#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iku s ASN 3 N 0.00 3.20 0.18 1.61 2.47 -1.26 -5.04 114.94 116.10 1iku s ASN 3 Ca 0.00 -0.95 -0.08 0.00 0.42 0.00 0.00 52.86 52.25 1iku s ASN 3 Cb 0.00 -0.23 0.06 0.00 -1.45 0.00 0.00 41.25 39.63 1iku s ASN 3 CO 0.00 0.02 1.57 0.77 -3.72 0.00 0.00 177.10 175.74 1iku h SER 4 N 2.79 0.95 -0.57 -4.21 4.64 -2.01 -3.01 113.55 112.13 1iku h SER 4 Ca -0.42 -0.36 -0.09 0.00 -0.47 0.00 0.00 61.79 60.45 1iku h SER 4 Cb 1.23 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 63.04 1iku h SER 4 CO 0.55 1.13 -0.00 0.50 -0.87 0.00 0.00 176.83 178.14 1iku h LYS 5 N 0.79 1.03 0.00 4.77 1.63 -2.02 -2.10 116.57 120.68 1iku h LYS 5 Ca 0.10 -0.32 0.00 0.00 -0.85 0.00 0.00 60.65 59.58 1iku h LYS 5 Cb 0.79 -0.10 0.00 0.00 -0.60 0.00 0.00 32.23 32.32 1iku h LYS 5 CO 0.07 1.01 0.00 0.66 -3.45 0.00 0.00 179.45 177.73 1iku h SER 6 N 0.94 0.00 1.64 4.20 4.64 -1.93 -0.06 113.55 122.98 1iku h SER 6 Ca 0.17 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.45 1iku h SER 6 Cb 0.55 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.63 1iku h SER 6 CO 0.03 0.00 -0.16 1.23 -0.87 0.00 0.00 176.83 177.06 1iku h GLY 7 N 0.48 0.00 0.21 -0.77 0.00 -1.27 -3.30 103.07 98.42 1iku h GLY 7 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.24 1iku h GLY 7 CO 0.00 0.00 -0.45 0.00 0.00 0.00 0.00 176.54 176.09 1iku h ALA 8 N 1.84 0.02 -1.36 3.60 0.00 -1.03 -3.20 119.26 119.12 1iku h ALA 8 Ca -0.00 -0.67 0.40 0.00 0.00 0.00 0.00 54.91 54.64 1iku h ALA 8 Cb 1.03 0.14 -0.08 0.00 0.00 0.00 0.00 17.79 18.88 1iku h ALA 8 CO 0.02 0.23 0.94 -0.07 0.00 0.00 0.00 179.25 180.38 1iku h LEU 9 N -0.79 0.14 0.18 0.00 3.38 -1.60 -0.02 115.31 116.60 1iku h LEU 9 Ca -0.10 0.05 -0.01 0.00 0.09 0.00 0.00 57.88 57.91 1iku h LEU 9 Cb 1.25 0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.04 1iku h LEU 9 CO 0.02 -0.03 -0.09 -1.28 0.09 0.00 0.00 178.44 177.16 1iku h SER 10 N 0.09 -0.20 -0.96 -0.43 0.87 -1.65 -2.63 113.55 108.64 1iku h SER 10 Ca 0.71 -0.29 0.18 0.00 -1.23 0.00 0.00 61.79 61.15 1iku h SER 10 Cb 2.53 0.05 -0.17 0.00 -0.44 0.00 0.00 62.40 64.37 1iku h SER 10 CO -0.16 0.35 -0.29 0.50 -0.53 0.00 0.00 176.83 176.70 1iku h LYS 11 N -0.93 -0.01 -0.55 2.24 3.64 -1.00 0.79 116.57 120.77 1iku h LYS 11 Ca -0.02 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.29 1iku h LYS 11 Cb 0.49 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 1iku h LYS 11 CO 0.04 -0.00 0.08 0.93 -2.27 0.00 0.00 179.45 178.22 1iku h GLU 12 N -0.01 0.91 0.22 1.90 5.08 -1.57 -2.49 114.58 118.64 1iku h GLU 12 Ca 0.42 -0.25 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 1iku h GLU 12 Cb 0.67 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.82 1iku h GLU 12 CO -0.98 0.89 -0.11 0.82 -1.00 0.00 0.00 179.01 178.63 1iku h ILE 13 N 0.80 0.00 -1.46 3.13 2.04 0.18 -2.43 117.51 119.78 1iku h ILE 13 Ca 0.16 -0.22 0.48 0.00 1.00 0.00 0.00 64.86 66.29 1iku h ILE 13 Cb 0.43 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.38 1iku h ILE 13 CO 0.01 0.00 0.96 -0.07 0.00 0.00 0.00 178.15 179.05 1iku h LEU 14 N -0.52 0.18 -0.29 1.44 3.38 0.24 1.37 115.31 121.11 1iku h LEU 14 Ca -0.03 0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.95 1iku h LEU 14 Cb 0.23 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1iku h LEU 14 CO 0.05 -0.20 -0.26 -0.08 0.09 0.00 0.00 178.44 178.04 1iku h GLU 15 N 0.03 0.70 -0.98 1.13 4.22 -1.42 -3.01 114.58 115.25 1iku h GLU 15 Ca 0.87 -0.36 0.18 0.00 0.08 0.00 0.00 59.36 60.13 1iku h GLU 15 Cb 2.90 0.01 -0.09 0.00 0.50 0.00 0.00 28.75 32.07 1iku h GLU 15 CO -0.38 0.97 0.61 1.49 -2.18 0.00 0.00 179.01 179.52 1iku h GLU 16 N 0.44 0.72 0.00 1.92 4.81 0.23 -2.81 114.58 119.89 1iku h GLU 16 Ca 0.05 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1iku h GLU 16 Cb 0.83 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.05 1iku h GLU 16 CO 0.07 0.47 0.00 -0.11 -0.73 0.00 0.00 179.01 178.71 1iku n LEU 17 N -4.68 0.00 0.00 1.64 0.00 -1.01 -4.81 117.00 108.15 1iku n LEU 17 Ca 0.21 0.95 0.00 0.00 0.00 0.00 0.00 56.01 57.17 1iku n LEU 17 Cb 0.55 -0.45 0.00 0.00 0.00 0.00 0.00 43.42 43.52 1iku n LEU 17 CO 0.25 -0.45 0.00 1.67 0.00 0.00 0.00 177.39 178.86 1iku n GLN 18 N -2.64 0.00 0.00 1.96 7.27 -1.06 -5.08 117.38 117.84 1iku n GLN 18 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 1iku n GLN 18 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 1iku n GLN 18 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 