.13 32.76 1i9b s GLU 110 CO 0.00 0.27 -0.24 0.08 -0.56 0.00 0.00 175.26 174.81 1i9b s VAL 111 N -0.17 2.12 -0.16 3.70 1.01 0.10 -1.10 120.40 125.89 1i9b s VAL 111 Ca 0.45 -1.03 -0.00 0.00 0.00 0.00 0.00 61.98 61.40 1i9b s VAL 111 Cb -0.23 -1.78 0.04 0.00 0.00 0.00 0.00 36.38 34.40 1i9b s VAL 111 CO 0.29 0.56 -0.07 -0.76 0.00 0.00 0.00 175.10 175.13 1i9b s LEU 112 N 0.05 1.63 -0.18 3.92 2.01 -0.09 -1.90 118.68 124.12 1i9b s LEU 112 Ca -0.10 -0.61 0.01 0.00 0.01 0.00 0.00 54.13 53.43 1i9b s LEU 112 Cb -0.15 -0.97 0.04 0.00 0.01 0.00 0.00 46.19 45.12 1i9b s LEU 112 CO 0.06 -0.16 -0.11 -0.47 1.01 0.00 0.00 176.35 176.69 1i9b s TYR 113 N 1.60 2.26 -0.52 0.29 5.04 -0.32 -0.62 117.35 125.08 1i9b s TYR 113 Ca 0.02 -1.43 0.04 0.00 -2.44 0.00 0.00 57.07 53.26 1i9b s TYR 113 Cb -0.15 -1.59 0.16 0.00 0.35 0.00 0.00 41.96 40.74 1i9b s TYR 113 CO -0.08 -0.71 0.38 1.41 -1.34 0.00 0.00 175.55 175.21 1i9b s MET 114 N 1.45 1.51 0.39 4.97 -2.45 -1.26 -0.25 119.30 123.66 1i9b s MET 114 Ca 0.01 -2.52 -0.15 0.00 -1.25 0.00 0.00 55.69 51.77 1i9b s MET 114 Cb -0.15 -2.25 -0.08 0.00 1.25 0.00 0.00 34.83 33.59 1i9b s MET 114 CO -0.09 -1.32 0.82 -1.25 1.05 0.00 0.00 175.02 174.23 1i9b s PRO 115 N -0.43 3.97 -0.25 4.11 0.04 -1.26 -4.79 135.00 136.40 1i9b s PRO 115 Ca 0.28 0.73 -0.17 0.00 0.04 0.00 0.00 61.00 61.87 1i9b s PRO 115 Cb -0.03 -2.34 -0.03 0.00 0.04 0.00 0.00 34.50 32.14 1i9b s PRO 115 CO -0.16 0.01 0.47 0.45 0.04 0.00 0.00 177.00 177.81 1i9b s SER 116 N -2.63 6.41 -0.06 6.66 0.15 -1.26 -1.44 113.70 121.54 1i9b s SER 116 Ca 0.55 0.49 0.05 0.00 0.70 0.00 0.00 55.95 57.75 1i9b s SER 116 Cb -0.10 -2.26 -0.01 0.00 -1.71 0.00 0.00 66.02 61.94 1i9b s SER 116 CO 0.23 -0.22 -0.23 -0.63 1.20 0.00 0.00 173.24 173.59 1i9b s ILE 117 N 2.01 2.28 -0.14 6.45 1.01 0.22 -0.54 121.20 132.48 1i9b s ILE 117 Ca 0.20 -0.99 -0.03 0.00 0.00 0.00 0.00 60.65 59.82 1i9b s ILE 117 Cb -0.15 -1.84 -0.03 0.00 0.01 0.00 0.00 42.46 40.44 1i9b s ILE 117 CO 0.09 0.57 -0.03 -0.60 0.00 0.00 0.00 174.94 174.98 1i9b s ARG 118 N -0.25 3.56 -0.06 2.79 3.52 -0.94 -0.40 118.95 127.17 1i9b s ARG 118 Ca -0.01 -0.49 -0.30 0.00 -0.13 0.00 0.00 55.73 54.80 1i9b s ARG 118 Cb -0.13 -2.90 0.08 0.00 -1.56 0.00 0.00 34.95 30.44 1i9b s ARG 118 CO 0.03 0.33 0.75 -1.14 -0.81 0.00 0.00 175.30 174.46 1i9b s GLN 119 N 0.14 0.96 0.05 5.12 0.74 0.01 -1.86 119.66 124.82 1i9b s GLN 119 Ca -0.01 0.17 -0.05 0.00 0.05 0.00 0.00 55.36 55.53 1i9b s GLN 119 Cb -0.13 0.45 -0.05 0.00 1.10 0.00 0.00 33.01 34.38 1i9b s GLN 119 CO 0.03 -0.31 0.28 1.03 -0.55 0.00 0.00 175.29 175.76 1i9b s ARG 120 N -1.38 3.55 0.09 1.67 0.52 -1.26 -1.93 118.95 120.22 1i9b s ARG 120 Ca -0.08 -0.17 0.02 0.00 -0.52 0.00 0.00 55.73 54.99 1i9b s ARG 120 Cb -0.00 -3.02 -0.04 0.00 0.52 0.00 0.00 34.95 32.41 1i9b s ARG 120 CO 0.06 0.60 -0.07 -0.06 0.02 0.00 0.00 175.30 175.85 1i9b s PHE 121 N -1.43 0.89 -0.35 -0.53 0.40 0.20 0.41 117.98 117.58 1i9b s PHE 121 Ca 0.32 -0.85 -0.08 0.00 -0.60 0.00 0.00 56.93 55.73 1i9b s PHE 121 Cb -0.13 -0.51 0.04 0.00 0.51 0.00 0.00 43.02 42.92 1i9b s PHE 121 CO 0.21 -0.12 0.13 0.45 0.70 0.00 0.00 175.22 176.58 