#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ihl s LYS 2 N 0.00 3.45 -0.02 2.12 -0.14 -0.69 -4.85 119.74 119.61 3ihl s LYS 2 Ca 0.00 -0.39 0.03 0.00 -1.36 0.00 0.00 55.97 54.25 3ihl s LYS 2 Cb 0.00 -3.05 -0.00 0.00 -1.68 0.00 0.00 37.83 33.09 3ihl s LYS 2 CO 0.00 0.63 -0.11 0.71 -0.76 0.00 0.00 175.35 175.82 3ihl s TYR 3 N -1.46 1.05 -0.24 3.18 2.02 0.69 -0.95 117.35 121.64 3ihl s TYR 3 Ca 0.33 -0.23 0.02 0.00 -0.37 0.00 0.00 57.07 56.82 3ihl s TYR 3 Cb -0.13 -0.71 0.06 0.00 -0.40 0.00 0.00 41.96 40.78 3ihl s TYR 3 CO 0.25 -0.06 -0.09 0.42 -1.57 0.00 0.00 175.55 174.50 3ihl s ILE 4 N -0.08 1.92 -0.13 2.71 1.01 -0.29 -2.05 121.20 124.29 3ihl s ILE 4 Ca 0.01 -1.43 -0.19 0.00 0.00 0.00 0.00 60.65 59.05 3ihl s ILE 4 Cb -0.06 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.30 3ihl s ILE 4 CO 0.00 -0.01 0.52 -0.22 0.00 0.00 0.00 174.94 175.22 3ihl s LEU 5 N 1.23 4.25 -0.19 2.97 2.96 -0.76 0.39 118.68 129.53 3ihl s LEU 5 Ca -0.07 0.84 -0.02 0.00 -0.22 0.00 0.00 54.13 54.66 3ihl s LEU 5 Cb -0.19 -2.75 -0.00 0.00 0.50 0.00 0.00 46.19 43.74 3ihl s LEU 5 CO -0.06 -0.06 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.13 3ihl s VAL 6 N 0.87 3.02 0.37 1.68 1.01 0.97 -0.54 120.40 127.79 3ihl s VAL 6 Ca 0.27 -0.63 0.07 0.00 0.00 0.00 0.00 61.98 61.70 3ihl s VAL 6 Cb -0.15 -2.33 -0.07 0.00 0.00 0.00 0.00 36.38 33.82 3ihl s VAL 6 CO 0.11 0.47 -0.02 0.42 0.00 0.00 0.00 175.10 176.08 3ihl s THR 7 N 1.15 1.95 0.10 3.92 -4.23 -0.50 -1.23 115.64 116.81 3ihl s THR 7 Ca 0.01 -2.07 0.09 0.00 -1.18 0.00 0.00 61.69 58.54 3ihl s THR 7 Cb -0.14 -2.84 -0.03 0.00 1.34 0.00 0.00 72.50 70.82 3ihl s THR 7 CO -0.03 -0.08 -0.22 -0.83 -0.54 0.00 0.00 174.62 172.92 3ihl s GLY 8 N -3.64 1.28 0.11 3.99 0.00 -1.26 -0.70 107.32 107.10 3ihl s GLY 8 Ca 0.34 -1.26 0.07 0.00 0.00 0.00 0.00 44.72 43.87 3ihl s GLY 8 CO 0.17 -1.25 -0.18 -0.32 0.00 0.00 0.00 173.10 171.52 3ihl s GLY 9 N -1.85 1.17 0.00 0.20 0.00 0.76 -1.06 107.32 106.55 3ihl s GLY 9 Ca 0.08 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.55 3ihl s GLY 9 CO 0.04 -1.27 0.00 -0.62 0.00 0.00 0.00 173.10 171.25 3ihl n VAL 10 N 0.91 0.00 -4.19 1.40 0.31 -1.26 -3.63 118.33 111.86 3ihl n VAL 10 Ca -0.18 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.03 3ihl n VAL 10 Cb 0.55 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 33.38 3ihl n VAL 10 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 3ihl s ILE 11 N 0.00 0.85 0.94 2.52 -4.36 -1.26 -5.04 121.20 114.86 3ihl s ILE 11 Ca 0.00 -1.94 -0.14 0.00 -0.26 0.00 0.00 60.65 58.32 3ihl s ILE 11 Cb 0.00 -1.69 0.16 0.00 1.25 0.00 0.00 42.46 42.18 3ihl s ILE 11 CO 0.00 -0.80 1.17 -0.94 0.24 0.00 0.00 174.94 174.61 3ihl s SER 12 N -3.01 3.27 -1.44 4.36 1.04 -1.26 -4.13 113.70 112.53 3ihl s SER 12 Ca 0.12 0.78 -0.09 0.00 0.48 0.00 0.00 55.95 57.25 3ihl s SER 12 Cb 0.04 -1.22 0.05 0.00 0.10 0.00 0.00 66.02 64.99 3ihl s SER 12 CO -0.03 -2.68 0.68 0.61 0.98 0.00 0.00 173.24 172.79 3ihl n GLY 13 N -2.47 -0.51 0.06 7.32 0.00 -1.26 -4.86 105.19 103.48 3ihl n GLY 13 Ca 0.09 0.14 0.12 0.00 0.00 0.00 0.00 46.02 46.37 3ihl n GLY 13 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 3ihl n ILE 14 N -4.36 0.35 0.00 -0.61 0.13 -1.26 -4.94 119.36 108.68 3ihl n ILE 14 Ca -0.04 -0.26 0.00 0.00 -1.10 0.00 0.00 62.75 61.35 3ihl n ILE 14 Cb 0.57 -0.15 0.00 0.00 -0.84 0.00 0.00 39.64 39.22 3ihl n ILE 14 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 3ihl n GLY 15 N 1.34 1.58 0.12 4.50 0.00 -1.26 -4.92 105.19 106.56 3ihl n GLY 15 Ca 0.04 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 3ihl n GLY 15 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3ihl h LYS 16 N 0.00 -0.01 -0.20 1.61 1.57 -1.92 -1.43 116.57 116.20 3ihl h LYS 16 Ca 0.00 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3ihl h LYS 16 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.30 3ihl h LYS 16 CO 0.00 -0.01 0.11 0.78 -0.57 0.00 0.00 179.45 179.76 3ihl h GLY 17 N -0.02 0.29 1.10 3.86 0.00 -1.98 -1.07 103.07 105.26 3ihl h GLY 17 Ca 0.11 -0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.31 3ihl h GLY 17 CO -0.24 0.13 0.60 -2.22 0.00 0.00 0.00 176.54 174.81 3ihl h ILE 18 N 0.22 1.24 -0.24 2.60 1.08 -1.96 0.29 117.51 120.73 3ihl h ILE 18 Ca 0.07 -0.44 -0.07 0.00 -0.39 0.00 0.00 64.86 64.03 3ihl h ILE 18 Cb 0.07 -0.10 -0.01 0.00 -3.07 0.00 0.00 36.82 33.71 3ihl h ILE 18 CO -0.01 0.23 -0.13 0.40 -0.69 0.00 0.00 178.15 177.95 3ihl h ILE 19 N 1.24 1.30 -0.18 -0.67 1.08 -0.95 0.12 117.51 119.45 3ihl h ILE 19 Ca 0.33 -1.22 -0.01 0.00 -0.39 0.00 0.00 64.86 63.57 3ihl h ILE 19 Cb -0.13 1.59 -0.01 0.00 -3.07 0.00 0.00 36.82 35.20 3ihl h ILE 19 CO -0.07 0.38 0.07 0.00 -0.69 0.00 0.00 178.15 177.84 3ihl h ALA 20 N 0.71 0.24 -0.59 1.87 0.00 -0.97 -0.15 119.26 120.37 3ihl h ALA 20 Ca 0.05 -0.11 0.09 0.00 0.00 0.00 0.00 54.91 54.95 3ihl h ALA 20 Cb 0.64 -0.07 -0.07 0.00 0.00 0.00 0.00 17.79 18.29 3ihl h ALA 20 CO 0.04 -0.17 0.20 1.03 0.00 0.00 0.00 179.25 180.35 3ihl h SER 21 N 0.14 0.18 -0.33 0.00 0.87 -0.43 -0.88 113.55 113.10 3ihl h SER 21 Ca 0.06 0.08 -0.16 0.00 -1.23 0.00 0.00 61.79 60.54 3ihl h SER 21 Cb 0.17 0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.20 3ihl h SER 21 CO -0.01 0.11 -0.43 0.28 -0.53 0.00 0.00 176.83 176.25 3ihl h SER 22 N 0.37 0.95 -0.72 6.23 0.02 -0.62 -1.67 113.55 118.11 3ihl h SER 22 Ca 0.30 -0.50 -0.02 0.00 -0.84 0.00 0.00 61.79 60.73 3ihl h SER 22 Cb 0.38 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.61 3ihl h SER 22 CO -0.31 1.26 0.36 0.40 -1.14 0.00 0.00 176.83 177.39 3ihl h ILE 23 N 0.67 1.23 -0.00 3.27 2.04 -0.82 -0.50 117.51 123.40 3ihl h ILE 23 Ca 0.04 -0.64 0.03 0.00 1.00 0.00 0.00 64.86 65.29 3ihl h ILE 23 Cb 1.03 0.33 -0.04 0.00 -0.74 0.00 0.00 36.82 37.40 3ihl h ILE 23 CO 0.10 0.27 -0.26 1.23 0.00 0.00 0.00 178.15 179.49 3ihl h GLY 24 N 1.00 -0.39 1.01 5.37 0.00 -0.89 -2.46 103.07 106.70 3ihl h GLY 24 Ca 0.25 0.31 -0.01 0.00 0.00 0.00 0.00 47.33 47.88 3ihl h GLY 24 CO -0.03 -0.21 0.42 -0.84 0.00 0.00 0.00 176.54 175.88 3ihl h THR 25 N -0.40 1.21 -0.43 4.70 2.02 -1.01 -2.29 112.91 116.71 3ihl h THR 25 Ca 0.06 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.74 3ihl h THR 25 Cb 0.48 0.22 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 3ihl h THR 25 CO -0.23 0.23 0.29 0.40 0.37 0.00 0.00 175.52 176.58 3ihl h ILE 26 N 1.00 1.11 -0.09 3.11 2.04 -0.85 -1.43 117.51 122.40 3ihl h ILE 26 Ca 0.26 -0.20 -0.18 0.00 1.00 0.00 0.00 64.86 65.74 3ihl h ILE 26 Cb -0.00 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.55 3ihl h ILE 26 CO -0.05 0.11 -0.69 -0.07 0.00 0.00 0.00 178.15 177.45 3ihl h LEU 27 N 0.59 0.47 -0.78 1.44 3.38 -1.28 -2.83 115.31 116.30 3ihl h LEU 27 Ca 0.16 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.81 3ihl h LEU 27 Cb -0.07 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 3ihl h LEU 27 CO -0.03 1.02 0.42 0.11 0.09 0.00 0.00 178.44 180.05 3ihl h LYS 28 N 0.28 1.09 -1.12 1.13 1.57 -1.20 -1.34 116.57 116.99 3ihl h LYS 28 Ca -0.02 -0.13 0.32 0.00 -1.87 0.00 0.00 60.65 58.95 3ihl h LYS 28 Cb 1.25 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 33.30 3ihl h LYS 28 CO 0.12 0.81 0.79 1.03 -0.57 0.00 0.00 179.45 181.63 3ihl h SER 29 N 1.08 0.08 -0.44 0.86 0.87 -1.01 0.36 113.55 115.35 3ihl h SER 29 Ca 0.27 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.85 3ihl h SER 29 Cb 0.04 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.01 3ihl h SER 29 CO -0.04 0.01 0.00 0.00 -0.53 0.00 0.00 176.83 176.27 3ihl n GLY 31 N 1.25 0.67 3.85 0.00 0.00 0.13 -5.06 105.19 106.02 3ihl n GLY 31 Ca 0.16 