1iku n LEU 19 N 0.00 0.00 0.00 1.69 4.77 -1.25 -5.10 117.00 117.12 1iku n LEU 19 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1iku n LEU 19 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1iku n LEU 19 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.39 175.60 1iku n ASN 20 N 0.00 0.00 0.16 -1.43 0.23 -1.26 -4.75 115.26 108.20 1iku n ASN 20 Ca 0.00 0.00 0.01 0.00 -0.53 0.00 0.00 54.58 54.06 1iku n ASN 20 Cb 0.00 0.00 0.23 0.00 -2.08 0.00 0.00 39.78 37.93 1iku n ASN 20 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1iku h THR 21 N 0.00 1.23 0.00 5.53 1.03 -1.96 -3.40 112.91 115.34 1iku h THR 21 Ca 0.00 -1.90 0.00 0.00 -0.01 0.00 0.00 66.41 64.50 1iku h THR 21 Cb 0.00 2.07 0.00 0.00 -1.07 0.00 0.00 68.15 69.15 1iku h THR 21 CO 0.00 0.52 0.00 1.17 -0.01 0.00 0.00 175.52 177.20 1iku n LYS 22 N -3.69 0.00 -1.67 0.00 4.81 -1.26 -4.89 118.16 111.45 1iku n LYS 22 Ca -0.01 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.04 1iku n LYS 22 Cb 0.58 -2.85 0.04 0.00 0.02 0.00 0.00 35.03 32.82 1iku n LYS 22 CO 0.00 0.00 0.00 1.19 1.17 0.00 0.00 177.40 179.76 1iku n PHE 23 N -1.30 1.61 -2.14 5.64 3.72 -1.26 -4.90 117.46 118.84 1iku n PHE 23 Ca 0.00 0.46 -0.41 0.00 -0.05 0.00 0.00 57.45 57.45 1iku n PHE 23 Cb 0.00 -2.27 -0.03 0.00 -0.94 0.00 0.00 39.48 36.25 1iku n PHE 23 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1iku s THR 24 N -1.35 2.93 0.31 4.37 2.01 -1.26 -4.88 115.64 117.76 1iku s THR 24 Ca 0.71 0.81 0.07 0.00 0.31 0.00 0.00 61.69 63.58 1iku s THR 24 Cb -0.45 -3.52 0.32 0.00 0.01 0.00 0.00 72.50 68.87 1iku s THR 24 CO 0.50 0.14 1.65 1.05 -0.69 0.00 0.00 174.62 177.28 1iku h GLU 25 N 4.74 0.25 -0.84 4.92 -0.00 -1.90 0.31 114.58 122.06 1iku h GLU 25 Ca -0.46 -0.02 0.20 0.00 -0.00 0.00 0.00 59.36 59.09 1iku h GLU 25 Cb 1.22 -0.06 -0.15 0.00 -0.00 0.00 0.00 28.75 29.76 1iku h GLU 25 CO 0.74 0.17 0.02 1.49 -0.00 0.00 0.00 179.01 181.42 1iku h GLU 26 N 0.26 0.08 0.25 1.06 4.57 -1.93 0.15 114.58 119.03 1iku h GLU 26 Ca 0.62 -0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.79 1iku h GLU 26 Cb 1.33 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.88 1iku h GLU 26 CO -0.64 0.05 -0.33 1.49 -1.18 0.00 0.00 179.01 178.41 1iku h GLU 27 N 0.08 -0.58 -0.97 1.92 4.22 -0.74 -1.10 114.58 117.42 1iku h GLU 27 Ca 0.47 0.04 0.25 0.00 0.08 0.00 0.00 59.36 60.21 1iku h GLU 27 Cb 0.88 0.13 -0.13 0.00 0.50 0.00 0.00 28.75 30.13 1iku h GLU 27 CO -0.75 -0.39 0.51 -0.07 -2.18 0.00 0.00 179.01 176.14 1iku h LEU 28 N -0.60 0.50 0.04 1.64 3.38 -1.18 0.74 115.31 119.83 1iku h LEU 28 Ca -0.03 0.16 0.03 0.00 0.09 0.00 0.00 57.88 58.12 1iku h LEU 28 Cb 0.54 0.10 -0.04 0.00 0.09 0.00 0.00 40.66 41.35 1iku h LEU 28 CO -0.08 0.01 -0.24 -1.28 0.09 0.00 0.00 178.44 176.93 1iku h SER 29 N 0.45 -0.71 -0.47 -0.43 0.87 0.34 0.47 113.55 114.07 1iku h SER 29 Ca 0.63 0.09 -0.06 0.00 -1.23 0.00 0.00 61.79 61.23 1iku h SER 29 Cb 1.27 0.28 -0.02 0.00 -0.44 0.00 0.00 62.40 63.49 1iku h SER 29 CO -0.53 -0.32 0.05 0.28 -0.53 0.00 0.00 176.83 175.78 1iku h SER 30 N -0.40 0.76 0.04 6.23 0.02 0.16 -2.64 113.55 117.72 1iku h SER 30 Ca 0.05 -0.28 -0.04 0.00 -0.84 0.00 0.00 61.79 60.69 1iku h SER 30 Cb 0.47 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.79 1iku h SER 30 CO -0.19 0.85 -0.11 -0.25 -1.14 0.00 0.00 176.83 175.99 1iku h TRP 31 N 0.65 0.17 0.56 3.45 7.01 -0.58 -1.21 115.95 126.00 1iku h TRP 31 Ca 0.14 -0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.10 1iku h TRP 31 Cb 0.42 -0.05 0.01 0.00 -2.10 0.00 0.00 29.16 27.44 1iku h TRP 31 CO 0.03 0.28 -0.27 -0.92 -2.79 0.00 0.00 178.44 174.77 1iku h TYR 32 N 0.16 -0.70 -0.77 2.65 3.20 0.28 0.41 116.97 122.20 1iku h TYR 32 Ca 0.03 -0.02 0.05 0.00 3.14 0.00 0.00 58.73 61.94 1iku h TYR 32 Cb 0.30 0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.74 1iku h TYR 32 CO 0.00 -0.44 0.46 1.96 -1.64 0.00 0.00 178.16 178.51 1iku h GLN 33 N -0.97 0.83 -0.49 1.82 4.20 -1.46 0.61 115.11 119.65 1iku h GLN 33 Ca -0.08 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.47 1iku h GLN 33 Cb 0.58 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 28.16 1iku h GLN 33 CO 0.13 0.55 -0.15 0.66 -0.67 0.00 0.00 178.83 179.35 1iku h SER 34 N 0.86 0.98 -0.49 1.46 4.64 -1.23 0.65 113.55 120.42 1iku h SER 34 Ca 0.33 -0.37 -0.11 0.00 -0.47 0.00 0.00 61.79 61.17 1iku h SER 34 Cb 0.14 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.95 1iku h SER 34 CO -0.16 1.13 -0.13 0.15 -0.87 0.00 0.00 