1i9b s SER 122 N -2.85 5.43 0.38 1.36 0.15 -0.39 -1.05 113.70 116.73 1i9b s SER 122 Ca 0.09 -1.09 -0.11 0.00 0.70 0.00 0.00 55.95 55.55 1i9b s SER 122 Cb 0.03 -1.91 0.04 0.00 -1.71 0.00 0.00 66.02 62.47 1i9b s SER 122 CO -0.04 -0.34 0.70 0.00 1.20 0.00 0.00 173.24 174.76 1i9b s ASP 124 N -3.14 6.15 -0.04 0.00 -1.08 -1.26 -4.45 116.67 112.85 1i9b s ASP 124 Ca 0.21 0.81 0.21 0.00 -0.52 0.00 0.00 52.55 53.25 1i9b s ASP 124 Cb -0.04 -2.54 -0.28 0.00 -1.46 0.00 0.00 42.92 38.61 1i9b s ASP 124 CO 0.15 -1.59 0.45 0.52 0.52 0.00 0.00 175.17 175.23 1i9b n VAL 125 N 7.13 0.46 -1.59 1.11 0.31 -1.26 -3.72 118.33 120.77 1i9b n VAL 125 Ca 0.17 -0.60 -0.54 0.00 -0.01 0.00 0.00 64.34 63.36 1i9b n VAL 125 Cb 0.48 -0.19 -0.06 0.00 -0.91 0.00 0.00 33.84 33.16 1i9b n VAL 125 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1i9b n SER 126 N -2.45 1.42 0.00 4.52 3.41 -1.26 -1.36 113.62 117.90 1i9b n SER 126 Ca -0.11 1.12 0.00 0.00 -0.26 0.00 0.00 58.87 59.63 1i9b n SER 126 Cb 0.72 -1.14 0.00 0.00 -0.26 0.00 0.00 64.21 63.54 1i9b n SER 126 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i9b n GLY 127 N 2.50 0.39 0.24 5.00 0.00 -1.26 -4.27 105.19 107.79 1i9b n GLY 127 Ca 0.19 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.19 1i9b n GLY 127 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1i9b h VAL 128 N 0.00 0.40 -1.76 1.61 2.07 -1.44 -1.94 116.25 115.19 1i9b h VAL 128 Ca 0.00 0.00 -0.77 0.00 0.82 0.00 0.00 66.70 66.75 1i9b h VAL 128 Cb 0.00 0.40 -0.19 0.00 -1.52 0.00 0.00 31.29 29.98 1i9b h VAL 128 CO 0.00 0.00 1.74 -0.67 0.02 0.00 0.00 177.57 178.66 1i9b n ASP 129 N -5.41 6.60 -3.91 0.57 -0.08 -1.26 -0.34 116.55 112.72 1i9b n ASP 129 Ca 0.06 -3.27 -0.09 0.00 -1.51 0.00 0.00 54.79 49.97 1i9b n ASP 129 Cb 0.31 -1.35 -0.07 0.00 2.34 0.00 0.00 41.12 42.34 1i9b n ASP 129 CO 0.00 0.00 0.00 -0.89 0.12 0.00 0.00 177.20 176.43 1i9b s THR 130 N -1.46 0.10 0.14 5.18 2.01 -0.74 -4.99 115.64 115.88 1i9b s THR 130 Ca 0.42 -1.29 -0.11 0.00 0.31 0.00 0.00 61.69 61.02 1i9b s THR 130 Cb 0.13 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 70.96 1i9b s THR 130 CO -0.02 -0.43 1.48 -0.33 -0.69 0.00 0.00 174.62 174.62 1i9b h GLU 131 N 2.62 0.93 0.00 4.92 4.39 -1.90 -2.54 114.58 123.00 1i9b h GLU 131 Ca -0.33 -0.50 0.00 0.00 0.34 0.00 0.00 59.36 58.88 1i9b h GLU 131 Cb 1.22 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.89 1i9b h GLU 131 CO 0.51 1.15 -0.09 -1.13 -1.16 0.00 0.00 179.01 178.29 1i9b n SER 132 N -4.05 0.80 -0.51 1.42 3.41 -1.26 -5.01 113.62 108.41 1i9b n SER 132 Ca -0.02 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.09 1i9b n SER 132 Cb 0.55 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.85 1i9b n SER 132 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1i9b n GLY 133 N 1.31 -0.08 3.80 5.00 0.00 -0.96 -4.85 105.19 109.42 1i9b n GLY 133 Ca 0.05 -0.87 -0.22 0.00 0.00 0.00 0.00 46.02 44.99 1i9b n GLY 133 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1i9b s ALA 134 N -1.90 3.57 -0.28 4.61 0.00 0.44 -4.49 121.76 123.71 1i9b s ALA 134 Ca 0.00 -1.48 0.01 0.00 0.00 0.00 0.00 51.96 50.48 1i9b s ALA 134 Cb 0.00 -1.21 0.08 0.00 0.00 0.00 0.00 23.12 21.99 1i9b s ALA 134 CO 0.00 0.22 0.03 0.99 0.00 0.00 0.00 175.76 177.00 1i9b s THR 135 N -2.18 1.37 -0.31 0.00 2.01 -1.25 -1.46 115.64 113.83 1i9b s THR 135 Ca 0.34 -1.45 -0.12 0.00 0.31 0.00 0.00 61.69 60.77 1i9b s THR 135 Cb -0.07 -1.87 -0.03 0.00 0.01 0.00 0.00 72.50 70.54 1i9b s THR 135 CO 0.24 -0.41 0.21 0.00 -0.69 0.00 0.00 174.62 173.98 1i9b s ARG 137 N 1.74 3.91 -0.17 0.00 0.52 -1.26 0.41 118.95 124.09 1i9b s ARG 137 Ca 0.07 -0.29 0.01 0.00 -0.52 0.00 0.00 55.73 54.99 1i9b s ARG 137 Cb -0.17 -3.23 0.02 0.00 0.52 0.00 0.00 34.95 32.09 1i9b s ARG 137 CO 0.11 0.37 -0.18 0.42 0.02 0.00 0.00 175.30 176.03 1i9b s ILE 138 N 0.12 1.93 -0.22 1.52 1.01 0.19 -4.84 121.20 120.92 1i9b s ILE 138 Ca 0.06 -0.86 -0.07 0.00 0.00 0.00 0.00 60.65 59.78 1i9b s ILE 138 Cb -0.12 -1.76 -0.03 0.00 0.01 0.00 0.00 42.46 40.56 1i9b s ILE 138 CO 0.00 0.51 0.05 -0.54 0.00 0.00 0.00 174.94 174.96 1i9b s LYS 139 N 1.34 3.71 -0.04 2.79 1.02 -1.26 -1.10 119.74 126.21 1i9b s LYS 139 Ca 0.05 -0.46 0.02 0.00 0.02 0.00 0.00 55.97 55.59 1i9b s LYS 139 Cb -0.13 -3.22 0.01 0.00 -0.52 0.00 0.00 37.83 33.97 1i9b s LYS 139 CO -0.12 -0.02 -0.07 0.96 -0.92 0.00 0.00 175.35 175.18 1i9b s ILE 140 N 1.14 0.69 0.31 2.17 -4.36 -0.88 0.48 121.20 120.76 1i9b s ILE 140 Ca 0.04 -0.25 -0.16 0.00 -0.26 0.00 0.00 60.65 60.01 1i9b s ILE 140 Cb -0.14 -0.65 0.03 0.00 1.25 0.00 0.00 42.46 42.94 1i9b s ILE 140 CO 0.03 0.24 0.68 -0.83 0.24 0.00 0.00 174.94 175.30 1i9b s GLY 141 N 0.58 0.31 0.46 6.27 0.00 -0.93 -1.82 107.32 112.19 1i9b s GLY 141 Ca -0.09 -0.66 -0.24 0.00 0.00 0.00 0.00 44.72 43.73 1i9b s GLY 141 CO 0.01 -0.34 1.19 -1.26 0.00 0.00 0.00 173.10 172.70 1i9b n SER 142 N -0.85 2.08 -0.01 1.64 2.88 -1.26 -1.96 113.62 116.14 1i9b n SER 142 Ca -0.05 1.04 -0.12 0.00 -1.33 0.00 0.00 58.87 58.41 1i9b n SER 142 Cb 0.60 -1.47 -0.14 0.00 -0.75 0.00 0.00 64.21 62.45 1i9b n SER 142 CO 0.00 0.00 0.00 -0.25 -1.23 0.00 0.00 175.04 173.56 1i9b h TRP 143 N 1.68 0.14 0.00 0.66 2.91 -1.54 -3.41 115.95 116.38 1i9b h TRP 143 Ca -0.48 -0.10 0.00 0.00 1.13 0.00 0.00 58.89 59.44 1i9b h TRP 143 Cb 1.31 -0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.96 1i9b h TRP 143 CO 0.45 1.21 -0.52 0.25 -1.03 0.00 0.00 178.44 178.80 1i9b n THR 144 N -3.17 0.00 -4.00 2.65 -2.24 -1.26 -5.00 114.28 101.24 1i9b n THR 144 Ca -0.20 -0.29 -0.35 0.00 -2.27 0.00 0.00 64.05 60.94 1i9b n THR 144 Cb 1.05 0.78 -0.10 0.00 -2.10 0.00 0.00 70.33 69.95 1i9b n THR 144 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1i9b s HIS 145 N -1.62 3.20 0.87 4.78 3.76 -1.26 -5.10 115.29 119.91 1i9b s HIS 145 Ca 0.00 -0.05 -0.11 0.00 -0.15 0.00 0.00 55.06 54.76 1i9b s HIS 145 Cb 0.02 -2.10 0.17 0.00 1.11 0.00 0.00 32.58 31.78 1i9b s HIS 145 CO 0.11 0.04 1.20 -3.38 -0.85 0.00 0.00 174.74 171.86 1i9b s HIS 146 N 0.60 1.72 0.60 1.40 -3.43 -1.26 -4.60 115.29 110.32 1i9b s HIS 146 Ca 0.03 0.16 0.28 0.00 -0.80 0.00 0.00 55.06 54.73 1i9b s HIS 146 Cb -0.13 -3.70 1.43 0.00 -1.43 0.00 0.00 32.58 28.75 1i9b s HIS 146 CO 0.01 -2.26 1.84 0.66 -2.00 0.00 0.00 174.74 172.99 1i9b h SER 147 N -1.22 0.00 