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.44 3ihl n GLY 31 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ihl s LEU 32 N 0.00 4.10 -0.29 0.99 1.43 -1.05 -5.01 118.68 118.85 3ihl s LEU 32 Ca 0.00 1.25 -0.22 0.00 -1.03 0.00 0.00 54.13 54.13 3ihl s LEU 32 Cb 0.00 -3.99 -0.01 0.00 0.03 0.00 0.00 46.19 42.22 3ihl s LEU 32 CO 0.00 -0.17 0.71 -0.13 0.23 0.00 0.00 176.35 176.99 3ihl s ARG 33 N -2.88 3.97 -0.04 1.70 0.52 -1.26 -4.30 118.95 116.67 3ihl s ARG 33 Ca 0.52 0.50 0.03 0.00 -0.52 0.00 0.00 55.73 56.26 3ihl s ARG 33 Cb -0.11 -3.71 0.00 0.00 0.52 0.00 0.00 34.95 31.65 3ihl s ARG 33 CO 0.18 -0.60 -0.12 0.08 0.02 0.00 0.00 175.30 174.87 3ihl s VAL 34 N 2.77 1.03 0.24 3.52 1.01 -1.26 -0.29 120.40 127.41 3ihl s VAL 34 Ca 0.29 -0.47 0.11 0.00 0.00 0.00 0.00 61.98 61.91 3ihl s VAL 34 Cb -0.15 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.27 3ihl s VAL 34 CO 0.11 0.32 -0.20 0.28 0.00 0.00 0.00 175.10 175.61 3ihl s THR 35 N 0.29 2.32 -0.03 3.92 -1.32 -0.32 -4.94 115.64 115.56 3ihl s THR 35 Ca -0.06 -2.27 0.07 0.00 -1.21 0.00 0.00 61.69 58.21 3ihl s THR 35 Cb -0.11 -2.20 -0.01 0.00 -1.51 0.00 0.00 72.50 68.66 3ihl s THR 35 CO 0.02 -0.36 -0.23 0.00 -2.21 0.00 0.00 174.62 171.84 3ihl s ALA 36 N -2.35 1.94 0.02 11.08 0.00 -1.26 -0.64 121.76 130.54 3ihl s ALA 36 Ca 0.26 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.25 3ihl s ALA 36 Cb -0.05 -0.53 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 3ihl s ALA 36 CO 0.12 0.44 -0.03 0.96 0.00 0.00 0.00 175.76 177.25 3ihl s ILE 37 N -0.39 0.12 -0.04 0.00 -4.36 -0.64 -4.94 121.20 110.95 3ihl s ILE 37 Ca 0.05 -0.88 0.06 0.00 -0.26 0.00 0.00 60.65 59.61 3ihl s ILE 37 Cb -0.10 -0.26 -0.01 0.00 1.25 0.00 0.00 42.46 43.33 3ihl s ILE 37 CO 0.00 -0.47 -0.21 -0.75 0.24 0.00 0.00 174.94 173.75 3ihl s LYS 38 N -1.40 2.05 -0.17 0.37 2.20 -1.26 -0.03 119.74 121.50 3ihl s LYS 38 Ca -0.15 -0.76 0.01 0.00 -0.36 0.00 0.00 55.97 54.71 3ihl s LYS 38 Cb -0.10 -1.81 0.02 0.00 -1.51 0.00 0.00 37.83 34.44 3ihl s LYS 38 CO -0.01 0.35 -0.16 0.42 -0.36 0.00 0.00 175.35 175.59 3ihl s ILE 39 N -0.18 1.81 -0.31 5.43 1.01 0.46 -4.95 121.20 124.47 3ihl s ILE 39 Ca -0.00 -0.83 0.00 0.00 0.00 0.00 0.00 60.65 59.82 3ihl s ILE 39 Cb -0.11 -1.69 0.07 0.00 0.01 0.00 0.00 42.46 40.74 3ihl s ILE 39 CO 0.02 0.45 0.01 -0.62 0.00 0.00 0.00 174.94 174.81 3ihl s ASP 40 N 1.38 4.82 0.32 3.58 -1.08 -1.26 -0.62 116.67 123.80 3ihl s ASP 40 Ca 0.04 -1.59 -0.29 0.00 -0.52 0.00 0.00 52.55 50.19 3ihl s ASP 40 Cb -0.13 -1.68 -0.11 0.00 -1.46 0.00 0.00 42.92 39.54 3ihl s ASP 40 CO -0.11 -0.31 1.53 -2.84 0.52 0.00 0.00 175.17 173.96 3ihl s PRO 41 N 1.13 4.14 0.09 4.34 0.02 -1.26 -4.96 135.00 138.50 3ihl s PRO 41 Ca -0.01 2.54 -0.26 0.00 0.02 0.00 0.00 61.00 63.29 3ihl s PRO 41 Cb -0.20 -3.01 -0.06 0.00 0.02 0.00 0.00 34.50 31.24 3ihl s PRO 41 CO -0.04 -0.56 0.81 -0.47 -0.33 0.00 0.00 177.00 176.41 3ihl s TYR 42 N -0.41 3.79 -0.38 6.54 5.04 -1.26 -4.86 117.35 125.81 3ihl s TYR 42 Ca 0.59 1.59 -0.45 0.00 -2.44 0.00 0.00 57.07 56.35 3ihl s TYR 42 Cb -0.47 -2.86 -0.20 0.00 0.35 0.00 0.00 41.96 38.79 3ihl s TYR 42 CO 0.53 0.32 1.49 -0.89 -1.34 0.00 0.00 175.55 175.65 3ihl n ILE 43 N 2.51 0.01 -1.60 3.14 -0.00 -1.26 -4.67 119.36 117.50 3ihl n ILE 43 Ca -0.02 -0.00 -0.44 0.00 -0.00 0.00 0.00 62.75 62.28 3ihl n ILE 43 Cb 0.50 -0.43 -0.01 0.00 -0.00 0.00 0.00 39.64 39.69 3ihl n ILE 43 CO 0.00 0.00 0.00 -3.20 -0.00 0.00 0.00 176.55 173.35 3ihl n ASN 44 N 3.51 1.45 -4.35 4.38 5.15 -1.26 -4.84 115.26 119.30 3ihl n ASN 44 Ca 0.28 1.18 -0.41 0.00 -0.60 0.00 0.00 54.58 55.03 3ihl n ASN 44 Cb -0.02 -1.31 -0.10 0.00 -0.53 0.00 0.00 39.78 37.82 3ihl n ASN 44 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 3ihl s ILE 45 N -1.05 4.60 -0.26 -1.44 1.01 -1.26 -4.92 121.20 117.87 3ihl s ILE 45 Ca 0.58 -1.04 -0.14 0.00 0.00 0.00 0.00 60.65 60.05 3ihl s ILE 45 Cb -0.69 -3.67 -0.04 0.00 0.01 0.00 0.00 42.46 38.07 3ihl s ILE 45 CO 0.60 -0.37 0.32 -1.81 0.00 0.00 0.00 174.94 173.68 3ihl s ASP 46 N 1.87 6.22 0.29 3.58 1.01 -1.26 -5.00 116.67 123.37 3ihl s ASP 46 Ca 0.03 0.24 0.03 0.00 0.71 0.00 0.00 52.55 53.55 3ihl s ASP 46 Cb -0.21 -2.19 -0.06 0.00 1.01 0.00 0.00 42.92 41.48 3ihl s ASP 46 CO 0.05 -0.13 0.07 0.00 0.21 0.00 0.00 175.17 175.38 3ihl s ALA 47 N 1.84 2.01 -0.29 5.23 0.00 -1.26 -3.72 121.76 125.58 3ihl s ALA 47 Ca 0.13 -1.95 -0.34 0.00 0.00 0.00 0.00 51.96 49.81 3ihl s ALA 47 Cb -0.16 0.84 0.18 0.00 0.00 0.00 0.00 23.12 23.98 3ihl s ALA 47 CO 0.09 -0.38 1.37 0.20 0.00 0.00 0.00 175.76 177.05 3ihl s GLY 48 N -3.39 -0.05 -0.10 0.00 0.00 -1.08 -5.03 107.32 97.67 3ihl s GLY 48 Ca 0.37 2.38 -0.18 0.00 0.00 0.00 0.00 44.72 47.29 3ihl s GLY 48 CO 0.14 0.87 0.49 -1.59 0.00 0.00 0.00 173.10 173.01 3ihl s THR 49 N -1.53 5.15 -0.09 0.90 2.01 -1.26 -1.62 115.64 119.20 3ihl s THR 49 Ca 0.10 0.98 -0.03 0.00 0.31 0.00 0.00 61.69 63.06 3ihl s THR 49 Cb -0.01 -3.82 -0.03 0.00 0.01 0.00 0.00 72.50 68.64 3ihl s THR 49 CO -0.05 0.35 0.03 -0.36 -0.69 0.00 0.00 174.62 173.90 3ihl s PHE 50 N 0.41 3.24 -0.19 4.92 2.99 -0.52 -4.99 117.98 123.84 3ihl s PHE 50 Ca 0.27 0.25 -0.03 0.00 0.00 0.00 0.00 56.93 57.41 3ihl s PHE 50 Cb -0.16 -1.81 0.06 0.00 0.00 0.00 0.00 43.02 41.12 3ihl s PHE 50 CO 0.11 0.52 0.05 -1.12 -0.00 0.00 0.00 175.22 174.79 3ihl s SER 51 N -0.96 2.82 0.80 1.36 0.01 -1.26 -2.70 113.70 113.77 3ihl s SER 51 Ca 0.14 -0.80 -0.11 0.00 1.31 0.00 0.00 55.95 56.49 3ihl s SER 51 Cb -0.11 -0.52 0.07 0.00 0.21 0.00 0.00 66.02 65.67 3ihl s SER 51 CO 0.03 -0.32 1.09 -2.84 0.41 0.00 0.00 173.24 171.61 3ihl s PRO 52 N 1.92 2.08 0.06 12.44 0.02 -1.26 -4.98 135.00 145.28 3ihl s PRO 52 Ca 0.00 1.00 -0.22 0.00 0.02 0.00 0.00 61.00 61.81 3ihl s PRO 52 Cb -0.17 -1.89 -0.10 0.00 0.02 0.00 0.00 34.50 32.37 3ihl s PRO 52 CO -0.09 -1.72 1.34 -0.92 -0.33 0.00 0.00 177.00 175.28 3ihl h TYR 53 N -1.18 -0.91 -2.17 6.54 5.03 -2.00 -3.34 116.97 118.95 3ihl h TYR 53 Ca -0.45 0.02 -0.56 0.00 2.58 0.00 0.00 58.73 60.32 3ihl h TYR 53 Cb 1.24 0.38 -0.41 0.00 1.55 0.00 0.00 36.73 39.49 3ihl h TYR 53 CO 0.53 -0.39 -0.83 -0.85 -1.32 0.00 0.00 178.16 175.31 3ihl n GLU 54 N -4.28 2.26 -3.48 1.82 0.28 -1.26 -5.06 120.64 110.92 3ihl n GLU 54 Ca -0.06 -4.27 -0.10 0.00 -0.16 0.00 0.00 57.16 52.57 3ihl n GLU 54 Cb 0.27 -2.00 -0.02 0.00 1.43 0.00 0.00 31.44 31.11 3ihl n GLU 54 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 3ihl s HIS 55 N -2.81 -0.43 0.48 -1.84 2.46 -1.25 -5.16 115.29 106.74 3ihl s HIS 55 Ca 0.44 0.32 -0.21 0.00 0.47 0.00 0.00 55.06 56.08 3ihl s HIS 55 Cb 0.27 0.54 -0.11 0.00 -0.13 0.00 0.00 32.58 33.14 3ihl s HIS 55 CO -0.10 -0.65 0.55 0.41 -2.47 0.00 0.00 174.74 172.48 3ihl n GLY 56 N -0.20 -1.44 3.68 1.59 0.00 -1.26 -4.14 105.19 103.42 3ihl n GLY 56 Ca -0.12 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3ihl n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ihl s GLU 57 N -1.80 4.30 -0.09 1.61 2.02 -1.26 -4.50 118.70 118.98 3ihl s GLU 57 Ca 0.65 1.69 -0.14 0.00 0.02 0.00 0.00 54.97 57.20 3ihl s GLU 57 Cb -0.53 -3.64 -0.05 0.00 0.10 0.00 0.00 34.13 30.01 3ihl s GLU 57 CO 0.57 -0.55 0.33 0.08 0.02 0.00 0.00 175.26 175.71 3ihl s VAL 58 N 2.69 5.22 -0.34 2.63 1.01 -1.10 -4.98 120.40 125.54 3ihl s VAL 58 Ca 0.56 0.65 -0.08 0.00 0.00 0.00 0.00 61.98 63.12 3ihl s VAL 58 Cb -0.24 -3.65 0.03 0.00 0.00 0.00 0.00 36.38 32.52 3ihl s VAL 58 CO 0.20 0.48 0.12 0.12 0.00 0.00 0.00 175.10 176.03 3ihl s PHE 59 N -0.29 3.23 -0.18 5.22 5.36 -1.26 -1.44 117.98 128.63 3ihl s PHE 59 Ca 0.20 -1.23 -0.15 0.00 -0.96 0.00 0.00 56.93 54.79 3ihl s PHE 59 Cb -0.14 -2.31 -0.04 0.00 -0.34 0.00 0.00 43.02 40.18 3ihl s PHE 59 CO 0.08 -0.68 0.36 0.08 -1.46 0.00 0.00 175.22 173.60 3ihl s VAL 60 N 1.46 5.25 0.43 3.12 1.01 -0.64 -4.97 120.40 126.06 3ihl s VAL 60 Ca -0.00 0.65 0.05 0.00 0.00 0.00 0.00 61.98 62.68 3ihl s VAL 60 Cb -0.19 -3.69 0.05 0.00 0.00 0.00 0.00 36.38 32.55 3ihl s VAL 60 CO 0.04 0.32 0.39 0.18 0.00 0.00 0.00 175.10 176.03 3ihl n LEU 61 N 4.02 0.00 -3.62 3.92 4.77 -1.26 -2.64 117.00 122.18 3ihl n LEU 61 Ca -0.10 -2.16 -0.17 0.00 -0.03 0.00 0.00 56.01 53.55 3ihl n LEU 61 Cb 0.51 -0.10 -0.15 0.00 -2.33 0.00 0.00 43.42 41.36 3ihl n LEU 61 CO 0.40 -0.55 -0.22 0.21 -1.33 0.00 0.00 177.39 175.90 3ihl s ASN 62 N -3.58 0.90 0.33 -1.43 2.47 -1.24 -4.97 114.94 107.43 3ihl s ASN 62 Ca 0.30 0.21 -0.29 0.00 0.42 0.00 0.00 52.86 53.49 3ihl s ASN 62 Cb -0.02 0.35 -0.11 0.00 -1.45 0.00 0.00 41.25 40.02 3ihl s ASN 62 CO 0.19 -0.27 1.47 -1.81 -3.72 0.00 0.00 177.10 172.96 3ihl s ASP 63 N 2.32 6.47 0.00 -4.21 1.11 -1.26 -4.67 116.67 116.42 3ihl s ASP 63 Ca 0.04 2.91 0.00 0.00 0.18 0.00 0.00 52.55 55.68 3ihl s ASP 63 Cb -0.13 -2.65 0.00 0.00 1.07 0.00 0.00 42.92 41.21 3ihl s ASP 63 CO -0.08 -0.80 0.00 0.61 1.18 0.00 0.00 175.17 176.08 3ihl n GLY 64 N 1.14 0.96 2.55 0.21 0.00 -1.26 -4.97 105.19 103.83 3ihl n GLY 64 Ca 0.03 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 3ihl n GLY 64 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ihl n GLY 65 N 2.77 1.28 0.00 -0.02 0.00 -1.26 -5.04 105.19 102.91 3ihl n GLY 65 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.52 3ihl n GLY 65 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 3ihl n GLU 66 N 1.02 0.00 0.00 1.61 2.13 -1.26 -5.18 120.64 118.96 3ihl n GLU 66 Ca 0.13 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.95 3ihl n GLU 66 Cb 0.64 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.35 3ihl n GLU 66 CO 0.00 0.00 0.00 0.28 -0.41 0.00 0.00 177.13 177.00 3ihl n VAL 111 N 0.00 0.00 -4.33 6.31 0.31 -1.26 -5.09 118.33 114.28 3ihl n VAL 111 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.03 3ihl n VAL 111 Cb 0.00 0.00 -0.10 0.00 -0.91 0.00 0.00 33.84 32.83 3ihl n VAL 111 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 3ihl s GLN 112 N 0.00 2.22 -0.23 5.55 0.74 -1.26 -5.11 119.66 121.57 3ihl s GLN 112 Ca 0.00 -0.95 0.00 0.00 0.05 0.00 0.00 55.36 54.46 3ihl s GLN 112 Cb 0.00 -2.34 0.06 0.00 1.10 0.00 0.00 33.01 31.83 3ihl s GLN 112 CO 0.00 0.53 -0.04 0.08 -0.55 0.00 0.00 175.29 175.31 3ihl s VAL 113 N -1.14 1.37 0.20 1.34 1.01 -1.26 -5.13 120.40 116.79 3ihl s VAL 113 Ca 0.20 -1.10 0.06 0.00 0.00 0.00 0.00 61.98 61.14 3ihl s VAL 113 Cb -0.11 -1.66 -0.04 0.00 0.00 0.00 0.00 36.38 34.57 3ihl s VAL 113 CO 0.12 -0.10 0.11 -0.69 0.00 0.00 0.00 175.10 174.53 3ihl s VAL 114 N 1.47 4.24 -0.02 2.92 1.01 -1.26 -5.06 120.40 123.70 3ihl s VAL 114 Ca -0.05 -1.29 -0.23 0.00 0.00 0.00 0.00 61.98 60.41 3ihl s VAL 114 Cb -0.18 -3.20 -0.17 0.00 0.00 0.00 0.00 36.38 32.83 3ihl s VAL 114 CO -0.06 -0.19 1.07 1.55 0.00 0.00 0.00 175.10 177.47 3ihl h PRO 115 N 2.20 -0.25 -4.79 2.72 0.13 -2.05 -3.43 132.00 126.53 3ihl h PRO 115 Ca -0.47 0.02 -0.68 0.00 -0.87 0.00 0.00 66.00 63.99 3ihl h PRO 115 Cb 1.21 0.06 -0.32 0.00 0.13 0.00 0.00 31.00 32.08 3ihl h PRO 115 CO 0.61 0.14 -0.70 -1.01 -0.23 0.00 0.00 178.00 176.82 3ihl s HIS 116 N -4.04 3.21 0.31 1.56 3.76 -1.26 -4.99 115.29 113.85 3ihl s HIS 116 Ca -0.14 -1.69 0.00 0.00 -0.15 0.00 0.00 55.06 53.09 3ihl s HIS 116 Cb 0.01 -2.12 0.52 0.00 1.11 0.00 0.00 32.58 32.10 3ihl s HIS 116 CO 0.53 -0.76 1.94 0.97 -0.85 0.00 0.00 174.74 176.57 3ihl h ILE 117 N 6.32 1.12 -0.62 0.60 6.09 -1.99 -1.78 117.51 127.26 3ihl h ILE 117 Ca -0.25 -0.35 -0.00 0.00 -1.37 0.00 0.00 64.86 62.89 3ihl h ILE 117 Cb 1.08 0.01 -0.03 0.00 0.47 0.00 0.00 36.82 38.34 3ihl h ILE 117 CO 0.55 0.19 0.38 0.74 -3.07 0.00 0.00 178.15 176.94 3ihl h THR 118 N 1.03 1.18 -0.23 2.19 2.02 -1.94 0.13 112.91 117.29 3ihl h THR 118 Ca 0.34 -0.37 -0.16 0.00 0.77 0.00 0.00 66.41 66.99 3ihl h THR 118 Cb 0.06 0.31 -0.01 0.00 -1.74 0.00 0.00 68.15 66.78 3ihl h THR 118 CO -0.10 0.18 -0.51 0.44 0.37 0.00 0.00 175.52 175.89 3ihl h ASP 119 N 0.83 0.72 -0.48 4.18 3.32 -1.91 -3.12 116.42 119.96 3ihl h ASP 119 Ca 0.22 -0.37 -0.09 0.00 0.02 0.00 0.00 57.03 56.81 3ihl h ASP 119 Cb -0.04 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 3ihl h ASP 119 CO -0.04 1.10 -0.05 0.00 -1.72 0.00 0.00 179.24 178.53 3ihl h ALA 120 N 0.92 0.92 0.06 3.45 0.00 -0.92 -1.31 119.26 122.39 3ihl h ALA 120 Ca 0.02 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.61 3ihl h ALA 120 Cb 1.07 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.66 3ihl h ALA 120 CO 0.10 0.63 -0.03 0.28 0.00 0.00 0.00 179.25 180.24 3ihl h VAL 121 N 0.85 0.95 -0.01 0.00 2.07 -0.78 -1.60 116.25 117.73 3ihl h VAL 121 Ca 0.15 -0.03 -0.12 0.00 0.82 0.00 0.00 66.70 67.52 3ihl h VAL 121 Cb 0.57 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3ihl h VAL 121 CO 0.03 0.01 -0.55 1.56 0.02 0.00 0.00 177.57 178.64 3ihl h GLN 122 N -0.10 0.04 -0.11 1.57 4.20 -1.47 -0.49 115.11 118.75 3ihl h GLN 122 Ca -0.01 -0.02 -0.09 0.00 0.06 0.00 0.00 58.65 58.59 3ihl h GLN 122 Cb 0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.86 3ihl h GLN 122 CO 0.01 0.57 -0.27 1.49 -0.67 0.00 0.00 178.83 179.97 3ihl h GLU 123 N 0.03 0.38 -0.15 1.46 4.81 -1.23 -2.81 114.58 117.07 3ihl h GLU 123 Ca -0.00 -0.26 -0.11 0.00 -0.13 0.00 0.00 59.36 58.86 3ihl h GLU 123 Cb 0.97 0.04 -0.01 0.00 0.63 0.00 0.00 28.75 30.38 3ihl h GLU 123 CO 0.07 0.87 -0.39 2.35 -0.73 0.00 0.00 179.01 181.19 3ihl h TRP 124 N -0.05 0.37 -0.12 0.92 7.01 -1.09 -2.10 115.95 120.88 3ihl h TRP 124 Ca -0.00 -0.10 -0.04 0.00 2.11 0.00 0.00 58.89 60.86 3ihl h TRP 124 Cb 0.87 -0.08 -0.00 0.00 -2.10 0.00 0.00 29.16 27.85 3ihl h TRP 124 CO 0.11 0.66 -0.07 0.28 -2.79 0.00 0.00 178.44 176.63 3ihl h VAL 125 N 0.27 1.33 -0.84 2.65 2.07 -1.18 -2.25 116.25 118.30 3ihl h VAL 125 Ca 0.03 -1.13 -0.01 0.00 0.82 0.00 0.00 66.70 66.41 3ihl h VAL 125 Cb 0.80 1.81 -0.04 0.00 -1.52 0.00 0.00 31.29 32.34 3ihl h VAL 125 CO 0.06 0.33 0.49 -0.03 0.02 0.00 0.00 177.57 178.44 3ihl h MET 126 N -0.09 1.14 -0.05 1.57 1.85 -1.38 -2.28 114.93 115.68 3ihl h MET 126 Ca 0.03 -0.11 -0.09 0.00 -0.61 0.00 0.00 59.70 58.92 3ihl h MET 126 Cb 0.55 -0.24 0.00 0.00 0.43 0.00 0.00 31.60 32.35 3ihl h MET 126 CO 0.02 0.81 -0.31 -0.91 -0.40 0.00 0.00 176.91 176.13 3ihl h ASN 127 N 1.15 0.36 -0.60 1.39 2.35 -1.44 -3.30 115.58 115.49 3ihl h ASN 127 Ca 0.30 -0.67 -0.04 0.00 -0.55 0.00 0.00 56.30 55.35 3ihl h ASN 127 Cb -0.03 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.21 3ihl h ASN 127 CO -0.05 0.97 0.25 1.56 -1.65 0.00 0.00 177.43 178.50 3ihl h GLN 128 N -0.22 0.93 -0.70 0.81 1.08 -1.39 -2.49 115.11 113.12 3ihl h GLN 128 Ca -0.02 -0.15 0.15 0.00 -1.45 0.00 0.00 58.65 57.17 3ihl h GLN 128 Cb 0.97 -0.16 -0.04 0.00 -0.05 0.00 0.00 27.48 28.20 3ihl h GLN 128 CO 0.06 0.76 0.47 0.00 -0.95 0.00 0.00 178.83 179.18 3ihl h ALA 129 N 1.36 2.18 -0.03 3.87 0.00 -1.49 -1.28 119.26 123.87 3ihl h ALA 129 Ca 0.21 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 3ihl h ALA 129 Cb 0.18 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3ihl h ALA 129 CO -0.02 -0.37 -0.56 0.87 0.00 0.00 0.00 179.25 179.17 3ihl h LYS 130 N 0.34 0.10 -6.13 0.00 1.57 -1.52 -3.37 116.57 107.56 3ihl h LYS 130 Ca 0.34 -0.06 -0.61 0.00 -1.87 0.00 0.00 60.65 58.45 3ihl h LYS 130 Cb 0.85 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.18 3ihl h LYS 130 CO -0.09 0.63 1.32 0.28 -0.57 0.00 0.00 179.45 181.02 3ihl n VAL 131 N -3.88 0.45 -1.65 0.50 0.31 -0.48 -4.23 118.33 109.34 3ihl n VAL 131 Ca -0.02 -0.26 -0.42 0.00 -0.01 