176.83 176.95 1iku h PHE 35 N 0.83 1.08 0.00 4.77 3.57 0.41 -2.79 116.94 124.80 1iku h PHE 35 Ca 0.12 -0.23 -0.10 0.00 3.53 0.00 0.00 57.97 61.28 1iku h PHE 35 Cb 0.72 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.18 1iku h PHE 35 CO 0.05 1.03 -0.59 -0.07 -2.23 0.00 0.00 178.31 176.51 1iku h LEU 36 N 0.81 0.00 -0.65 0.59 3.38 -0.82 -2.76 115.31 115.87 1iku h LEU 36 Ca 0.12 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 1iku h LEU 36 Cb 0.69 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 1iku h LEU 36 CO 0.05 0.46 0.39 0.50 0.09 0.00 0.00 178.44 179.94 1iku h LYS 37 N 0.00 0.88 -0.04 1.13 1.63 0.52 -0.78 116.57 119.90 1iku h LYS 37 Ca -0.02 -0.08 -0.24 0.00 -0.85 0.00 0.00 60.65 59.46 1iku h LYS 37 Cb 1.37 -0.18 0.01 0.00 -0.60 0.00 0.00 32.23 32.83 1iku h LYS 37 CO 0.06 0.62 -0.94 1.49 -3.45 0.00 0.00 179.45 177.22 1iku h GLU 38 N 0.88 0.64 -3.08 1.90 4.57 -1.55 -3.38 114.58 114.57 1iku h GLU 38 Ca 0.23 -0.63 -0.62 0.00 -1.18 0.00 0.00 59.36 57.15 1iku h GLU 38 Cb -0.03 0.17 -0.42 0.00 -0.16 0.00 0.00 28.75 28.31 1iku h GLU 38 CO -0.04 1.24 -0.54 0.00 -1.18 0.00 0.00 179.01 178.48 1iku h PRO 40 N 5.38 -1.01 0.00 0.00 0.11 -1.34 -1.55 132.00 133.59 1iku h PRO 40 Ca 0.15 0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.33 1iku h PRO 40 Cb 0.75 0.23 0.00 0.00 0.11 0.00 0.00 31.00 32.09 1iku h PRO 40 CO 0.73 -0.67 0.59 0.66 -0.21 0.00 0.00 178.00 179.10 1iku h SER 41 N -1.05 0.00 -0.87 -2.05 4.64 -1.92 -3.42 113.55 108.86 1iku h SER 41 Ca -0.11 0.00 -0.38 0.00 -0.47 0.00 0.00 61.79 60.84 1iku h SER 41 Cb 0.81 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 62.75 1iku h SER 41 CO 0.18 0.00 -0.34 0.61 -0.87 0.00 0.00 176.83 176.41 1iku n GLY 42 N -1.30 1.78 3.46 -0.77 0.00 -0.58 -4.66 105.19 103.11 1iku n GLY 42 Ca -0.01 -0.08 -0.44 0.00 0.00 0.00 0.00 46.02 45.50 1iku n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iku s ARG 43 N -3.55 3.50 0.45 1.61 0.52 -1.26 0.07 118.95 120.28 1iku s ARG 43 Ca 0.00 -1.55 0.07 0.00 -0.52 0.00 0.00 55.73 53.73 1iku s ARG 43 Cb 0.00 -4.80 0.02 0.00 0.52 0.00 0.00 34.95 30.69 1iku s ARG 43 CO 0.00 -1.80 0.61 0.96 0.02 0.00 0.00 175.30 175.09 1iku s ILE 44 N 3.06 2.91 0.43 1.52 -4.36 -0.54 -4.72 121.20 119.50 1iku s ILE 44 Ca 0.31 -0.96 0.07 0.00 -0.26 0.00 0.00 60.65 59.82 1iku s ILE 44 Cb -0.07 -2.95 -0.03 0.00 1.25 0.00 0.00 42.46 40.66 1iku s ILE 44 CO -0.06 0.00 0.31 0.42 0.24 0.00 0.00 174.94 175.85 1iku s THR 45 N -2.42 2.44 0.11 8.37 -4.23 -1.26 -1.02 115.64 117.63 1iku s THR 45 Ca 0.56 -1.49 -0.19 0.00 -1.18 0.00 0.00 61.69 59.39 1iku s THR 45 Cb -0.10 -2.92 -0.07 0.00 1.34 0.00 0.00 72.50 70.75 1iku s THR 45 CO 0.34 0.00 1.71 0.08 -0.54 0.00 0.00 174.62 176.21 1iku h ARG 46 N 1.15 0.31 -0.41 3.99 0.11 -1.90 0.13 114.38 117.75 1iku h ARG 46 Ca -0.41 -0.04 0.12 0.00 0.10 0.00 0.00 59.98 59.75 1iku h ARG 46 Cb 1.26 -0.06 -0.02 0.00 1.11 0.00 0.00 29.97 32.27 1iku h ARG 46 CO 0.62 0.28 0.41 1.96 0.10 0.00 0.00 179.97 183.34 1iku h GLN 47 N 0.25 0.00 0.07 0.08 1.08 -1.96 -1.28 115.11 113.35 1iku h GLN 47 Ca 0.08 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 56.97 1iku h GLN 47 Cb 0.06 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.47 1iku h GLN 47 CO -0.01 0.00 -1.68 0.39 -0.95 0.00 0.00 178.83 176.57 1iku n GLU 48 N -3.86 0.67 0.17 1.46 -0.58 -0.72 -3.85 120.64 113.94 1iku n GLU 48 Ca 0.07 0.40 -0.14 0.00 -0.42 0.00 0.00 57.16 57.08 1iku n GLU 48 Cb 0.59 -1.72 -0.07 0.00 -0.57 0.00 0.00 31.44 29.67 1iku n GLU 48 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1iku h PHE 49 N -0.42 -0.65 -0.48 -0.32 3.57 -0.00 -1.44 116.94 117.20 1iku h PHE 49 Ca -0.40 0.00 0.14 0.00 3.53 0.00 0.00 57.97 61.25 1iku h PHE 49 Cb 1.71 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 40.68 1iku h PHE 49 CO 0.08 -0.36 0.37 -0.56 -2.23 0.00 0.00 178.31 175.62 1iku h GLN 50 N -0.53 0.00 -0.12 1.11 3.07 -1.47 0.57 115.11 117.75 1iku h GLN 50 Ca -0.01 0.00 -0.19 0.00 0.09 0.00 0.00 58.65 58.55 1iku h GLN 50 Cb 0.49 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.05 1iku h GLN 50 CO -0.05 0.00 -0.70 1.15 0.09 0.00 0.00 178.83 179.31 1iku h THR 51 N 0.00 1.34 -0.01 1.86 2.02 -1.39 -2.11 112.91 114.62 1iku h THR 51 Ca 0.23 -2.03 -0.20 0.00 0.77 0.00 0.00 66.41 65.18 1iku h THR 51 Cb 0.97 2.01 -0.01 0.00 -1.74 0.00 0.00 68.15 69.38 1iku h THR 51 CO -0.00 0.62 -0.85 0.40 0.37 0.00 0.00 175.52 176.06 1iku h ILE 52 N 0.37 1.46 -0.05 3.11 2.04 -0.23 -2.24 