1.74 7.38 4.64 -0.85 -0.01 113.55 125.23 1i9b h SER 147 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1i9b h SER 147 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1i9b h SER 147 CO 0.41 0.00 0.00 0.03 -0.87 0.00 0.00 176.83 176.40 1i9b h ARG 148 N 0.00 0.00 0.00 4.77 3.08 -1.92 -3.37 114.38 116.94 1i9b h ARG 148 Ca 0.20 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.99 1i9b h ARG 148 Cb 1.24 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 31.25 1i9b h ARG 148 CO -0.00 0.00 -1.90 0.39 -1.07 0.00 0.00 179.97 177.39 1i9b n GLU 149 N -2.82 0.35 -4.72 0.04 1.02 -0.36 -3.19 120.64 110.97 1i9b n GLU 149 Ca 0.04 0.14 -0.24 0.00 -0.02 0.00 0.00 57.16 57.08 1i9b n GLU 149 Cb 0.48 -1.13 -0.16 0.00 -0.02 0.00 0.00 31.44 30.61 1i9b n GLU 149 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1i9b s ILE 150 N -2.30 1.24 -0.03 -3.67 1.01 -0.16 0.11 121.20 117.39 1i9b s ILE 150 Ca -0.22 -0.63 0.03 0.00 0.00 0.00 0.00 60.65 59.82 1i9b s ILE 150 Cb 0.08 -1.06 0.00 0.00 0.01 0.00 0.00 42.46 41.49 1i9b s ILE 150 CO 0.30 0.36 -0.11 -0.94 0.00 0.00 0.00 174.94 174.55 1i9b s SER 151 N -0.08 1.46 -0.00 3.58 1.04 -0.81 -3.52 113.70 115.37 1i9b s SER 151 Ca -0.00 -0.23 0.03 0.00 0.48 0.00 0.00 55.95 56.23 1i9b s SER 151 Cb -0.09 -0.44 -0.03 0.00 0.10 0.00 0.00 66.02 65.56 1i9b s SER 151 CO 0.01 0.08 -0.08 0.68 0.98 0.00 0.00 173.24 174.90 1i9b s VAL 152 N 0.24 3.56 -0.03 5.02 -7.23 -1.25 -1.25 120.40 119.46 1i9b s VAL 152 Ca -0.05 -0.78 -0.04 0.00 -1.81 0.00 0.00 61.98 59.30 1i9b s VAL 152 Cb -0.10 -2.53 0.01 0.00 0.56 0.00 0.00 36.38 34.31 1i9b s VAL 152 CO 0.01 0.41 0.10 -1.81 -0.31 0.00 0.00 175.10 173.51 1i9b s ASP 153 N -1.34 -0.06 1.18 4.85 1.01 -0.73 -4.75 116.67 116.82 1i9b s ASP 153 Ca 0.16 0.09 -0.19 0.00 0.71 0.00 0.00 52.55 53.32 1i9b s ASP 153 Cb -0.11 0.21 0.27 0.00 1.01 0.00 0.00 42.92 44.30 1i9b s ASP 153 CO 0.07 -0.12 1.09 -2.65 0.21 0.00 0.00 175.17 173.77 1i9b n PRO 154 N 2.62 -2.59 0.00 8.23 -0.02 -1.26 -2.29 135.00 139.69 1i9b n PRO 154 Ca -0.15 -1.73 0.00 0.00 -2.02 0.00 0.00 63.50 59.60 1i9b n PRO 154 Cb 0.58 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.57 1i9b n PRO 154 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1i9b n THR 155 N -4.49 0.00 -0.36 3.45 -2.24 -1.26 -4.82 114.28 104.55 1i9b n THR 155 Ca 0.15 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.83 1i9b n THR 155 Cb 0.56 0.00 -0.04 0.00 -2.10 0.00 0.00 70.33 68.75 1i9b n THR 155 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1i9b n THR 156 N 0.00 0.00 0.62 4.28 -1.04 -1.26 -4.84 114.28 112.04 1i9b n THR 156 Ca 0.00 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.13 1i9b n THR 156 Cb 0.00 -0.12 0.25 0.00 -1.82 0.00 0.00 70.33 68.63 1i9b n THR 156 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1i9b n GLU 157 N 2.07 0.26 0.00 -2.82 1.02 -1.26 -4.49 120.64 115.42 1i9b n GLU 157 Ca 0.16 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 1i9b n GLU 157 Cb 0.01 -1.70 0.00 0.00 -0.02 0.00 0.00 31.44 29.73 1i9b n GLU 157 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1i9b n ASN 158 N -2.09 0.00 0.00 1.62 