0.00 0.00 64.34 63.63 3ihl n VAL 131 Cb 0.58 -2.13 0.01 0.00 -0.91 0.00 0.00 33.84 31.39 3ihl n VAL 131 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3ihl n PRO 132 N 7.83 1.66 -4.35 5.55 -0.02 -1.26 -4.73 135.00 139.67 3ihl n PRO 132 Ca 0.29 0.59 -0.18 0.00 -2.02 0.00 0.00 63.50 62.18 3ihl n PRO 132 Cb 0.35 -2.19 -0.10 0.00 -0.02 0.00 0.00 33.50 31.54 3ihl n PRO 132 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3ihl s VAL 133 N -1.21 0.97 0.00 -1.45 -7.23 -1.26 -4.94 120.40 105.28 3ihl s VAL 133 Ca 0.61 -2.02 0.00 0.00 -1.81 0.00 0.00 61.98 58.76 3ihl s VAL 133 Cb -0.55 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 33.90 3ihl s VAL 133 CO 0.58 -0.20 0.00 0.47 -0.31 0.00 0.00 175.10 175.64 3ihl n ASP 134 N -0.48 0.00 0.00 4.85 8.00 -1.26 -4.25 116.55 123.41 3ihl n ASP 134 Ca -0.03 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.47 3ihl n ASP 134 Cb 0.65 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.75 3ihl n ASP 134 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3ihl n GLY 135 N 0.00 0.78 4.62 0.44 0.00 -1.26 -4.86 105.19 104.90 3ihl n GLY 135 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ihl n GLY 135 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ihl n ASN 136 N 0.00 0.00 0.00 1.61 4.13 -1.26 -4.64 115.26 115.10 3ihl n ASN 136 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 3ihl n ASN 136 Cb 0.00 -0.25 0.00 0.00 -1.54 0.00 0.00 39.78 37.99 3ihl n ASN 136 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 3ihl n LYS 137 N -1.14 0.00 -4.27 3.52 3.00 -1.26 -4.75 118.16 113.26 3ihl n LYS 137 Ca 0.00 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.06 3ihl n LYS 137 Cb 0.00 -2.89 -0.08 0.00 0.00 0.00 0.00 35.03 32.06 3ihl n LYS 137 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 3ihl s GLU 138 N 0.00 2.15 0.16 1.64 2.02 -1.26 -4.89 118.70 118.52 3ihl s GLU 138 Ca 0.00 -1.78 -0.32 0.00 0.02 0.00 0.00 54.97 52.90 3ihl s GLU 138 Cb 0.00 -1.95 -0.10 0.00 0.10 0.00 0.00 34.13 32.18 3ihl s GLU 138 CO 0.00 0.05 1.63 -2.00 0.02 0.00 0.00 175.26 174.96 3ihl s GLU 139 N -3.78 4.19 0.84 1.61 2.12 -1.26 -4.40 118.70 118.02 3ihl s GLU 139 Ca 0.37 2.43 -0.13 0.00 0.36 0.00 0.00 54.97 58.00 3ihl s GLU 139 Cb 0.01 -3.21 0.08 0.00 0.26 0.00 0.00 34.13 31.27 3ihl s GLU 139 CO 0.21 -0.67 1.00 -2.30 -0.54 0.00 0.00 175.26 172.95 3ihl n PRO 140 N 4.25 0.00 -0.09 4.30 -0.02 -1.26 -4.97 135.00 137.22 3ihl n PRO 140 Ca 0.15 0.07 -0.15 0.00 -2.02 0.00 0.00 63.50 61.55 3ihl n PRO 140 Cb 0.38 -2.27 -0.14 0.00 -0.02 0.00 0.00 33.50 31.45 3ihl n PRO 140 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3ihl n GLN 141 N -2.95 0.68 -4.64 -0.52 6.02 0.60 -4.81 117.38 111.75 3ihl n GLN 141 Ca 0.12 0.14 -0.23 0.00 -0.01 0.00 0.00 57.00 57.01 3ihl n GLN 141 Cb 0.51 -1.58 -0.15 0.00 1.02 0.00 0.00 30.24 30.03 3ihl n GLN 141 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3ihl s ILE 142 N -2.53 1.13 -0.22 5.09 1.01 -0.87 -1.71 121.20 123.11 3ihl s ILE 142 Ca -0.22 -0.58 -0.00 0.00 0.00 0.00 0.00 60.65 59.85 3ihl s ILE 142 Cb 0.08 -0.97 0.02 0.00 0.01 0.00 0.00 42.46 41.60 3ihl s ILE 142 CO 0.73 0.33 -0.12 0.00 0.00 0.00 0.00 174.94 175.88 3ihl s VAL 144 N 1.31 4.90 -0.13 0.00 1.01 0.18 -1.14 120.40 126.54 3ihl s VAL 144 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 61.98 61.83 3ihl s VAL 144 Cb -0.15 -4.15 -0.04 0.00 0.00 0.00 0.00 36.38 32.03 3ihl s VAL 144 CO -0.08 -0.54 0.44 -0.63 0.00 0.00 0.00 175.10 174.29 3ihl s ILE 145 N 2.63 5.21 -0.25 2.22 1.01 0.16 -1.61 121.20 130.57 3ihl s ILE 145 Ca 0.20 0.87 -0.04 0.00 0.00 0.00 0.00 60.65 61.67 3ihl s ILE 145 Cb -0.15 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.54 3ihl s ILE 145 CO 0.17 0.34 -0.01 -0.70 0.00 0.00 0.00 174.94 174.74 3ihl s GLU 146 N 0.60 3.20 -0.38 2.79 2.12 0.96 -0.02 118.70 127.97 3ihl s GLU 146 Ca 0.24 -0.75 -0.11 0.00 0.36 0.00 0.00 54.97 54.70 3ihl s GLU 146 Cb -0.15 -3.10 0.03 0.00 0.26 0.00 0.00 34.13 31.18 3ihl s GLU 146 CO 0.09 -0.30 0.22 -1.17 -0.54 0.00 0.00 175.26 173.56 3ihl s LEU 147 N 1.45 4.81 1.25 2.70 2.96 -0.36 -0.40 118.68 131.09 3ihl s LEU 147 Ca 0.04 -1.04 -0.20 0.00 -0.22 0.00 0.00 54.13 52.71 3ihl s LEU 147 Cb -0.15 -2.04 0.30 0.00 0.50 0.00 0.00 46.19 44.80 3ihl s LEU 147 CO -0.02 -0.41 1.07 -0.83 -1.32 0.00 0.00 176.35 174.83 3ihl s GLY 148 N 1.62 1.54 0.06 7.98 0.00 0.21 -4.49 107.32 114.24 3ihl s GLY 148 Ca 0.02 -0.87 0.00 0.00 0.00 0.00 0.00 44.72 43.87 3ihl s GLY 148 CO 0.07 0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.80 3ihl n GLY 149 N -0.37 -1.76 3.24 0.20 0.00 -1.26 -4.57 105.19 100.67 3ihl n GLY 149 Ca 0.12 -1.27 -0.27 0.00 0.00 0.00 0.00 46.02 44.60 3ihl n GLY 149 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ihl s THR 150 N -0.62 1.69 0.22 2.61 2.01 -1.26 -4.41 115.64 115.88 3ihl s THR 150 Ca 0.00 -1.00 -0.32 0.00 0.31 0.00 0.00 61.69 60.68 3ihl s THR 150 Cb 0.00 -1.42 -0.13 0.00 0.01 0.00 0.00 72.50 70.96 3ihl s THR 150 CO 0.00 0.40 1.47 -0.38 -0.69 0.00 0.00 174.62 175.42 3ihl n ILE 151 N 2.34 0.64 0.00 1.82 2.08 -0.22 -0.96 119.36 125.07 3ihl n ILE 151 Ca -0.16 -0.16 0.00 0.00 0.56 0.00 0.00 62.75 62.99 3ihl n ILE 151 Cb 0.53 -1.52 0.00 0.00 -0.75 0.00 0.00 39.64 37.90 3ihl n ILE 151 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3ihl n GLY 152 N 2.57 2.88 3.69 7.39 0.00 -1.26 -4.66 105.19 115.79 3ihl n GLY 152 Ca 0.13 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.71 3ihl n GLY 152 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ihl n ASP 153 N 0.00 3.21 -0.33 1.61 8.00 -0.13 -4.89 116.55 124.02 3ihl n ASP 153 Ca 0.00 1.12 0.05 0.00 0.71 0.00 0.00 54.79 56.67 3ihl n ASP 153 Cb 0.00 -1.48 0.21 0.00 -0.02 0.00 0.00 41.12 39.83 3ihl n ASP 153 CO 0.00 0.00 0.00 0.40 -0.39 0.00 0.00 177.20 177.21 3ihl h ILE 154 N 3.36 0.92 0.00 0.53 5.03 -1.98 -2.36 117.51 123.01 3ihl h ILE 154 Ca -0.45 -0.31 -0.04 0.00 -0.12 0.00 0.00 64.86 63.94 3ihl h ILE 154 Cb 1.25 -0.08 -0.01 0.00 -3.03 0.00 0.00 36.82 34.96 3ihl h ILE 154 CO 0.82 0.17 -0.17 -0.33 -0.68 0.00 0.00 178.15 177.96 3ihl h GLU 155 N 0.92 0.00 0.00 2.37 3.07 -1.91 -2.95 114.58 116.08 3ihl h GLU 155 Ca 0.46 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.32 3ihl h GLU 155 Cb 0.43 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 3ihl h GLU 155 CO -0.26 0.17 0.00 0.78 -1.40 0.00 0.00 179.01 178.30 3ihl h GLY 156 N 2.05 0.00 0.98 -3.84 0.00 -1.75 -3.39 103.07 97.12 3ihl h GLY 156 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3ihl h GLY 156 CO 0.02 0.00 0.17 -0.33 0.00 0.00 0.00 176.54 176.40 3ihl h MET 157 N 0.00 0.34 -0.42 4.80 2.86 -1.56 -1.23 114.93 119.72 3ihl h MET 157 Ca 0.00 -0.02 -0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3ihl h MET 157 Cb 0.65 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.21 3ihl h MET 157 CO 0.00 0.23 0.24 -1.35 1.06 0.00 0.00 176.91 177.09 3ihl h PRO 158 N 0.35 0.57 -0.02 -0.22 0.11 -1.82 -0.32 132.00 130.65 3ihl h PRO 158 Ca 0.10 -0.05 -0.26 0.00 0.11 0.00 0.00 66.00 65.90 3ihl h PRO 158 Cb -0.03 -0.12 0.02 0.00 0.11 0.00 0.00 31.00 30.98 3ihl h PRO 158 CO -0.03 0.41 -1.01 0.74 -0.21 0.00 0.00 178.00 177.91 3ihl h PHE 159 N 0.58 1.02 -0.50 0.65 -1.00 -1.68 -0.88 116.94 115.14 3ihl h PHE 159 Ca 0.15 -0.54 -0.04 0.00 2.81 0.00 0.00 57.97 60.35 3ihl h PHE 159 Cb -0.00 -0.12 -0.02 0.00 3.61 0.00 0.00 35.95 39.41 3ihl h PHE 159 CO 0.00 1.38 0.16 0.28 -1.61 0.00 0.00 178.31 178.52 3ihl h VAL 160 N 0.40 1.20 -0.74 -0.55 2.07 -1.02 -1.46 116.25 116.14 3ihl h VAL 160 Ca -0.12 -0.67 -0.03 0.00 0.82 0.00 0.00 66.70 66.70 3ihl h VAL 160 Cb 1.66 0.