117.51 121.98 1iku h ILE 52 Ca -0.03 -2.49 -0.15 0.00 1.00 0.00 0.00 64.86 63.19 1iku h ILE 52 Cb 1.29 2.39 -0.01 0.00 -0.74 0.00 0.00 36.82 39.74 1iku h ILE 52 CO 0.13 0.73 -0.63 0.22 0.00 0.00 0.00 178.15 178.60 1iku h TYR 53 N 0.15 0.24 0.05 1.37 3.20 -1.15 -2.01 116.97 118.81 1iku h TYR 53 Ca -0.04 -0.09 -0.21 0.00 3.14 0.00 0.00 58.73 61.52 1iku h TYR 53 Cb 1.46 -0.04 0.02 0.00 1.54 0.00 0.00 36.73 39.71 1iku h TYR 53 CO 0.03 0.76 -0.86 0.77 -1.64 0.00 0.00 178.16 177.22 1iku h SER 54 N 0.13 0.67 -0.13 -2.11 0.02 -1.35 -2.58 113.55 108.20 1iku h SER 54 Ca -0.01 -0.80 -0.02 0.00 -0.84 0.00 0.00 61.79 60.12 1iku h SER 54 Cb 1.13 -0.21 -0.00 0.00 0.14 0.00 0.00 62.40 63.46 1iku h SER 54 CO 0.09 1.40 0.00 0.50 -1.14 0.00 0.00 176.83 177.68 1iku h LYS 55 N 0.03 0.24 0.66 3.45 3.64 -1.42 -3.27 116.57 119.89 1iku h LYS 55 Ca -0.12 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.15 1iku h LYS 55 Cb 1.58 -0.02 0.01 0.00 -0.41 0.00 0.00 32.23 33.38 1iku h LYS 55 CO 0.17 0.47 -0.32 0.74 -2.27 0.00 0.00 179.45 178.24 1iku h PHE 56 N -0.02 -0.82 -3.57 1.91 -1.00 -1.47 -3.40 116.94 108.56 1iku h PHE 56 Ca 0.04 -0.02 -0.61 0.00 2.81 0.00 0.00 57.97 60.18 1iku h PHE 56 Cb 0.36 0.27 -0.13 0.00 3.61 0.00 0.00 35.95 40.06 1iku h PHE 56 CO 0.03 -0.50 -0.05 -0.06 -1.61 0.00 0.00 178.31 176.12 1iku s PHE 57 N -5.94 3.29 -0.13 -0.55 0.08 -0.97 -4.17 117.98 109.58 1iku s PHE 57 Ca -0.17 0.63 -0.29 0.00 0.12 0.00 0.00 56.93 57.22 1iku s PHE 57 Cb 0.03 -2.68 -0.06 0.00 -0.57 0.00 0.00 43.02 39.74 1iku s PHE 57 CO 0.61 -0.23 2.09 -1.25 -0.10 0.00 0.00 175.22 176.34 1iku s PRO 58 N 2.12 3.53 -1.22 0.24 0.04 -1.26 -3.28 135.00 135.16 1iku s PRO 58 Ca 0.21 2.20 -0.03 0.00 0.04 0.00 0.00 61.00 63.42 1iku s PRO 58 Cb -0.16 -4.28 0.03 0.00 0.04 0.00 0.00 34.50 30.13 1iku s PRO 58 CO 0.09 -1.65 0.07 -1.91 0.04 0.00 0.00 177.00 173.64 1iku n GLU 59 N 8.26 -0.93 -0.13 4.56 2.13 -1.26 -4.75 120.64 128.53 1iku n GLU 59 Ca 0.26 0.07 0.09 0.00 0.66 0.00 0.00 57.16 58.24 1iku n GLU 59 Cb 0.44 -2.86 0.28 0.00 0.27 0.00 0.00 31.44 29.57 1iku n GLU 59 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1iku n ALA 60 N -3.67 2.48 -2.37 4.31 0.00 -1.21 -5.00 120.51 115.06 1iku n ALA 60 Ca -0.20 -0.60 -0.02 0.00 0.00 0.00 0.00 53.44 52.61 1iku n ALA 60 Cb 0.51 -1.03 -0.02 0.00 0.00 0.00 0.00 19.45 18.91 1iku n ALA 60 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1iku n ASP 61 N 0.49 -5.33 0.00 0.00 8.00 -1.26 -4.46 116.55 113.99 1iku n ASP 61 Ca 0.15 1.54 0.03 0.00 0.71 0.00 0.00 54.79 57.22 1iku n ASP 61 Cb 0.34 -4.97 0.18 0.00 -0.02 0.00 0.00 41.12 36.65 1iku n ASP 61 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1iku n PRO 62 N 1.66 0.20 -0.60 -0.24 -0.05 -1.26 -1.35 135.00 133.36 1iku n PRO 62 Ca -0.17 0.00 0.02 0.00 -0.05 0.00 0.00 63.50 63.29 1iku n PRO 62 Cb 0.27 -1.48 0.21 0.00 -0.05 0.00 0.00 33.50 32.45 1iku n PRO 62 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 175.50 175.81 1iku n LYS 63 N -0.98 2.15 0.00 0.54 2.85 -1.26 -4.23 118.16 117.22 1iku n LYS 63 Ca 0.05 -3.01 0.00 0.00 -1.05 0.00 0.00 58.31 54.29 1iku n LYS 63 Cb 0.02 -1.79 0.00 0.00 -0.65 0.00 0.00 35.03 32.61 1iku n LYS 63 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1iku n ALA 64 N -0.95 0.00 -0.02 0.58 0.00 -0.45 -4.75 120.51 114.92 1iku n ALA 64 Ca 0.27 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.69 1iku n ALA 64 Cb 0.94 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.38 1iku n ALA 64 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1iku n TYR 65 N 0.00 0.30 0.01 0.00 9.36 -1.26 -4.16 117.16 121.40 1iku n TYR 65 Ca 0.00 0.13 0.00 0.00 3.32 0.00 0.00 57.90 61.35 1iku n TYR 65 Cb 0.00 -0.41 0.01 0.00 -0.63 0.00 0.00 39.34 38.31 1iku n TYR 65 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1iku n ALA 66 N -2.72 0.32 0.03 2.98 0.00 -1.26 -2.18 120.51 117.67 1iku n ALA 66 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.28 1iku n ALA 66 Cb 0.09 -0.32 -0.07 0.00 0.00 0.00 0.00 19.45 19.14 1iku n ALA 66 CO 0.00 0.00 0.00 0.37 0.00 0.00 0.00 177.50 177.87 1iku h GLN 67 N 0.00 -0.54 -0.16 0.00 5.75 -1.74 0.22 115.11 118.64 1iku h GLN 67 Ca 0.00 0.04 -0.00 0.00 -0.15 0.00 0.00 58.65 58.53 1iku h GLN 67 Cb 0.69 0.12 -0.01 0.00 1.07 0.00 0.00 27.48 29.36 1iku h GLN 67 CO 0.00 -0.36 0.08 1.25 -2.65 0.00 0.00 178.83 177.15 1iku h HIS 68 N -0.56 0.22 0.28 3.99 2.76 -1.72 -2.57 115.15 117.55 1iku h HIS 68 Ca 0.05 -0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.21 1iku h HIS 68 Cb 0.66 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.54 1iku h HIS 68 CO -0.48 0.24 -0.29 0.28 -1.30 0.00 0.00 177.93 176.37 1iku h VAL 69 N 0.15 0.00 -0.17 5.26 2.07 -1.60 0.35 116.25 122.31 1iku h VAL 69 Ca 0.06 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.60 1iku h VAL 69 Cb 0.09 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 29.83 1iku h VAL 69 CO -0.01 0.00 -0.24 0.15 0.02 0.00 0.00 177.57 177.49 1iku h PHE 70 N -0.57 -0.74 -0.45 1.57 3.57 -0.61 0.17 116.94 119.89 1iku h PHE 70 Ca -0.04 0.04 0.06 0.00 3.53 0.00 0.00 57.97 61.56 1iku h PHE 70 Cb 0.50 0.34 -0.05 0.00 2.79 0.00 0.00 35.95 39.53 1iku h PHE 70 CO -0.18 -0.21 0.16 -0.09 -2.23 0.00 0.00 178.31 175.76 1iku h ARG 71 N -0.18 0.33 0.00 1.11 2.43 -1.48 -0.06 114.38 116.53 1iku h ARG 71 Ca 0.03 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1iku h ARG 71 Cb 0.26 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 1iku h ARG 71 CO -0.25 0.22 0.00 -1.13 -1.51 0.00 0.00 179.97 177.29 1iku n SER 72 N -5.00 0.00 -0.00 -3.80 3.41 0.12 -3.45 113.62 104.90 1iku n SER 72 Ca 0.04 0.19 -0.01 0.00 -0.26 0.00 0.00 58.87 58.82 1iku n SER 72 Cb 0.17 -0.32 -0.00 0.00 -0.26 0.00 0.00 64.21 63.79 1iku n SER 72 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 1iku h PHE 73 N 0.00 -0.04 0.00 7.33 3.57 0.13 -3.38 116.94 124.55 1iku h PHE 73 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1iku h PHE 73 Cb 0.13 0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.88 1iku h PHE 73 CO 0.00 -0.02 0.00 -0.25 -2.23 0.00 0.00 178.31 175.81 1iku n ASP 74 N -3.21 0.00 -3.90 0.41 8.00 -1.21 -4.78 116.55 111.86 1iku n ASP 74 Ca -0.01 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.20 1iku n ASP 74 Cb 0.02 0.00 0.02 0.00 -0.02 0.00 0.00 41.12 41.14 1iku n ASP 74 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iku n ALA 75 N -3.00 -1.40 -1.70 2.24 0.00 -0.89 -4.77 120.51 110.98 1iku n ALA 75 Ca 0.00 0.13 -0.58 0.00 0.00 0.00 0.00 53.44 52.98 1iku n ALA 75 Cb 0.00 -4.03 -0.07 0.00 0.00 0.00 0.00 19.45 15.35 1iku n ALA 75 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1iku n ASN 76 N -2.86 2.14 -4.20 0.00 5.15 -1.26 -0.75 115.26 113.48 1iku n ASN 76 Ca -0.01 1.09 -0.30 0.00 -0.60 0.00 0.00 54.58 54.76 1iku n ASN 76 Cb 0.55 -1.11 -0.07 0.00 -0.53 0.00 0.00 39.78 38.62 1iku n ASN 76 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1iku n SER 77 N 4.89 0.08 -3.17 1.20 7.64 -1.26 -0.06 113.62 122.95 1iku n SER 77 Ca 0.26 -1.17 -0.18 0.00 1.01 0.00 0.00 58.87 58.79 1iku n SER 77 Cb 0.11 -2.16 0.07 0.00 -1.01 0.00 0.00 64.21 61.22 1iku n SER 77 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1iku n ASP 78 N -2.88 -3.89 0.00 6.43 8.00 0.07 -5.00 116.55 119.28 1iku n ASP 78 Ca -0.27 -0.51 0.00 0.00 0.71 0.00 0.00 54.79 54.72 1iku n ASP 78 Cb 0.67 -4.51 0.00 0.00 -0.02 0.00 0.00 41.12 37.25 1iku n ASP 78 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1iku n GLY 79 N -1.46 0.63 3.37 0.44 0.00 0.92 -4.89 105.19 104.20 1iku n GLY 79 Ca -0.13 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.79 1iku n GLY 79 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1iku s THR 80 N 1.32 0.00 -0.04 2.61 -4.23 -1.26 -4.48 115.64 109.56 1iku s THR 80 Ca 0.00 -1.75 -0.19 0.00 -1.18 0.00 0.00 61.69 58.57 1iku s THR 80 Cb 0.00 -2.37 0.04 0.00 1.34 0.00 0.00 72.50 71.50 1iku s THR 80 CO 0.00 0.00 0.42 -1.48 -0.54 0.00 0.00 174.62 173.02 1iku s LEU 81 N -3.10 0.41 0.39 4.79 0.05 -0.19 -2.11 118.68 118.92 1iku s LEU 81 Ca 0.32 0.35 -0.26 0.00 0.05 0.00 0.00 54.13 54.59 1iku s LEU 81 Cb 0.04 1.61 -0.09 0.00 -2.05 0.00 0.00 46.19 45.70 1iku s LEU 81 CO 0.11 -0.45 1.21 -1.81 -0.55 0.00 0.00 176.35 174.87 1iku s ASP 82 N -1.08 6.53 -0.21 1.48 1.11 -1.25 -1.47 116.67 121.78 1iku s ASP 82 Ca -0.11 2.46 -0.21 0.00 0.18 0.00 0.00 52.55 54.87 1iku s ASP 82 Cb -0.04 -2.62 -0.18 0.00 1.07 0.00 0.00 42.92 41.15 1iku s ASP 82 CO 0.05 -0.68 0.17 0.33 1.18 0.00 0.00 175.17 176.22 1iku n PHE 83 N 0.22 0.95 0.03 4.23 7.35 0.11 -3.44 117.46 126.91 1iku n PHE 83 Ca 0.03 0.41 -0.12 0.00 -0.76 0.00 0.00 57.45 57.01 1iku n PHE 83 Cb 0.45 -1.09 -0.06 0.00 0.35 0.00 0.00 39.48 39.13 1iku n PHE 83 CO 0.00 0.00 0.00 0.87 -0.76 0.00 0.00 176.76 176.87 1iku h LYS 84 N -1.00 -0.49 -0.85 -4.13 1.57 -1.92 0.16 116.57 109.90 1iku h LYS 84 Ca -0.36 0.03 0.10 0.00 -1.87 0.00 0.00 60.65 58.55 1iku h LYS 84 Cb 1.31 0.11 -0.07 0.00 0.08 0.00 