3.02 -1.26 -4.86 115.26 111.68 1i9b n ASN 158 Ca 0.04 0.23 0.00 0.00 -0.03 0.00 0.00 54.58 54.82 1i9b n ASN 158 Cb 0.43 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 1i9b n ASN 158 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 1i9b n SER 159 N -0.28 0.00 -4.69 6.41 3.41 -1.26 -4.54 113.62 112.67 1i9b n SER 159 Ca 0.00 0.00 -0.53 0.00 -0.26 0.00 0.00 58.87 58.08 1i9b n SER 159 Cb 0.00 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 63.89 1i9b n SER 159 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1i9b n ASP 160 N 0.00 2.74 0.15 4.04 2.03 -1.26 -4.78 116.55 119.46 1i9b n ASP 160 Ca 0.00 1.04 0.06 0.00 0.52 0.00 0.00 54.79 56.41 1i9b n ASP 160 Cb 0.00 -1.24 0.30 0.00 -0.72 0.00 0.00 41.12 39.46 1i9b n ASP 160 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 1i9b n ASP 161 N 5.46 0.29 -1.40 1.67 8.00 -1.26 -1.72 116.55 127.59 1i9b n ASP 161 Ca 0.24 0.51 0.03 0.00 0.71 0.00 0.00 54.79 56.28 1i9b n ASP 161 Cb 0.20 -0.45 0.07 0.00 -0.02 0.00 0.00 41.12 40.92 1i9b n ASP 161 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1i9b n SER 162 N -1.95 1.36 0.05 -2.24 3.41 -1.26 -4.72 113.62 108.27 1i9b n SER 162 Ca -0.01 -2.55 0.11 0.00 -0.26 0.00 0.00 58.87 56.16 1i9b n SER 162 Cb 0.33 -0.38 0.45 0.00 -0.26 0.00 0.00 64.21 64.35 1i9b n SER 162 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1i9b n GLU 163 N -0.05 0.08 0.00 4.33 0.28 -0.70 -2.58 120.64 122.00 1i9b n GLU 163 Ca 0.11 0.22 0.03 0.00 -0.16 0.00 0.00 57.16 57.35 1i9b n GLU 163 Cb 1.00 -1.63 -0.02 0.00 1.43 0.00 0.00 31.44 32.22 1i9b n GLU 163 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1i9b n TYR 164 N -1.78 0.00 -1.91 -1.84 4.01 -1.26 -5.03 117.16 109.34 1i9b n TYR 164 Ca 0.04 0.00 -0.39 0.00 -0.16 0.00 0.00 57.90 57.40 1i9b n TYR 164 Cb 0.27 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.32 1i9b n TYR 164 CO 0.00 0.00 0.00 0.12 -0.46 0.00 0.00 176.86 176.52 1i9b s PHE 165 N -1.30 2.51 0.30 -0.72 5.36 -1.07 -4.60 117.98 118.47 1i9b s PHE 165 Ca 0.04 1.38 -0.29 0.00 -0.96 0.00 0.00 56.93 57.09 1i9b s PHE 165 Cb 0.05 -3.74 -0.10 0.00 -0.34 0.00 0.00 43.02 38.89 1i9b s PHE 165 CO 0.20 -2.55 1.15 0.45 -1.46 0.00 0.00 175.22 173.01 1i9b s SER 166 N -0.86 7.12 0.30 6.13 0.15 0.00 -4.93 113.70 121.61 1i9b s SER 166 Ca 0.65 2.36 0.21 0.00 0.70 0.00 0.00 55.95 59.88 1i9b s SER 166 Cb -0.39 -2.63 0.14 0.00 -1.71 0.00 0.00 66.02 61.43 1i9b s SER 166 CO 0.48 -0.26 1.32 0.06 1.20 0.00 0.00 173.24 176.05 1i9b h GLN 167 N 3.65 0.00 -0.07 5.44 3.07 -1.92 -3.26 115.11 122.02 1i9b h GLN 167 Ca -0.47 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.27 1i9b h GLN 167 Cb 1.22 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.78 1i9b h GLN 167 CO 0.66 0.09 0.00 0.66 0.09 0.00 0.00 178.83 180.34 1i9b n TYR 168 N -2.95 0.08 -1.85 0.06 4.01 -1.26 -4.90 117.16 110.34 1i9b n TYR 168 Ca 0.01 -0.04 -0.39 0.00 -0.16 0.00 0.00 57.90 57.32 1i9b n TYR 168 Cb 0.59 0.00 0.02 0.00 -0.31 0.00 0.00 39.34 39.64 1i9b n TYR 168 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 1i9b s SER 169 N -1.79 5.83 0.44 7.72 0.15 -1.23 -4.86 113.70 119.95 1i9b