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.04 3ihl h VAL 160 CO 0.20 0.25 0.36 -0.08 0.02 0.00 0.00 177.57 178.32 3ihl h GLU 161 N 0.72 1.07 -0.63 1.57 4.57 -0.94 -0.71 114.58 120.22 3ihl h GLU 161 Ca 0.17 -0.16 0.10 0.00 -1.18 0.00 0.00 59.36 58.29 3ihl h GLU 161 Cb 0.21 -0.19 -0.07 0.00 -0.16 0.00 0.00 28.75 28.53 3ihl h GLU 161 CO -0.01 0.83 0.26 0.00 -1.18 0.00 0.00 179.01 178.91 3ihl h ALA 162 N 1.18 0.83 0.00 2.92 0.00 -0.12 -2.08 119.26 121.99 3ihl h ALA 162 Ca 0.26 0.08 -0.13 0.00 0.00 0.00 0.00 54.91 55.12 3ihl h ALA 162 Cb 0.12 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3ihl h ALA 162 CO -0.03 -0.16 -0.63 0.74 0.00 0.00 0.00 179.25 179.16 3ihl h PHE 163 N 0.45 0.00 -0.02 0.00 0.04 -1.01 -0.73 116.94 115.67 3ihl h PHE 163 Ca 0.32 0.00 0.01 0.00 2.80 0.00 0.00 57.97 61.10 3ihl h PHE 163 Cb 0.38 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 3ihl h PHE 163 CO -0.16 0.60 -0.06 -0.09 -0.60 0.00 0.00 178.31 178.01 3ihl h ARG 164 N 0.00 -0.10 -0.68 1.51 2.43 -0.70 -1.20 114.38 115.64 3ihl h ARG 164 Ca -0.01 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.12 3ihl h ARG 164 Cb 1.47 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 31.01 3ihl h ARG 164 CO 0.08 -0.06 0.25 1.96 -1.51 0.00 0.00 179.97 180.69 3ihl h GLN 165 N -0.10 1.04 -0.50 0.20 4.20 -1.28 -3.21 115.11 115.46 3ihl h GLN 165 Ca 0.03 -0.20 -0.06 0.00 0.06 0.00 0.00 58.65 58.48 3ihl h GLN 165 Cb 0.14 -0.16 -0.02 0.00 0.30 0.00 0.00 27.48 27.74 3ihl h GLN 165 CO -0.08 0.88 0.07 0.35 -0.67 0.00 0.00 178.83 179.38 3ihl h PHE 166 N 0.98 0.82 -0.08 2.96 3.04 -0.78 -2.89 116.94 120.99 3ihl h PHE 166 Ca 0.23 -0.09 0.02 0.00 3.98 0.00 0.00 57.97 62.11 3ihl h PHE 166 Cb 0.24 -0.24 -0.00 0.00 2.56 0.00 0.00 35.95 38.51 3ihl h PHE 166 CO 0.02 0.72 0.07 -0.56 -2.02 0.00 0.00 178.31 176.54 3ihl h GLN 167 N 0.75 0.00 0.00 1.11 3.07 -1.23 0.15 115.11 118.97 3ihl h GLN 167 Ca 0.16 0.00 -0.14 0.00 0.09 0.00 0.00 58.65 58.76 3ihl h GLN 167 Cb 0.35 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.89 3ihl h GLN 167 CO 0.01 0.00 -0.94 0.74 0.09 0.00 0.00 178.83 178.73 3ihl h PHE 168 N 0.00 0.00 -0.00 0.06 0.04 -1.66 -2.52 116.94 112.85 3ihl h PHE 168 Ca 0.04 0.00 -0.08 0.00 2.80 0.00 0.00 57.97 60.73 3ihl h PHE 168 Cb 0.18 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.33 3ihl h PHE 168 CO 0.00 0.55 -0.31 0.87 -0.60 0.00 0.00 178.31 178.82 3ihl h LYS 169 N 0.00 0.21 0.00 1.51 1.57 -1.07 -3.26 116.57 115.53 3ihl h LYS 169 Ca -0.07 -0.22 -0.02 0.00 -1.87 0.00 0.00 60.65 58.46 3ihl h LYS 169 Cb 1.48 0.06 -0.00 0.00 0.08 0.00 0.00 32.23 33.85 3ihl h LYS 169 CO 0.06 0.95 -0.09 0.00 -0.57 0.00 0.00 179.45 179.79 3ihl h ALA 170 N 0.27 1.34 -1.93 3.86 0.00 -0.89 -3.49 119.26 118.42 3ihl h ALA 170 Ca -0.04 -0.09 0.14 0.00 0.00 0.00 0.00 54.91 54.93 3ihl h ALA 170 Cb 1.05 -0.01 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 3ihl h ALA 170 CO 0.06 0.12 -0.65 1.63 0.00 0.00 0.00 179.25 180.41 3ihl n LYS 171 N -3.69 -1.91 0.02 0.00 5.02 -0.95 -4.35 118.16 112.30 3ihl n LYS 171 Ca -0.02 1.55 -0.09 0.00 -2.02 0.00 0.00 58.31 57.72 3ihl n LYS 171 Cb 0.20 -2.12 0.05 0.00 -0.02 0.00 0.00 35.03 33.14 3ihl n LYS 171 CO 0.00 0.00 0.00 -0.09 -0.52 0.00 0.00 177.40 176.79 3ihl h ARG 172 N -0.55 0.49 0.00 1.97 2.43 -1.86 -2.69 114.38 114.18 3ihl h ARG 172 Ca -0.08 -0.34 0.00 0.00 -0.81 0.00 0.00 59.98 58.75 3ihl h ARG 172 Cb 0.69 0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.29 3ihl h ARG 172 CO 0.03 0.95 0.00 -0.85 -1.51 0.00 0.00 179.97 178.60 3ihl n GLU 173 N -3.92 0.02 -0.01 0.20 0.00 -1.26 -2.64 120.64 113.03 3ihl n GLU 173 Ca -0.04 0.31 0.01 0.00 0.00 0.00 0.00 57.16 57.44 3ihl n GLU 173 Cb 0.64 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.59 3ihl n GLU 173 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3ihl n ASN 174 N -1.46 1.84 -3.70 -1.84 3.02 -1.02 -4.52 115.26 107.57 3ihl n ASN 174 Ca 0.03 -2.03 -0.11 0.00 -0.03 0.00 0.00 54.58 52.44 3ihl n ASN 174 Cb 0.11 -0.05 -0.11 0.00 -0.61 0.00 0.00 39.78 39.12 3ihl n ASN 174 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 3ihl s PHE 175 N -1.10 -0.54 0.17 3.10 5.36 -1.08 -0.22 117.98 123.67 3ihl s PHE 175 Ca 0.03 1.17 -0.09 0.00 -0.96 0.00 0.00 56.93 57.08 3ihl s PHE 175 Cb 0.03 0.21 -0.01 0.00 -0.34 0.00 0.00 43.02 42.91 3ihl s PHE 175 CO 0.00 -0.32 0.28 0.00 -1.46 0.00 0.00 175.22 173.73 3ihl s ASN 177 N -2.98 0.41 -0.07 0.00 2.20 -1.26 -1.82 114.94 111.41 3ihl s ASN 177 Ca 0.19 -0.79 -0.00 0.00 -0.94 0.00 0.00 52.86 51.32 3ihl s ASN 177 Cb 0.03 0.15 0.02 0.00 -2.00 0.00 0.00 41.25 39.46 3ihl s ASN 177 CO 0.01 -0.47 -0.03 -0.63 -2.94 0.00 0.00 177.10 173.04 3ihl s ILE 178 N -2.87 0.58 -0.22 0.54 1.01 0.30 -0.96 121.20 119.58 3ihl s ILE 178 Ca -0.03 -0.07 -0.04 0.00 0.00 0.00 0.00 60.65 60.52 3ihl s ILE 178 Cb 0.00 -0.65 -0.01 0.00 0.01 0.00 0.00 42.46 41.81 3ihl s ILE 178 CO -0.06 0.27 -0.03 -2.28 0.00 0.00 0.00 174.94 172.84 3ihl s HIS 179 N 1.48 2.97 -0.45 3.97 2.46 -0.43 -1.41 115.29 123.88 3ihl s HIS 179 Ca -0.02 -0.89 -0.14 0.00 0.47 0.00 0.00 55.06 54.48 3ihl s HIS 179 Cb -0.13 -2.12 0.06 0.00 -0.13 0.00 0.00 32.58 30.27 3ihl s HIS 179 CO -0.03 -0.53 0.35 0.08 -2.47 0.00 0.00 174.74 172.14 3ihl s VAL 180 N 1.49 5.05 0.25 0.89 1.01 0.13 -0.35 120.40 128.87 3ihl s VAL 180 Ca 0.06 -1.05 0.11 0.00 0.00 0.00 0.00 61.98 61.10 3ihl s VAL 180 Cb -0.14 -3.99 -0.05 0.00 0.00 0.00 0.00 36.38 32.20 3ihl s VAL 180 CO -0.03 -0.51 -0.20 -0.55 0.00 0.00 0.00 175.10 173.81 3ihl s SER 181 N 2.35 3.43 0.08 3.32 0.15 -0.37 -0.17 113.70 122.49 3ihl s SER 181 Ca 0.04 -0.99 -0.20 0.00 0.70 0.00 0.00 55.95 55.50 3ihl s SER 181 Cb -0.23 -0.27 -0.07 0.00 -1.71 0.00 0.00 66.02 63.74 3ihl s SER 181 CO 0.06 0.03 0.60 -0.22 1.20 0.00 0.00 173.24 174.92 3ihl s LEU 182 N -3.28 4.54 -0.42 3.45 2.96 -1.24 -1.30 118.68 123.38 3ihl s LEU 182 Ca 0.27 1.32 -0.01 0.00 -0.22 0.00 0.00 54.13 55.49 3ihl s LEU 182 Cb -0.05 -2.96 0.11 0.00 0.50 0.00 0.00 46.19 43.80 3ihl s LEU 182 CO 0.13 0.26 0.19 -0.69 -1.32 0.00 0.00 176.35 174.92 3ihl s VAL 183 N -1.09 3.06 0.86 1.68 1.01 -0.50 -4.00 120.40 121.42 3ihl s VAL 183 Ca 0.30 -2.27 -0.12 0.00 0.00 0.00 0.00 61.98 59.89 3ihl s VAL 183 Cb -0.20 -3.12 0.11 0.00 0.00 0.00 0.00 36.38 33.17 3ihl s VAL 183 CO 0.20 -0.69 1.13 -2.16 0.00 0.00 0.00 175.10 173.57 3ihl s PRO 184 N 0.91 1.54 -0.30 2.72 0.04 -1.26 -4.61 135.00 134.04 3ihl s PRO 184 Ca 0.10 0.39 -0.06 0.00 0.04 0.00 0.00 61.00 61.47 3ihl s PRO 184 Cb -0.22 -1.88 0.17 0.00 0.04 0.00 0.00 34.50 32.62 3ihl s PRO 184 CO -0.05 -1.95 0.69 -1.14 0.04 0.00 0.00 177.00 174.60 3ihl s GLN 185 N -5.26 0.51 0.18 4.56 0.74 -1.26 -2.05 119.66 117.07 3ihl s GLN 185 Ca 0.63 1.04 -0.30 0.00 0.05 0.00 0.00 55.36 56.78 3ihl s GLN 185 Cb -0.14 0.60 -0.08 0.00 1.10 0.00 0.00 33.01 34.49 3ihl s GLN 185 CO 0.53 -0.41 1.11 -0.51 -0.55 0.00 0.00 175.29 175.45 3ihl s LEU 186 N 2.85 4.49 0.44 3.68 1.43 -1.26 -4.95 118.68 125.35 3ihl s LEU 186 Ca 0.09 2.10 0.13 0.00 -1.03 0.00 0.00 54.13 55.42 3ihl s LEU 186 Cb -0.13 -3.60 1.02 0.00 0.03 0.00 0.00 46.19 43.50 3ihl s LEU 186 CO -0.19 -0.23 2.02 0.77 0.23 0.00 0.00 176.35 178.94 3ihl h SER 187 N 5.10 0.35 -0.14 2.29 4.64 -1.97 -1.15 113.55 122.67 3ihl h SER 187 Ca -0.44 0.00 0.04 0.00 -0.47 0.00 0.00 61.79 60.92 3ihl h SER 187 Cb 1.21 -0.07 -0.01 0.00 -0.31 0.00 0.00 62.40 63.22 3ihl h SER 187 CO 0.72 0.23 0.14 0.00 -0.87 0.00 0.00 176.83 177.05 3ihl h ALA 188 N 1.73 1.82 0.00 5.18 0.00 -2.02 -3.32 119.26 122.66 3ihl h ALA 188 Ca 0.22 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3ihl h ALA 188 Cb 0.35 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.15 