0.00 32.23 33.66 1iku h LYS 84 CO -0.22 -0.33 0.50 0.93 -0.57 0.00 0.00 179.45 179.76 1iku h GLU 85 N -0.51 0.80 -0.88 3.15 5.08 -1.96 -0.54 114.58 119.72 1iku h GLU 85 Ca 0.07 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1iku h GLU 85 Cb 0.62 -0.18 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 1iku h GLU 85 CO -0.35 0.53 0.52 -0.92 -1.00 0.00 0.00 179.01 177.79 1iku h TYR 86 N 0.83 1.17 0.28 4.33 5.03 -1.20 -2.35 116.97 125.05 1iku h TYR 86 Ca 0.41 -0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.70 1iku h TYR 86 Cb 0.37 -0.38 0.00 0.00 1.55 0.00 0.00 36.73 38.27 1iku h TYR 86 CO -0.05 0.79 -0.13 0.28 -1.32 0.00 0.00 178.16 177.72 1iku h VAL 87 N 1.22 0.76 0.07 1.81 2.07 0.83 -1.56 116.25 121.45 1iku h VAL 87 Ca 0.31 -0.32 0.02 0.00 0.82 0.00 0.00 66.70 67.54 1iku h VAL 87 Cb -0.03 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.63 1iku h VAL 87 CO -0.06 0.07 -0.51 0.40 0.02 0.00 0.00 177.57 177.49 1iku h ILE 88 N -0.54 0.03 -1.01 4.57 2.04 -1.18 0.19 117.51 121.61 1iku h ILE 88 Ca -0.04 0.00 0.23 0.00 1.00 0.00 0.00 64.86 66.05 1iku h ILE 88 Cb 0.40 0.03 -0.11 0.00 -0.74 0.00 0.00 36.82 36.39 1iku h ILE 88 CO 0.06 0.00 0.61 0.00 0.00 0.00 0.00 178.15 178.82 1iku h ALA 89 N -0.41 1.82 -0.08 1.87 0.00 -1.43 0.18 119.26 121.21 1iku h ALA 89 Ca 0.01 0.10 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1iku h ALA 89 Cb 0.74 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1iku h ALA 89 CO -0.31 -0.24 0.04 1.25 0.00 0.00 0.00 179.25 179.99 1iku h LEU 90 N 0.62 0.10 0.57 0.00 7.12 0.11 -3.20 115.31 120.63 1iku h LEU 90 Ca 0.61 -0.11 -0.03 0.00 0.13 0.00 0.00 57.88 58.49 1iku h LEU 90 Cb 1.14 -0.03 0.01 0.00 -0.53 0.00 0.00 40.66 41.25 1iku h LEU 90 CO -0.41 0.18 -0.27 0.45 -0.13 0.00 0.00 178.44 178.26 1iku h HIS 91 N 0.02 -0.71 -0.70 1.25 3.86 0.17 -3.44 115.15 115.60 1iku h HIS 91 Ca 0.03 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1iku h HIS 91 Cb 0.10 0.23 0.00 0.00 1.06 0.00 0.00 27.41 28.81 1iku h HIS 91 CO -0.04 -0.40 0.00 -1.33 0.86 0.00 0.00 177.93 177.03 1iku n MET 92 N -5.37 -1.03 -2.94 2.45 2.81 0.39 -3.64 117.12 109.78 1iku n MET 92 Ca -0.12 0.00 -0.13 0.00 -1.81 0.00 0.00 57.70 55.64 1iku n MET 92 Cb 0.33 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.82 1iku n MET 92 CO 0.00 0.00 0.00 -2.37 1.51 0.00 0.00 175.97 175.11 1iku n THR 93 N -2.42 0.00 0.00 2.03 5.66 -1.26 -4.62 114.28 113.67 1iku n THR 93 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1iku n THR 93 Cb 0.00 -0.15 0.00 0.00 -1.55 0.00 0.00 70.33 68.63 1iku n THR 93 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 1iku n SER 94 N -1.61 3.68 0.00 1.09 3.41 -1.24 -5.04 113.62 113.91 1iku n SER 94 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 1iku n SER 94 Cb 0.44 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 1iku n SER 94 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iku n ALA 95 N -3.00 0.00 0.00 7.33 0.00 -1.26 -4.82 120.51 118.76 1iku n ALA 95 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1iku n ALA 95 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1iku n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iku n GLY 96 N 0.00 -1.69 3.41 0.00 0.00 -1.26 -4.97 105.19 100.68 1iku n GLY 96 Ca 0.00 0.59 -0.35 0.00 0.00 0.00 0.00 46.02 46.26 1iku n GLY 96 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1iku n LYS 97 N 0.00 0.00 0.00 1.61 5.02 -1.26 -4.99 118.16 118.55 1iku n LYS 97 Ca 0.00 0.05 0.00 0.00 -2.02 0.00 0.00 58.31 56.34 1iku n LYS 97 Cb 0.00 -1.78 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 1iku n LYS 97 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1iku n THR 98 N -2.94 0.00 0.10 -0.18 -1.04 -1.26 -3.96 114.28 105.00 1iku n THR 98 Ca 0.08 0.20 0.16 0.00 -2.04 0.00 0.00 64.05 62.45 1iku n THR 98 Cb 0.52 -1.20 0.43 0.00 -1.82 0.00 0.00 70.33 68.26 1iku n THR 98 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1iku h ASN 99 N 0.00 0.00 0.54 8.00 7.08 -1.97 0.92 115.58 130.16 1iku h ASN 99 Ca 0.00 0.00 -0.27 0.00 -3.08 0.00 0.00 56.30 52.95 1iku h ASN 99 Cb 0.00 0.00 0.01 0.00 -2.08 0.00 0.00 38.32 36.25 1iku h ASN 99 CO 0.00 0.00 -1.22 1.56 -2.08 0.00 0.00 177.43 175.69 1iku h GLN 100 N 0.00 0.33 -0.33 4.14 1.08 -1.97 -3.02 115.11 115.33 1iku h GLN 100 Ca 0.20 -0.51 -0.17 0.00 -1.45 0.00 0.00 58.65 56.71 1iku h GLN 100 Cb 1.90 0.19 -0.00 0.00 -0.05 0.00 0.00 27.48 29.52 1iku h GLN 100 CO -0.00 1.23 -0.47 -0.22 -0.95 0.00 0.00 178.83 