s SER 169 Ca 0.36 2.83 0.30 0.00 0.70 0.00 0.00 55.95 60.14 1i9b s SER 169 Cb 0.19 -2.65 1.41 0.00 -1.71 0.00 0.00 66.02 63.26 1i9b s SER 169 CO 0.30 -1.20 1.92 -0.09 1.20 0.00 0.00 173.24 175.36 1i9b h ARG 170 N 2.19 0.00 -5.29 5.44 2.43 -1.91 -3.44 114.38 113.80 1i9b h ARG 170 Ca -0.51 0.00 -0.67 0.00 -0.81 0.00 0.00 59.98 57.99 1i9b h ARG 170 Cb 1.27 0.00 -0.13 0.00 -0.42 0.00 0.00 29.97 30.69 1i9b h ARG 170 CO 0.60 0.00 -0.51 -0.06 -1.51 0.00 0.00 179.97 178.49 1i9b s PHE 171 N -3.63 1.93 0.04 2.20 0.40 -1.26 -2.76 117.98 114.90 1i9b s PHE 171 Ca 0.00 -0.92 -0.04 0.00 -0.60 0.00 0.00 56.93 55.38 1i9b s PHE 171 Cb 0.09 -1.65 -0.02 0.00 0.51 0.00 0.00 43.02 41.96 1i9b s PHE 171 CO 0.41 0.22 0.05 -1.83 0.70 0.00 0.00 175.22 174.77 1i9b s GLU 172 N -3.88 0.53 -0.21 0.44 -1.05 -0.45 -4.82 118.70 109.26 1i9b s GLU 172 Ca 0.10 -0.80 -0.10 0.00 -0.15 0.00 0.00 54.97 54.02 1i9b s GLU 172 Cb 0.02 0.20 -0.05 0.00 -0.44 0.00 0.00 34.13 33.86 1i9b s GLU 172 CO 0.06 -0.12 0.14 0.42 0.95 0.00 0.00 175.26 176.71 1i9b s ILE 173 N -2.58 5.39 -0.15 1.83 1.01 -1.26 -1.90 121.20 123.55 1i9b s ILE 173 Ca -0.05 0.19 -0.12 0.00 0.00 0.00 0.00 60.65 60.67 1i9b s ILE 173 Cb -0.02 -3.48 -0.08 0.00 0.01 0.00 0.00 42.46 38.89 1i9b s ILE 173 CO -0.05 0.41 0.05 -0.07 0.00 0.00 0.00 174.94 175.29 1i9b h LEU 174 N 6.93 0.00 -7.14 2.97 3.38 -1.13 -3.49 115.31 116.83 1i9b h LEU 174 Ca -0.40 -0.22 -0.05 0.00 0.09 0.00 0.00 57.88 57.30 1i9b h LEU 174 Cb 1.16 0.00 -0.15 0.00 0.09 0.00 0.00 40.66 41.76 1i9b h LEU 174 CO 0.73 0.88 0.09 -0.62 0.09 0.00 0.00 178.44 179.60 1i9b s ASP 175 N -5.98 -0.48 -0.05 -0.43 2.15 -0.76 -5.04 116.67 106.08 1i9b s ASP 175 Ca -0.15 0.14 -0.00 0.00 0.43 0.00 0.00 52.55 52.97 1i9b s ASP 175 Cb 0.02 0.53 0.03 0.00 -0.30 0.00 0.00 42.92 43.19 1i9b s ASP 175 CO 0.30 -0.79 -0.01 -0.69 -0.17 0.00 0.00 175.17 173.81 1i9b s VAL 176 N -2.80 0.35 0.03 1.11 1.01 -1.26 -1.14 120.40 117.70 1i9b s VAL 176 Ca -0.03 0.05 0.03 0.00 0.00 0.00 0.00 61.98 62.03 1i9b s VAL 176 Cb -0.00 -0.46 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 1i9b s VAL 176 CO -0.05 0.22 -0.10 0.42 0.00 0.00 0.00 175.10 175.60 1i9b s THR 177 N 1.43 0.72 -0.10 3.92 -4.23 -1.10 -4.99 115.64 111.28 1i9b s THR 177 Ca -0.04 -0.91 0.01 0.00 -1.18 0.00 0.00 61.69 59.58 1i9b s THR 177 Cb -0.13 -0.71 0.02 0.00 1.34 0.00 0.00 72.50 73.02 1i9b s THR 177 CO -0.03 -0.17 -0.12 -1.10 -0.54 0.00 0.00 174.62 172.66 1i9b s GLN 178 N -1.19 1.92 -0.16 3.99 -0.21 -1.26 -0.61 119.66 122.15 1i9b s GLN 178 Ca -0.04 -0.45 -0.01 0.00 0.02 0.00 0.00 55.36 54.89 1i9b s GLN 178 Cb -0.08 -1.72 0.04 0.00 1.00 0.00 0.00 33.01 32.25 1i9b s GLN 178 CO 0.01 -0.11 -0.05 0.15 -2.12 0.00 0.00 175.29 173.17 1i9b s LYS 179 N 1.15 1.34 0.67 2.91 1.02 -0.25 -4.88 119.74 121.71 1i9b s LYS 179 Ca -0.04 -0.46 -0.15 0.00 0.02 0.00 0.00 55.97 55.34 1i9b s LYS 179 Cb -0.14 -1.93 0.01 0.00 -0.52 0.00 0.00 37.83 35.25 1i9b s LYS 179 CO -0.03 -0.43 1.12 -1.59 -0.92 0.00 0.00 175.35 173.50 1i9b s LYS 180 N 1.67 2.70 0.36 1.68 0.00 -1.26 -2.27 119.74 122.61 1i9b s LYS 180 Ca 0.01 1.42 0.05 0.00 0.00 0.00 0.00 55.97 