3ihl h ALA 188 CO -0.06 -0.21 -0.76 0.25 0.00 0.00 0.00 179.25 178.48 3ihl n THR 189 N -3.97 0.00 -0.14 0.00 -2.24 -1.06 -5.03 114.28 101.84 3ihl n THR 189 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3ihl n THR 189 Cb 0.25 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 67.73 3ihl n THR 189 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ihl n GLY 190 N 2.40 2.55 3.63 3.38 0.00 -0.46 -5.00 105.19 111.70 3ihl n GLY 190 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3ihl n GLY 190 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3ihl s GLU 191 N -0.06 4.03 0.41 1.61 2.02 -1.26 -4.91 118.70 120.53 3ihl s GLU 191 Ca 0.00 0.99 -0.24 0.00 0.02 0.00 0.00 54.97 55.74 3ihl s GLU 191 Cb 0.00 -3.75 -0.09 0.00 0.10 0.00 0.00 34.13 30.39 3ihl s GLU 191 CO 0.00 -0.92 1.08 -0.65 0.02 0.00 0.00 175.26 174.79 3ihl s GLN 192 N 3.65 4.10 -0.01 1.61 -0.21 -1.26 -4.38 119.66 123.16 3ihl s GLN 192 Ca 0.44 1.60 0.07 0.00 0.02 0.00 0.00 55.36 57.49 3ihl s GLN 192 Cb -0.12 -2.55 -0.02 0.00 1.00 0.00 0.00 33.01 31.32 3ihl s GLN 192 CO 0.16 -0.22 -0.23 0.15 -2.12 0.00 0.00 175.29 173.03 3ihl s LYS 193 N -2.48 1.84 -0.01 2.91 -0.14 -0.87 -5.02 119.74 115.97 3ihl s LYS 193 Ca 0.58 -0.85 0.19 0.00 -1.36 0.00 0.00 55.97 54.53 3ihl s LYS 193 Cb -0.24 -1.80 -0.25 0.00 -1.68 0.00 0.00 37.83 33.85 3ihl s LYS 193 CO 0.30 0.49 0.64 0.25 -0.76 0.00 0.00 175.35 176.28 3ihl n THR 194 N 2.42 0.00 -0.00 2.17 -2.24 -1.26 -4.05 114.28 111.32 3ihl n THR 194 Ca -0.16 -0.23 -0.10 0.00 -2.27 0.00 0.00 64.05 61.30 3ihl n THR 194 Cb 0.52 0.58 -0.05 0.00 -2.10 0.00 0.00 70.33 69.29 3ihl n THR 194 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3ihl h LYS 195 N 0.00 0.01 -0.82 -0.78 1.63 -1.95 0.91 116.57 115.57 3ihl h LYS 195 Ca 0.00 -0.00 0.14 0.00 -0.85 0.00 0.00 60.65 59.94 3ihl h LYS 195 Cb 0.65 -0.00 -0.09 0.00 -0.60 0.00 0.00 32.23 32.18 3ihl h LYS 195 CO 0.00 0.01 0.41 -1.35 -3.45 0.00 0.00 179.45 175.06 3ihl h PRO 196 N 0.01 0.57 -0.21 1.90 0.11 -1.87 -0.04 132.00 132.47 3ihl h PRO 196 Ca 0.05 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 65.95 3ihl h PRO 196 Cb 0.08 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 31.06 3ihl h PRO 196 CO -0.11 0.38 -0.59 1.15 -0.21 0.00 0.00 178.00 178.62 3ihl h THR 197 N 0.59 1.30 -0.37 -1.15 2.02 -1.47 -1.00 112.91 112.83 3ihl h THR 197 Ca 0.44 -1.82 0.07 0.00 0.77 0.00 0.00 66.41 65.87 3ihl h THR 197 Cb 0.62 1.77 -0.06 0.00 -1.74 0.00 0.00 68.15 68.74 3ihl h THR 197 CO -0.36 0.58 -0.03 1.56 0.37 0.00 0.00 175.52 177.64 3ihl h GLN 198 N 0.52 0.06 -0.36 6.66 4.20 -0.06 -0.32 115.11 125.82 3ihl h GLN 198 Ca -0.00 -0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 3ihl h GLN 198 Cb 1.18 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 3ihl h GLN 198 CO 0.12 0.04 -0.24 -0.91 -0.67 0.00 0.00 178.83 177.17 3ihl h ASN 199 N 0.07 0.83 -0.20 1.46 2.35 -0.91 -2.25 115.58 116.93 3ihl h ASN 199 Ca 0.18 -0.43 0.03 0.00 -0.55 0.00 0.00 56.30 55.53 3ihl h ASN 199 Cb 0.26 -0.23 -0.03 0.00 0.05 0.00 0.00 38.32 38.38 3ihl h ASN 199 CO -0.33 1.09 0.02 -1.28 -1.65 0.00 0.00 177.43 175.27 3ihl h SER 200 N 0.58 -0.03 -0.92 5.81 0.87 -0.97 -0.52 113.55 118.39 3ihl h SER 200 Ca 0.07 0.04 0.03 0.00 -1.23 0.00 0.00 61.79 60.69 3ihl h SER 200 Cb 0.80 0.06 -0.05 0.00 -0.44 0.00 0.00 62.40 62.77 3ihl h SER 200 CO 0.07 0.01 0.60 0.58 -0.53 0.00 0.00 176.83 177.56 3ihl h VAL 201 N 0.09 1.19 -0.36 2.23 2.07 -0.94 -0.62 116.25 119.91 3ihl h VAL 201 Ca 0.09 -0.41 -0.03 0.00 0.82 0.00 0.00 66.70 67.18 3ihl h VAL 201 Cb 0.10 -0.10 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 3ihl h VAL 201 CO -0.13 0.22 0.12 0.03 0.02 0.00 0.00 177.57 177.83 3ihl h ARG 202 N 1.19 0.55 -0.48 1.57 3.08 -0.77 -0.20 114.38 119.32 3ihl h ARG 202 Ca 0.35 -0.11 0.09 0.00 0.07 0.00 0.00 59.98 60.38 3ihl h ARG 202 Cb -0.05 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 29.85 3ihl h ARG 202 CO -0.10 0.56 0.05 0.00 -1.07 0.00 0.00 179.97 179.42 3ihl h ALA 203 N 0.97 0.50 -0.30 0.04 0.00 -0.67 0.10 119.26 119.90 3ihl h ALA 203 Ca 0.12 0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.15 3ihl h ALA 203 Cb 0.23 0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 3ihl h ALA 203 CO -0.01 -0.35 0.19 1.25 0.00 0.00 0.00 179.25 180.33 3ihl h LEU 204 N 0.17 0.35 -1.43 0.00 5.85 -0.67 -1.23 115.31 118.35 3ihl h LEU 204 Ca 0.24 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.92 3ihl h LEU 204 Cb 0.35 -0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 3ihl h LEU 204 CO -0.36 0.29 0.25 0.03 -0.34 0.00 0.00 178.44 178.30 3ihl h ARG 205 N 0.39 0.63 -0.37 1.25 3.08 -0.74 -2.51 114.38 116.11 3ihl h ARG 205 Ca 0.11 -0.06 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 3ihl h ARG 205 Cb -0.01 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 29.89 3ihl h ARG 205 CO -0.02 0.47 0.04 0.78 -1.07 0.00 0.00 179.97 180.17 3ihl h GLY 206 N 0.72 0.61 -0.26 0.04 0.00 0.32 -1.28 103.07 103.22 3ihl h GLY 206 Ca 0.16 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.15 3ihl h GLY 206 CO -0.03 0.32 0.00 1.04 0.00 0.00 0.00 176.54 177.88 3ihl n LEU 207 N -4.30 1.06 0.00 3.11 4.77 -0.66 -4.93 117.00 116.05 3ihl n LEU 207 Ca 0.02 -0.43 0.00 0.00 -0.03 0.00 0.00 56.01 55.57 3ihl n LEU 207 Cb 0.22 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3ihl n LEU 207 CO 0.39 0.21 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 3ihl n GLY 208 N 1.02 0.58 3.51 -0.72 0.00 -0.48 -4.72 105.19 104.38 3ihl n GLY 208 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 3ihl n GLY 208 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3ihl s LEU 209 N 0.00 3.18 -0.22 0.99 1.43 -1.04 -4.88 118.68 118.15 3ihl s LEU 209 Ca 0.00 -0.11 -0.09 0.00 -1.03 0.00 0.00 54.13 52.90 3ihl s LEU 209 Cb 0.00 -1.74 -0.04 0.00 0.03 0.00 0.00 46.19 44.43 3ihl s LEU 209 CO 0.00 0.23 0.11 -0.55 0.23 0.00 0.00 176.35 176.37 3ihl s SER 210 N 0.01 5.83 0.00 2.29 0.15 -1.26 -2.76 113.70 117.97 3ihl s SER 210 Ca -0.00 0.07 -0.30 0.00 0.70 0.00 0.00 55.95 56.42 3ihl s SER 210 Cb -0.13 -2.03 -0.04 0.00 -1.71 0.00 0.00 66.02 62.10 3ihl s SER 210 CO 0.03 0.10 1.16 -2.16 1.20 0.00 0.00 173.24 173.57 3ihl s PRO 211 N 0.80 4.42 0.03 5.44 0.04 -1.26 -4.66 135.00 139.81 3ihl s PRO 211 Ca 0.06 1.67 0.03 0.00 0.04 0.00 0.00 61.00 62.80 3ihl s PRO 211 Cb -0.13 -3.45 -0.25 0.00 0.04 0.00 0.00 34.50 30.72 3ihl s PRO 211 CO 0.02 -0.29 0.95 -0.44 0.04 0.00 0.00 177.00 177.28 3ihl h ASP 212 N 7.05 0.19 -4.14 6.66 3.32 -1.44 -3.45 116.42 124.60 3ihl h ASP 212 Ca -0.38 -0.26 -0.40 0.00 0.02 0.00 0.00 57.03 56.01 3ihl h ASP 212 Cb 1.19 -0.06 -0.28 0.00 0.22 0.00 0.00 39.33 40.41 3ihl h ASP 212 CO 0.83 1.22 -0.78 -0.76 -1.72 0.00 0.00 179.24 178.02 3ihl s LEU 213 N -6.71 2.06 -0.27 1.55 1.43 -1.14 -4.79 118.68 110.82 3ihl s LEU 213 Ca -0.05 -0.24 -0.07 0.00 -1.03 0.00 0.00 54.13 52.74 3ihl s LEU 213 Cb 0.08 -0.48 -0.01 0.00 0.03 0.00 0.00 46.19 45.82 3ihl s LEU 213 CO 0.84 0.08 0.06 -0.63 0.23 0.00 0.00 176.35 176.92 3ihl s ILE 214 N -0.41 3.99 -0.41 -0.59 1.01 0.27 -1.31 121.20 123.75 3ihl s ILE 214 Ca 0.02 -0.48 -0.17 0.00 0.00 0.00 0.00 60.65 60.03 3ihl s ILE 214 Cb -0.05 -2.95 0.02 0.00 0.01 0.00 0.00 42.46 39.49 3ihl s ILE 214 CO -0.00 0.22 0.40 -0.69 0.00 0.00 0.00 174.94 174.87 3ihl s VAL 215 N 1.54 5.13 -0.28 2.92 1.01 0.53 -0.96 120.40 130.29 3ihl s VAL 215 Ca 0.04 -0.41 -0.19 0.00 0.00 0.00 0.00 61.98 61.42 3ihl s VAL 215 Cb -0.16 -4.00 -0.02 0.00 0.00 0.00 0.00 36.38 32.20 3ihl s VAL 215 CO 0.02 -0.38 0.59 0.00 0.00 0.00 0.00 175.10 175.33 3ihl s ARG 217 N 2.48 3.38 0.13 