178.41 1iku h LYS 101 N 0.11 0.91 0.89 1.46 1.63 0.74 -3.15 116.57 119.16 1iku h LYS 101 Ca -0.14 -0.53 -0.04 0.00 -0.85 0.00 0.00 60.65 59.09 1iku h LYS 101 Cb 1.93 0.04 0.01 0.00 -0.60 0.00 0.00 32.23 33.61 1iku h LYS 101 CO 0.21 1.18 -0.43 -0.07 -3.45 0.00 0.00 179.45 176.89 1iku h LEU 102 N 0.72 -1.01 -1.12 5.20 3.38 -1.54 -2.49 115.31 118.46 1iku h LEU 102 Ca 0.04 0.03 0.40 0.00 0.09 0.00 0.00 57.88 58.44 1iku h LEU 102 Cb 1.08 0.26 -0.16 0.00 0.09 0.00 0.00 40.66 41.93 1iku h LEU 102 CO 0.11 -0.67 0.64 -0.33 0.09 0.00 0.00 178.44 178.29 1iku h GLU 103 N -1.31 0.10 0.18 1.13 4.39 -1.61 0.38 114.58 117.85 1iku h GLU 103 Ca -0.12 -0.01 -0.01 0.00 0.34 0.00 0.00 59.36 59.56 1iku h GLU 103 Cb 0.91 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.54 1iku h GLU 103 CO 0.20 0.06 -0.09 2.35 -1.16 0.00 0.00 179.01 180.37 1iku h TRP 104 N 0.10 -0.23 -0.84 4.33 7.01 -1.46 0.93 115.95 125.79 1iku h TRP 104 Ca 0.82 -0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.83 1iku h TRP 104 Cb 2.23 0.08 -0.05 0.00 -2.10 0.00 0.00 29.16 29.32 1iku h TRP 104 CO -0.01 0.11 0.55 0.00 -2.79 0.00 0.00 178.44 176.30 1iku h ALA 105 N 0.13 1.08 -0.10 2.65 0.00 0.01 0.32 119.26 123.35 1iku h ALA 105 Ca -0.03 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 1iku h ALA 105 Cb 0.44 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1iku h ALA 105 CO 0.04 0.43 0.04 0.35 0.00 0.00 0.00 179.25 180.11 1iku h PHE 106 N 1.10 0.16 -0.00 0.00 3.57 -0.39 -2.32 116.94 119.05 1iku h PHE 106 Ca 0.32 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.75 1iku h PHE 106 Cb -0.07 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 1iku h PHE 106 CO -0.02 0.28 -0.29 0.66 -2.23 0.00 0.00 178.31 176.71 1iku h SER 107 N -0.01 0.01 0.09 0.41 4.64 -0.42 -1.43 113.55 116.84 1iku h SER 107 Ca 0.03 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.30 1iku h SER 107 Cb 0.19 -0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1iku h SER 107 CO -0.00 0.29 -0.18 0.25 -0.87 0.00 0.00 176.83 176.33 1iku h LEU 108 N 0.01 0.17 0.00 5.97 5.85 0.04 -2.33 115.31 125.02 1iku h LEU 108 Ca -0.00 -0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.68 1iku h LEU 108 Cb 0.51 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.50 1iku h LEU 108 CO 0.04 0.36 -0.83 -1.22 -0.34 0.00 0.00 178.44 176.45 1iku n TYR 109 N -4.25 0.48 -2.31 1.25 4.01 -0.80 -4.60 117.16 110.95 1iku n TYR 109 Ca -0.01 0.14 -0.39 0.00 -0.16 0.00 0.00 57.90 57.48 1iku n TYR 109 Cb 0.29 -0.60 -0.02 0.00 -0.31 0.00 0.00 39.34 38.69 1iku n TYR 109 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1iku n ASP 110 N -2.12 4.22 0.02 7.72 2.03 -0.61 -4.59 116.55 123.22 1iku n ASP 110 Ca 0.02 -2.84 0.01 0.00 0.52 0.00 0.00 54.79 52.50 1iku n ASP 110 Cb 0.45 -1.71 -0.09 0.00 -0.72 0.00 0.00 41.12 39.05 1iku n ASP 110 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1iku n VAL 111 N 6.69 1.05 0.00 5.18 0.24 -1.26 -4.58 118.33 125.65 1iku n VAL 111 Ca 0.48 -0.68 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 1iku n VAL 111 Cb 0.45 -0.61 0.00 0.00 -1.47 0.00 0.00 33.84 32.21 1iku n VAL 111 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1iku n ASP 112 N -2.80 0.00 0.00 -1.34 -0.08 -1.26 -5.01 116.55 106.06 1iku n ASP 112 Ca -0.11 0.52 0.00 0.00 -1.51 0.00 0.00 54.79 53.70 1iku n ASP 112 Cb 0.82 -0.23 0.00 0.00 2.34 0.00 0.00 41.12 44.05 1iku n ASP 112 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1iku n GLY 113 N 0.53 0.75 0.00 0.27 0.00 -1.26 -5.05 105.19 100.43 1iku n GLY 113 Ca 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1iku n GLY 113 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1iku n ASN 114 N 0.00 0.00 0.00 1.61 5.15 -1.26 -4.97 115.26 115.79 1iku n ASN 114 Ca 0.00 0.48 0.00 0.00 -0.60 0.00 0.00 54.58 54.46 1iku n ASN 114 Cb 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.25 1iku n ASN 114 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1iku n GLY 115 N -0.61 -0.63 3.06 8.20 0.00 -1.26 -5.06 105.19 108.90 1iku n GLY 115 Ca 0.00 -0.03 -0.09 0.00 0.00 0.00 0.00 46.02 45.90 1iku n GLY 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1iku s THR 116 N 0.00 0.32 0.11 2.61 -4.23 -1.26 -3.36 115.64 109.83 1iku s THR 116 Ca 0.00 -1.43 0.04 0.00 -1.18 0.00 0.00 61.69 59.12 1iku s THR 116 Cb 0.00 -1.00 -0.04 0.00 1.34 0.00 0.00 72.50 72.80 1iku s THR 116 CO 0.00 -0.72 -0.10 -0.51 -0.54 0.00 0.00 174.62 172.75 1iku s ILE 117 N -2.67 0.99 0.41 2.99 