57.45 1i9b s LYS 180 Cb -0.15 -1.93 -0.02 0.00 0.00 0.00 0.00 37.83 35.73 1i9b s LYS 180 CO -0.08 -1.34 0.18 0.09 0.00 0.00 0.00 175.35 174.21 1i9b n ASN 181 N -2.50 0.52 -3.26 0.03 3.02 0.18 -4.88 115.26 108.37 1i9b n ASN 181 Ca 0.11 -3.04 -0.04 0.00 -0.03 0.00 0.00 54.58 51.58 1i9b n ASN 181 Cb 0.52 1.18 -0.04 0.00 -0.61 0.00 0.00 39.78 40.83 1i9b n ASN 181 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1i9b s SER 182 N -3.28 -0.44 0.01 6.41 0.15 -1.26 -2.54 113.70 112.75 1i9b s SER 182 Ca 0.26 0.28 0.06 0.00 0.70 0.00 0.00 55.95 57.25 1i9b s SER 182 Cb 0.01 1.54 -0.03 0.00 -1.71 0.00 0.00 66.02 65.83 1i9b s SER 182 CO 0.18 -0.30 -0.15 -0.69 1.20 0.00 0.00 173.24 173.49 1i9b s VAL 183 N 2.67 3.04 -0.16 4.45 1.01 -1.10 -4.90 120.40 125.41 1i9b s VAL 183 Ca 0.14 -1.00 -0.02 0.00 0.00 0.00 0.00 61.98 61.11 1i9b s VAL 183 Cb -0.14 -2.27 -0.01 0.00 0.00 0.00 0.00 36.38 33.95 1i9b s VAL 183 CO -0.22 0.40 -0.10 -0.89 0.00 0.00 0.00 175.10 174.30 1i9b s THR 184 N -0.90 3.20 -0.06 3.92 2.01 -1.26 0.60 115.64 123.15 1i9b s THR 184 Ca 0.15 -0.59 -0.01 0.00 0.31 0.00 0.00 61.69 61.55 1i9b s THR 184 Cb -0.11 -2.39 -0.03 0.00 0.01 0.00 0.00 72.50 69.98 1i9b s THR 184 CO 0.05 0.49 0.01 -0.31 -0.69 0.00 0.00 174.62 174.17 1i9b s TYR 185 N 0.69 3.16 0.39 4.92 1.51 -1.23 -4.98 117.35 121.80 1i9b s TYR 185 Ca -0.05 0.18 0.14 0.00 -1.01 0.00 0.00 57.07 56.33 1i9b s TYR 185 Cb -0.15 -1.76 0.97 0.00 -0.11 0.00 0.00 41.96 40.91 1i9b s TYR 185 CO 0.02 0.48 1.85 0.66 -1.11 0.00 0.00 175.55 177.45 1i9b h SER 186 N 4.92 0.52 -0.87 2.29 4.64 -1.99 0.39 113.55 123.45 1i9b h SER 186 Ca -0.50 0.05 0.01 0.00 -0.47 0.00 0.00 61.79 60.88 1i9b h SER 186 Cb 1.19 -0.05 -0.04 0.00 -0.31 0.00 0.00 62.40 63.19 1i9b h SER 186 CO 0.55 0.22 0.58 0.00 -0.87 0.00 0.00 176.83 177.31 1i9b h PRO 189 N 7.44 -0.12 0.00 0.00 0.11 -1.84 -3.25 132.00 134.35 1i9b h PRO 189 Ca -0.31 0.01 -0.43 0.00 0.11 0.00 0.00 66.00 65.38 1i9b h PRO 189 Cb 1.17 0.03 0.13 0.00 0.11 0.00 0.00 31.00 32.43 1i9b h PRO 189 CO 0.48 -0.08 0.26 0.39 -0.21 0.00 0.00 178.00 178.84 1i9b n GLU 190 N -5.36 -0.68 -3.79 1.05 -0.58 -1.26 -4.91 120.64 105.10 1i9b n GLU 190 Ca 0.03 -2.29 -0.35 0.00 -0.42 0.00 0.00 57.16 54.13 1i9b n GLU 190 Cb 0.33 -0.98 -0.05 0.00 -0.57 0.00 0.00 31.44 30.16 1i9b n GLU 190 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1i9b s ALA 191 N -3.57 3.86 -0.29 0.62 0.00 -1.26 -4.34 121.76 116.77 1i9b s ALA 191 Ca 0.68 -0.60 0.03 0.00 0.00 0.00 0.00 51.96 52.07 1i9b s ALA 191 Cb -0.03 -2.03 0.08 0.00 0.00 0.00 0.00 23.12 21.14 1i9b s ALA 191 CO 0.47 0.65 -0.03 0.71 0.00 0.00 0.00 175.76 177.55 1i9b s TYR 192 N -1.23 3.40 0.64 0.00 1.51 0.20 -0.53 117.35 121.33 1i9b s TYR 192 Ca 0.25 -2.58 -0.17 0.00 -1.01 0.00 0.00 57.07 53.56 1i9b s TYR 192 Cb -0.13 -2.34 -0.01 0.00 -0.11 0.00 0.00 41.96 39.37 1i9b s TYR 192 CO 0.14 -0.90 1.16 -1.21 -1.11 0.00 0.00 175.55 173.63 1i9b s GLU 193 N 1.04 2.77 0.02 -0.62 2.02 -1.26 -2.72 118.70 119.96 1i9b s GLU 193 Ca 0.00 1.63 -0.28 0.00 0.02 0.00 0.00 54.97 56.35 1i9b s GLU 193 Cb -0.19 -1.92 0.08 0.00 0.10 0.00 0.00 34.13 32.19 1i9b s GLU 193 