0.00 1.81 -0.42 -1.31 118.95 125.02 3ihl s ARG 217 Ca 0.24 -0.23 -0.24 0.00 -1.72 0.00 0.00 55.73 53.77 3ihl s ARG 217 Cb -0.15 -3.11 0.07 0.00 -0.45 0.00 0.00 34.95 31.30 3ihl s ARG 217 CO 0.10 0.73 0.74 -1.54 -0.68 0.00 0.00 175.30 174.65 3ihl s SER 218 N -1.36 -0.42 0.01 0.23 1.04 -1.23 -1.42 113.70 110.55 3ihl s SER 218 Ca 0.19 -0.14 -0.25 0.00 0.48 0.00 0.00 55.95 56.23 3ihl s SER 218 Cb -0.12 0.55 -0.17 0.00 0.10 0.00 0.00 66.02 66.38 3ihl s SER 218 CO 0.09 -0.93 1.25 0.28 0.98 0.00 0.00 173.24 174.92 3ihl h SER 219 N 2.00 -0.28 -1.83 7.02 0.02 -1.94 0.97 113.55 119.51 3ihl h SER 219 Ca -0.27 -0.21 -0.50 0.00 -0.84 0.00 0.00 61.79 59.97 3ihl h SER 219 Cb 1.27 0.07 -0.04 0.00 0.14 0.00 0.00 62.40 63.84 3ihl h SER 219 CO 0.32 0.08 -0.46 0.42 -1.14 0.00 0.00 176.83 176.06 3ihl s THR 220 N -4.64 3.41 0.68 -2.27 -4.23 -1.26 -3.37 115.64 103.97 3ihl s THR 220 Ca -0.14 -1.41 -0.16 0.00 -1.18 0.00 0.00 61.69 58.80 3ihl s THR 220 Cb 0.02 -3.15 0.01 0.00 1.34 0.00 0.00 72.50 70.73 3ihl s THR 220 CO 0.56 -0.16 1.17 -2.84 -0.54 0.00 0.00 174.62 172.81 3ihl s PRO 221 N -3.98 2.50 -0.04 3.99 0.02 -1.26 -4.78 135.00 131.45 3ihl s PRO 221 Ca 0.41 1.65 -0.21 0.00 0.02 0.00 0.00 61.00 62.87 3ihl s PRO 221 Cb -0.05 -1.89 -0.05 0.00 0.02 0.00 0.00 34.50 32.53 3ihl s PRO 221 CO 0.26 -1.53 0.60 0.42 -0.33 0.00 0.00 177.00 176.42 3ihl s ILE 222 N -2.03 5.00 0.40 2.83 1.01 -1.26 -5.06 121.20 122.10 3ihl s ILE 222 Ca 0.72 1.25 -0.12 0.00 0.00 0.00 0.00 60.65 62.51 3ihl s ILE 222 Cb -0.26 -3.94 -0.07 0.00 0.01 0.00 0.00 42.46 38.19 3ihl s ILE 222 CO 0.42 0.35 0.79 -1.83 0.00 0.00 0.00 174.94 174.66 3ihl s GLU 223 N 0.25 3.83 0.39 2.79 1.03 -1.26 -4.89 118.70 120.84 3ihl s GLU 223 Ca 0.32 0.54 0.11 0.00 0.03 0.00 0.00 54.97 55.98 3ihl s GLU 223 Cb -0.17 -2.37 0.91 0.00 -0.80 0.00 0.00 34.13 31.69 3ihl s GLU 223 CO 0.16 -0.03 1.90 0.52 -1.33 0.00 0.00 175.26 176.48 3ihl h MET 224 N 1.36 0.56 -0.70 -4.83 2.86 -1.98 -0.98 114.93 111.23 3ihl h MET 224 Ca -0.47 -0.03 -0.04 0.00 -2.06 0.00 0.00 59.70 57.09 3ihl h MET 224 Cb 1.19 -0.13 -0.03 0.00 0.06 0.00 0.00 31.60 32.69 3ihl h MET 224 CO 0.64 0.37 0.26 0.00 1.06 0.00 0.00 176.91 179.24 3ihl h ALA 225 N 1.62 0.91 -0.19 6.32 0.00 -1.99 0.39 119.26 126.32 3ihl h ALA 225 Ca 0.39 -0.19 -0.19 0.00 0.00 0.00 0.00 54.91 54.92 3ihl h ALA 225 Cb 0.71 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3ihl h ALA 225 CO -0.15 0.55 -0.65 0.28 0.00 0.00 0.00 179.25 179.27 3ihl h VAL 226 N 1.00 1.30 0.00 0.00 2.07 -1.59 -1.90 116.25 117.13 3ihl h VAL 226 Ca 0.23 -1.89 -0.04 0.00 0.82 0.00 0.00 66.70 65.82 3ihl h VAL 226 Cb 0.24 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.85 3ihl h VAL 226 CO -0.02 0.60 -0.17 0.50 0.02 0.00 0.00 177.57 178.50 3ihl h LYS 227 N 0.51 0.00 -0.07 1.57 3.64 -1.08 -1.98 116.57 119.16 3ihl h LYS 227 Ca -0.02 0.00 -0.18 0.00 -1.27 0.00 0.00 60.65 59.18 3ihl h LYS 227 Cb 1.24 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.08 3ihl h LYS 227 CO 0.13 0.17 -0.67 1.49 -2.27 0.00 0.00 179.45 178.31 3ihl h GLU 228 N 0.00 0.58 -0.78 1.90 4.81 -0.72 -2.98 114.58 117.40 3ihl h GLU 228 Ca -0.00 -0.53 -0.03 0.00 -0.13 0.00 0.00 59.36 58.67 3ihl h GLU 228 Cb 0.34 0.13 -0.04 0.00 0.63 0.00 0.00 28.75 29.81 3ihl h GLU 228 CO 0.02 1.15 0.38 0.87 -0.73 0.00 0.00 179.01 180.70 3ihl h LYS 229 N 0.19 1.10 0.14 1.92 1.57 -0.97 -1.82 116.57 118.70 3ihl h LYS 229 Ca -0.06 -0.15 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 3ihl h LYS 229 Cb 1.33 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.44 3ihl h LYS 229 CO 0.14 0.85 -0.07 0.82 -0.57 0.00 0.00 179.45 180.61 3ihl h ILE 230 N 1.10 0.98 -0.77 1.86 2.04 -1.41 0.55 117.51 121.87 3ihl h ILE 230 Ca 0.27 -0.54 0.18 0.00 1.00 0.00 0.00 64.86 65.76 3ihl h ILE 230 Cb 0.10 1.32 -0.12 0.00 -0.74 0.00 0.00 36.82 37.38 3ihl h ILE 230 CO -0.04 0.13 0.18 -1.28 0.00 0.00 0.00 178.15 177.14 3ihl h SER 231 N -0.45 -0.01 0.13 1.72 0.87 -1.45 0.12 113.55 114.48 3ihl h SER 231 Ca -0.02 0.16 -0.19 0.00 -1.23 0.00 0.00 61.79 60.51 3ihl h SER 231 Cb 0.36 0.22 0.02 0.00 -0.44 0.00 0.00 62.40 62.55 3ihl h SER 231 CO 0.03 -0.07 -0.84 -0.03 -0.53 0.00 0.00 176.83 175.39 3ihl h MET 232 N 0.25 0.28 0.00 2.24 -1.53 -1.07 -2.41 114.93 112.69 3ihl h MET 232 Ca 0.44 -0.48 0.00 0.00 -3.44 0.00 0.00 59.70 56.22 3ihl h MET 232 Cb 0.79 0.18 0.00 0.00 -0.55 0.00 0.00 31.60 32.02 3ihl h MET 232 CO -0.55 1.23 -0.21 1.19 0.14 0.00 0.00 176.91 178.71 3ihl n PHE 233 N -4.13 0.40 0.12 1.39 0.99 0.16 -3.33 117.46 113.07 3ihl n PHE 233 Ca -0.15 0.12 0.09 0.00 -0.00 0.00 0.00 57.45 57.50 3ihl n PHE 233 Cb 0.82 -0.63 0.17 0.00 -1.00 0.00 0.00 39.48 38.84 3ihl n PHE 233 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 3ihl n HIS 235 N 1.04 -1.92 -4.27 0.00 8.25 -1.02 -5.01 115.22 112.28 3ihl n HIS 235 Ca 0.15 0.81 -0.18 0.00 -0.26 0.00 0.00 57.72 58.24 3ihl n HIS 235 Cb 0.49 -4.31 -0.11 0.00 1.12 0.00 0.00 29.99 27.18 3ihl n HIS 235 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 3ihl s VAL 236 N -3.66 1.45 0.66 1.59 -7.23 -0.94 -5.07 120.40 107.21 3ihl s VAL 236 Ca 0.05 -1.85 -0.16 0.00 -1.81 0.00 0.00 61.98 58.20 3ihl s VAL 236 Cb -0.01 -1.68 0.00 0.00 0.56 0.00 0.00 36.38 35.24 3ihl s VAL 236 CO 0.81 -0.45 1.17 0.20 -0.31 0.00 0.00 175.10 176.52 3ihl s ASN 237 N -2.67 4.84 0.37 4.85 0.01 -1.26 -4.52 114.94 116.55 3ihl s ASN 237 Ca 0.13 2.24 0.16 0.00 -0.71 0.00 0.00 52.86 54.68 3ihl s ASN 237 Cb -0.04 -2.58 1.06 0.00 0.41 0.00 0.00 41.25 40.10 3ihl s ASN 237 CO 0.04 -1.82 1.73 -0.65 -1.51 0.00 0.00 177.10 174.89 3ihl h PRO 238 N 0.21 0.41 0.00 -0.60 0.11 -1.95 0.32 132.00 130.50 3ihl h PRO 238 Ca -0.48 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ihl h PRO 238 Cb 1.28 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3ihl h PRO 238 CO 0.53 0.27 0.00 1.05 -0.21 0.00 0.00 178.00 179.64 3ihl h GLU 239 N 0.42 0.00 -0.01 1.05 4.11 -1.98 -2.55 114.58 115.63 3ihl h GLU 239 Ca 0.65 0.00 0.00 0.00 0.07 0.00 0.00 59.36 60.08 3ihl h GLU 239 Cb 1.53 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.78 3ihl h GLU 239 CO -0.40 0.00 -0.17 1.04 0.07 0.00 0.00 179.01 179.54 3ihl n GLN 240 N -2.47 0.72 -3.45 1.06 6.02 0.10 -4.67 117.38 114.69 3ihl n GLN 240 Ca 0.02 -0.33 -0.42 0.00 -0.01 0.00 0.00 57.00 56.27 3ihl n GLN 240 Cb 0.28 -1.49 -0.10 0.00 1.02 0.00 0.00 30.24 29.95 3ihl n GLN 240 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3ihl s VAL 241 N -2.51 5.23 -0.13 5.09 1.01 -0.96 -0.57 120.40 127.57 3ihl s VAL 241 Ca 0.26 -0.35 0.00 0.00 0.00 0.00 0.00 61.98 61.89 3ihl s VAL 241 Cb 0.20 -3.86 -0.01 0.00 0.00 0.00 0.00 36.38 32.70 3ihl s VAL 241 CO 0.50 -0.19 -0.13 -0.63 0.00 0.00 0.00 175.10 174.65 3ihl s ILE 242 N 1.82 3.03 -0.22 2.22 -1.09 -0.13 -4.99 121.20 121.84 3ihl s ILE 242 Ca 0.08 -0.67 -0.04 0.00 -2.23 0.00 0.00 60.65 57.79 3ihl s ILE 242 Cb -0.18 -2.27 -0.01 0.00 -1.58 0.00 0.00 42.46 38.43 3ihl s ILE 242 CO 0.11 0.53 -0.05 0.00 -1.23 0.00 0.00 174.94 174.30 3ihl s ILE 244 N 1.45 1.49 0.79 0.00 -1.09 -0.43 -4.92 121.20 118.49 3ihl s ILE 244 Ca 0.05 -1.68 -0.07 0.00 -2.23 0.00 0.00 60.65 56.72 3ihl s ILE 244 Cb -0.14 -2.04 0.13 0.00 -1.58 0.00 0.00 42.46 38.83 3ihl s ILE 244 CO -0.03 -0.53 1.10 -1.38 -1.23 0.00 0.00 174.94 172.87 3ihl s HIS 245 N 1.33 2.00 -0.03 3.97 -3.43 -1.26 -3.51 115.29 114.36 3ihl s HIS 245 Ca 0.07 0.12 -0.30 0.00 -0.80 0.00 0.00 55.06 54.15 3ihl s HIS 245 Cb -0.18 -3.39 -0.06 0.00 -1.43 0.00 0.00 32.58 27.52 3ihl s HIS 245 CO -0.15 -1.89 1.63 -0.51 -2.00 0.00 0.00 174.74 171.82 3ihl s ASP 246 N -4.71 6.67 0.26 7.38 1.01 0.34 -4.83 116.67 122.78 3ihl s ASP 246 Ca 0.67 2.27 0.11 0.00 0.71 0.00 0.00 52.55 56.30 3ihl s ASP 246 Cb -0.07 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.28 3ihl s ASP 246 CO 0.47 -0.90 -0.13 0.68 0.21 0.00 0.00 175.17 175.50 3ihl s VAL 247 N 3.64 2.82 -0.76 -1.27 -7.23 -1.26 -4.91 120.40 111.43 3ihl s VAL 247 Ca 0.73 -2.17 0.26 0.00 -1.81 0.00 0.00 61.98 58.99 3ihl s VAL 247 Cb -0.34 -2.48 0.25 0.00 0.56 0.00 0.00 36.38 34.37 3ihl s VAL 247 CO 0.30 -0.35 1.74 -1.20 -0.31 0.00 0.00 175.10 175.28 3ihl n SER 248 N -0.59 0.70 -3.71 4.85 7.64 -1.26 -4.79 113.62 116.46 3ihl n SER 248 Ca -0.06 0.50 -0.14 0.00 1.01 0.00 0.00 58.87 60.18 3ihl n SER 248 Cb 0.59 -0.64 -0.09 0.00 -1.01 0.00 0.00 64.21 63.06 3ihl n SER 248 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3ihl s SER 249 N -4.29 -0.43 0.32 6.43 1.04 -1.26 -5.07 113.70 110.45 3ihl s SER 249 Ca 0.11 0.71 0.02 0.00 0.48 0.00 0.00 55.95 57.27 3ihl s SER 249 Cb 0.13 0.76 0.60 0.00 0.10 0.00 0.00 66.02 67.61 3ihl s SER 249 CO 0.60 -0.26 1.93 0.71 0.98 0.00 0.00 173.24 177.20 3ihl h THR 250 N 4.17 1.06 -1.13 2.02 1.35 -2.04 -1.22 112.91 117.11 3ihl h THR 250 Ca -0.28 -0.32 0.42 0.00 -0.55 0.00 0.00 66.41 65.68 3ihl h THR 250 Cb 1.17 0.04 -0.14 0.00 -1.73 0.00 0.00 68.15 67.49 3ihl h THR 250 CO 0.28 0.17 0.69 0.00 -0.25 0.00 0.00 175.52 176.41 3ihl n TYR 251 N -4.48 0.82 0.23 4.73 9.36 -1.26 -0.24 117.16 126.32 3ihl n TYR 251 Ca 0.12 0.83 0.06 0.00 3.32 0.00 0.00 57.90 62.23 3ihl n TYR 251 Cb 0.20 -1.25 0.54 0.00 -0.63 0.00 0.00 39.34 38.20 3ihl n TYR 251 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3ihl h ARG 252 N 0.00 0.00 0.49 2.98 2.47 -1.65 -3.22 114.38 115.45 3ihl h ARG 252 Ca 0.80 0.00 -0.02 0.00 -1.26 0.00 0.00 59.98 59.51 3ihl h ARG 252 Cb 2.41 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 30.72 3ihl h ARG 252 CO -0.54 0.17 -0.31 0.28 0.56 0.00 0.00 179.97 180.13 3ihl h VAL 253 N 0.00 0.35 -0.79 2.04 2.07 -0.81 -0.82 116.25 118.29 3ihl h VAL 253 Ca -0.00 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.64 3ihl h VAL 253 Cb 0.32 0.35 -0.09 0.00 -1.52 0.00 0.00 31.29 30.36 3ihl h VAL 253 CO 0.02 0.00 0.40 -0.65 0.02 0.00 0.00 177.57 177.36 3ihl h PRO 254 N -0.77 0.59 -0.65 1.57 0.11 -1.71 -1.35 132.00 129.79 3ihl h PRO 254 Ca -0.05 -0.04 0.08 0.00 0.11 0.00 0.00 66.00 66.10 3ihl h PRO 254 Cb 0.64 -0.13 -0.07 0.00 0.11 0.00 0.00 31.00 31.55 3ihl h PRO 254 CO 0.05 0.39 0.31 0.28 -0.21 0.00 0.00 178.00 178.82 3ihl h VAL 255 N 0.61 0.86 -0.47 3.15 2.07 -1.49 -0.33 116.25 120.64 3ihl h VAL 255 Ca 0.42 -0.19 -0.12 0.00 0.82 0.00 0.00 66.70 67.63 3ihl h VAL 255 Cb 0.54 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 3ihl h VAL 255 CO -0.33 0.10 -0.18 -0.07 0.02 0.00 0.00 177.57 177.11 3ihl h LEU 256 N 0.55 0.94 -0.40 2.57 3.38 -0.29 0.11 115.31 122.17 3ihl h LEU 256 Ca 0.32 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.96 3ihl h LEU 256 Cb 0.32 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3ihl h LEU 256 CO -0.25 1.10 0.25 -0.07 0.09 0.00 0.00 178.44 179.56 3ihl h LEU 257 N 0.81 0.42 -0.28 1.67 3.38 -0.74 -1.88 115.31 118.70 3ihl h LEU 257 Ca 0.12 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 3ihl h LEU 257 Cb 0.73 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3ihl h LEU 257 CO 0.06 0.30 -0.01 -0.33 0.09 0.00 0.00 178.44 178.55 3ihl h GLU 258 N 0.51 0.50 -0.77 1.13 5.08 -0.74 -1.75 114.58 118.54 3ihl h GLU 258 Ca 0.15 -0.17 0.22 0.00 -1.00 0.00 0.00 59.36 58.57 3ihl h GLU 258 Cb -0.03 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 3ihl h GLU 258 CO -0.05 0.67 0.61 0.93 -1.00 0.00 0.00 179.01 180.16 3ihl h GLU 259 N 0.28 0.00 -0.73 2.33 5.08 -0.62 0.16 114.58 121.08 3ihl h GLU 259 Ca 0.08 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.18 3ihl h GLU 259 Cb 0.45 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 29.55 3ihl h GLU 259 CO 0.02 0.00 0.29 1.04 -1.00 0.00 0.00 179.01 179.36 3ihl n GLN 260 N -4.08 3.28 -2.54 2.33 6.02 -0.69 -4.94 117.38 116.75 3ihl n GLN 260 Ca 0.16 -3.08 -0.19 0.00 -0.01 0.00 0.00 57.00 53.88 3ihl n GLN 260 Cb 0.89 -2.16 0.00 0.00 1.02 0.00 0.00 30.24 30.00 3ihl n GLN 260 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.06 176.48 3ihl n SER 261 N -0.43 -5.49 0.00 1.08 7.64 0.56 -4.89 113.62 112.09 3ihl n SER 261 Ca 0.43 -0.09 0.09 0.00 1.01 0.00 0.00 58.87 60.30 3ihl n SER 261 Cb 1.38 -4.47 0.50 0.00 -1.01 0.00 0.00 64.21 60.61 3ihl n SER 261 CO 0.00 0.00 0.00 -0.29 -3.01 0.00 0.00 175.04 171.74 3ihl h ILE 262 N -0.40 0.99 -0.07 0.44 2.10 -1.62 -2.60 117.51 116.34 3ihl h ILE 262 Ca -0.45 -0.13 -0.08 0.00 1.08 0.00 0.00 64.86 65.27 3ihl h ILE 262 Cb 1.33 0.56 0.00 0.00 -1.09 0.00 0.00 36.82 37.62 3ihl h ILE 262 CO 0.52 0.07 -0.28 0.58 -1.08 0.00 0.00 178.15 177.97 3ihl h VAL 263 N 0.39 1.42 -0.95 2.19 2.07 -1.87 -1.16 116.25 118.35 3ihl h VAL 263 Ca 0.19 -1.67 0.18 0.00 0.82 0.00 0.00 66.70 66.22 3ihl h VAL 263 Cb 0.25 2.30 -0.08 0.00 -1.52 0.00 0.00 31.29 32.24 3ihl h VAL 263 CO -0.04 0.48 0.61 0.50 0.02 0.00 0.00 177.57 179.13 3ihl h LYS 264 N -0.18 0.62 0.25 1.57 3.64 -1.93 0.10 116.57 120.64 3ihl h LYS 264 Ca -0.01 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.32 3ihl h LYS 264 Cb 0.91 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 32.60 3ihl h LYS 264 CO 0.06 0.41 -0.12 -0.92 -2.27 0.00 0.00 179.45 176.61 3ihl h TYR 265 N 0.64 -0.32 -0.22 1.91 3.20 -1.24 -2.75 116.97 118.19 3ihl h TYR 265 Ca 0.51 -0.01 0.03 0.00 3.14 0.00 0.00 58.73 62.41 3ihl h TYR 265 Cb 0.94 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.31 3ihl h TYR 265 CO -0.00 0.05 0.15 0.74 -1.64 0.00 0.00 178.16 177.46 3ihl h PHE 266 N -0.84 0.15 0.09 -3.82 0.04 -0.85 -0.15 116.94 111.56 3ihl h PHE 266 Ca -0.03 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.73 3ihl h PHE 266 Cb 0.51 -0.05 0.00 0.00 2.20 0.00 0.00 35.95 38.61 3ihl h PHE 266 CO 0.05 0.09 -0.04 -0.22 -0.60 0.00 0.00 178.31 177.58 3ihl h LYS 267 N 0.15 -0.12 -0.46 1.51 3.64 -0.77 -0.53 116.57 119.99 3ihl h LYS 267 Ca 0.10 0.01 -0.09 0.00 -1.27 0.00 0.00 60.65 59.39 3ihl h LYS 267 Cb 0.19 0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 3ihl h LYS 267 CO -0.01 0.04 -0.07 0.93 -2.27 0.00 0.00 179.45 178.07 3ihl h GLU 268 N -0.25 0.86 -0.04 1.90 5.08 -1.15 -1.55 114.58 119.43 3ihl h GLU 268 Ca -0.01 -0.31 -0.17 0.00 -1.00 0.00 0.00 59.36 57.87 3ihl h GLU 268 Cb 0.21 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.39 3ihl h GLU 268 CO 0.02 0.94 -0.73 -0.09 -1.00 0.00 0.00 179.01 178.15 3ihl h ARG 269 N 0.71 0.24 -0.06 2.33 9.65 -0.95 -3.27 114.38 123.03 3ihl h ARG 269 Ca 0.12 -0.20 0.00 0.00 -1.10 0.00 0.00 59.98 58.80 3ihl h ARG 269 Cb 0.60 0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.22 3ihl h ARG 269 CO 0.04 0.87 0.00 1.28 2.80 0.00 0.00 179.97 184.96 3ihl n LEU 270 N -3.78 1.79 -3.61 3.80 4.77 -0.22 -4.73 117.00 115.03 3ihl n LEU 270 Ca -0.03 -1.23 -0.28 0.00 -0.03 0.00 0.00 56.01 54.44 3ihl n LEU 270 Cb 0.71 -0.03 0.05 0.00 -2.33 0.00 0.00 43.42 41.81 3ihl n LEU 270 CO 0.46 0.39 -0.06 1.41 -1.33 0.00 0.00 177.39 178.27 3ihl n HIS 271 N 0.32 -2.01 -3.56 -1.77 8.25 -0.60 -4.79 115.22 111.06 3ihl n HIS 271 Ca 0.05 0.56 -0.33 0.00 -0.26 0.00 0.00 57.72 57.73 3ihl n HIS 271 Cb 0.21 -3.64 -0.05 0.00 1.12 0.00 0.00 29.99 27.63 3ihl n HIS 271 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 3ihl s LEU 272 N -6.29 4.28 0.00 2.41 1.43 -1.10 -5.07 118.68 114.34 3ihl s LEU 272 Ca 0.43 0.77 0.32 0.00 -1.03 0.00 0.00 54.13 54.62 3ihl s LEU 272 Cb -0.13 -3.25 1.87 0.00 0.03 0.00 0.00 46.19 44.70 3ihl s LEU 272 CO 0.84 0.08 2.20 -0.81 0.23 0.00 0.00 176.35 178.89