CO -0.07 -1.32 0.69 0.16 0.02 0.00 0.00 175.26 174.74 1i9b s ASP 194 N -2.05 -0.59 -0.21 -0.19 1.47 -1.05 -4.26 116.67 109.79 1i9b s ASP 194 Ca 0.72 0.39 -0.08 0.00 1.18 0.00 0.00 52.55 54.76 1i9b s ASP 194 Cb -0.26 0.54 -0.04 0.00 -0.34 0.00 0.00 42.92 42.82 1i9b s ASP 194 CO 0.38 -0.72 0.10 -0.69 0.68 0.00 0.00 175.17 174.91 1i9b s VAL 195 N -2.24 4.89 -0.24 2.11 1.01 -0.76 0.47 120.40 125.64 1i9b s VAL 195 Ca -0.05 0.01 -0.09 0.00 0.00 0.00 0.00 61.98 61.85 1i9b s VAL 195 Cb -0.00 -3.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.09 1i9b s VAL 195 CO -0.00 0.40 0.12 -0.70 0.00 0.00 0.00 175.10 174.92 1i9b s GLU 196 N 0.83 3.87 -0.19 2.72 2.12 -0.96 -2.06 118.70 125.03 1i9b s GLU 196 Ca 0.05 -0.37 -0.04 0.00 0.36 0.00 0.00 54.97 54.97 1i9b s GLU 196 Cb -0.13 -3.44 -0.02 0.00 0.26 0.00 0.00 34.13 30.80 1i9b s GLU 196 CO 0.02 -0.06 -0.02 0.08 -0.54 0.00 0.00 175.26 174.74 1i9b s VAL 197 N 1.34 3.80 -0.28 3.70 1.01 -0.25 -1.10 120.40 128.62 1i9b s VAL 197 Ca 0.06 -0.37 -0.09 0.00 0.00 0.00 0.00 61.98 61.58 1i9b s VAL 197 Cb -0.15 -2.70 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1i9b s VAL 197 CO 0.05 0.45 0.12 -0.44 0.00 0.00 0.00 175.10 175.28 1i9b s SER 198 N 0.84 5.41 -0.47 3.32 0.01 0.22 -0.63 113.70 122.40 1i9b s SER 198 Ca -0.00 -0.30 -0.14 0.00 1.31 0.00 0.00 55.95 56.81 1i9b s SER 198 Cb -0.14 -1.98 0.08 0.00 0.21 0.00 0.00 66.02 64.19 1i9b s SER 198 CO 0.02 -0.10 0.38 -0.22 0.41 0.00 0.00 173.24 173.73 1i9b s LEU 199 N 1.63 5.62 -0.42 2.44 2.96 0.17 -2.72 118.68 128.36 1i9b s LEU 199 Ca 0.06 -1.44 -0.17 0.00 -0.22 0.00 0.00 54.13 52.35 1i9b s LEU 199 Cb -0.16 -2.14 0.02 0.00 0.50 0.00 0.00 46.19 44.41 1i9b s LEU 199 CO 0.06 -0.66 0.43 0.21 -1.32 0.00 0.00 176.35 175.07 1i9b s ASN 200 N 2.65 6.19 0.28 3.68 2.47 -0.29 -0.76 114.94 129.16 1i9b s ASN 200 Ca 0.04 -0.67 0.02 0.00 0.42 0.00 0.00 52.86 52.67 1i9b s ASN 200 Cb -0.25 -2.22 -0.03 0.00 -1.45 0.00 0.00 41.25 37.30 1i9b s ASN 200 CO 0.05 -0.56 0.27 0.72 -3.72 0.00 0.00 177.10 173.86 1i9b s PHE 201 N 2.11 1.37 0.17 0.43 -0.71 -0.54 -0.50 117.98 120.31 1i9b s PHE 201 Ca 0.12 -1.46 -0.22 0.00 -1.04 0.00 0.00 56.93 54.32 1i9b s PHE 201 Cb -0.17 -0.52 0.06 0.00 -1.21 0.00 0.00 43.02 41.19 1i9b s PHE 201 CO 0.13 -0.84 0.60 -0.98 -1.34 0.00 0.00 175.22 172.79 1i9b s ARG 202 N -3.65 1.32 0.73 1.99 1.70 -0.80 -0.42 118.95 119.82 1i9b s ARG 202 Ca 0.38 -0.53 -0.13 0.00 -0.47 0.00 0.00 55.73 54.97 1i9b s ARG 202 Cb 0.03 0.59 0.04 0.00 -0.57 0.00 0.00 34.95 35.03 1i9b s ARG 202 CO 0.20 -0.58 1.11 0.21 -1.08 0.00 0.00 175.30 175.16 1i9b s LYS 203 N -3.77 2.41 0.81 3.89 2.20 0.54 -1.34 119.74 124.48 1i9b s LYS 203 Ca 0.02 1.34 -0.12 0.00 -0.36 0.00 0.00 55.97 56.86 1i9b s LYS 203 Cb -0.01 -1.91 0.08 0.00 -1.51 0.00 0.00 37.83 34.48 1i9b s LYS 203 CO -0.11 -1.54 1.13 0.15 -0.36 0.00 0.00 175.35 174.61 1i9b s LYS 204 N -4.44 1.94 0.00 4.03 1.02 -1.11 -4.76 119.74 116.42 1i9b s LYS 204 Ca 0.65 0.39 0.14 0.00 0.02 0.00 0.00 55.97 57.17 1i9b s LYS 204 Cb -0.20 -1.92 0.11 0.00 -0.52 0.00 0.00 37.83 35.30 1i9b s LYS 204 CO 0.49 -1.67 0.94 0.41 -0.92 0.00 0.00 175.35 174.60