2.07 -0.99 -4.67 121.20 119.33 1iku s ILE 117 Ca -0.02 -1.72 0.06 0.00 -1.41 0.00 0.00 60.65 57.56 1iku s ILE 117 Cb -0.01 -1.46 -0.07 0.00 0.13 0.00 0.00 42.46 41.05 1iku s ILE 117 CO -0.05 -0.59 0.01 -0.55 -1.91 0.00 0.00 174.94 171.86 1iku s SER 118 N -2.57 3.84 0.07 4.50 0.15 -1.26 -2.62 113.70 115.82 1iku s SER 118 Ca 0.08 -1.39 -0.23 0.00 0.70 0.00 0.00 55.95 55.11 1iku s SER 118 Cb -0.02 -0.32 -0.09 0.00 -1.71 0.00 0.00 66.02 63.89 1iku s SER 118 CO 0.00 -0.49 1.37 0.50 1.20 0.00 0.00 173.24 175.82 1iku h LYS 119 N 1.75 -0.41 -0.92 5.44 1.63 -1.95 -1.16 116.57 120.94 1iku h LYS 119 Ca -0.44 0.03 0.35 0.00 -0.85 0.00 0.00 60.65 59.74 1iku h LYS 119 Cb 1.25 0.09 -0.13 0.00 -0.60 0.00 0.00 32.23 32.84 1iku h LYS 119 CO 0.80 -0.27 0.54 -1.71 -3.45 0.00 0.00 179.45 175.36 1iku n ASN 120 N -4.47 0.23 -0.06 4.20 2.85 -1.26 0.21 115.26 116.96 1iku n ASN 120 Ca -0.05 1.23 -0.12 0.00 -0.11 0.00 0.00 54.58 55.53 1iku n ASN 120 Cb 0.26 -0.60 -0.06 0.00 1.24 0.00 0.00 39.78 40.62 1iku n ASN 120 CO 0.00 0.00 0.00 -0.33 -2.11 0.00 0.00 177.26 174.82 1iku h GLU 121 N 0.00 0.36 -0.85 1.20 4.39 -1.63 -2.54 114.58 115.52 1iku h GLU 121 Ca 0.68 -0.16 0.08 0.00 0.34 0.00 0.00 59.36 60.30 1iku h GLU 121 Cb 1.98 -0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 30.57 1iku h GLU 121 CO -0.51 0.68 0.55 0.28 -1.16 0.00 0.00 179.01 178.85 1iku h VAL 122 N 0.04 1.02 -0.15 3.13 2.07 0.27 -1.65 116.25 120.98 1iku h VAL 122 Ca 0.04 -0.31 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1iku h VAL 122 Cb 0.57 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.38 1iku h VAL 122 CO 0.03 0.16 0.09 0.25 0.02 0.00 0.00 177.57 178.12 1iku h LEU 123 N 0.90 0.18 -0.50 2.57 5.85 -1.08 -2.22 115.31 121.01 1iku h LEU 123 Ca 0.37 -0.05 0.10 0.00 0.84 0.00 0.00 57.88 59.14 1iku h LEU 123 Cb 0.29 -0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.17 1iku h LEU 123 CO -0.14 0.18 -0.16 -0.33 -0.34 0.00 0.00 178.44 177.65 1iku h GLU 124 N 0.17 -0.04 0.05 1.25 5.08 -0.88 0.26 114.58 120.48 1iku h GLU 124 Ca 0.05 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.44 1iku h GLU 124 Cb 0.03 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.26 1iku h GLU 124 CO -0.01 -0.03 -0.21 0.82 -1.00 0.00 0.00 179.01 178.59 1iku h ILE 125 N -0.04 0.52 -0.60 3.13 2.04 -1.24 0.11 117.51 121.44 1iku h ILE 125 Ca 0.24 0.00 0.05 0.00 1.00 0.00 0.00 64.86 66.15 1iku h ILE 125 Cb 0.41 0.52 -0.03 0.00 -0.74 0.00 0.00 36.82 36.97 1iku h ILE 125 CO -0.54 0.00 0.40 0.58 0.00 0.00 0.00 178.15 178.59 1iku h VAL 126 N -0.36 1.04 0.00 1.67 2.07 -0.67 -1.18 116.25 118.81 1iku h VAL 126 Ca 0.04 -0.22 -0.15 0.00 0.82 0.00 0.00 66.70 67.20 1iku h VAL 126 Cb 0.41 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.49 1iku h VAL 126 CO -0.16 0.12 -0.70 0.74 0.02 0.00 0.00 177.57 177.59 1iku h THR 127 N 0.64 1.46 -0.03 2.57 2.02 0.31 -1.26 112.91 118.61 1iku h THR 127 Ca 0.25 -2.44 -0.00 0.00 0.77 0.00 0.00 66.41 64.99 1iku h THR 127 Cb 0.19 2.33 -0.00 0.00 -1.74 0.00 0.00 68.15 68.93 1iku h THR 127 CO -0.07 0.69 0.00 0.00 0.37 0.00 0.00 175.52 176.51 1iku h ALA 128 N 1.30 0.05 -0.12 6.16 0.00 0.43 0.15 119.26 127.22 1iku h ALA 128 Ca -0.01 -0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 1iku h ALA 128 Cb 1.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1iku h ALA 128 CO 0.09 -0.30 -0.29 0.82 0.00 0.00 0.00 179.25 179.58 1iku h ILE 129 N -0.22 1.38 0.19 0.00 2.04 -1.48 -2.28 117.51 117.15 1iku h ILE 129 Ca 0.01 -1.59 -0.01 0.00 1.00 0.00 0.00 64.86 64.27 1iku h ILE 129 Cb 0.30 2.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.49 1iku h ILE 129 CO 0.00 0.47 -0.09 0.15 0.00 0.00 0.00 178.15 178.67 1iku h PHE 130 N -0.03 -0.24 -0.83 1.37 3.57 -1.26 -0.88 116.94 118.65 1iku h PHE 130 Ca -0.00 -0.01 0.19 0.00 3.53 0.00 0.00 57.97 61.68 1iku h PHE 130 Cb 0.89 0.08 -0.05 0.00 2.79 0.00 0.00 35.95 39.66 1iku h PHE 130 CO 0.11 -0.13 0.56 -0.22 -2.23 0.00 0.00 178.31 176.40 1iku h LYS 131 N -0.28 0.31 -0.28 1.11 3.64 -0.75 0.60 116.57 120.92 1iku h LYS 131 Ca -0.03 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1iku h LYS 131 Cb 0.21 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1iku h LYS 131 CO 0.04 0.21 0.08 1.98 -2.27 0.00 0.00 179.45 179.49 1iku h MET 132 N 0.32 0.40 -6.32 1.90 4.05 -0.56 -3.41 114.93 111.30 1iku h MET 132 Ca 0.42 -0.05 -0.54 0.00 -0.28 0.00 0.00 59.70 59.24 1iku h MET 132 Cb 1.14 -0.07 0.00 0.00 -0.80 0.00 0.00 31.60 31.87 1iku h MET 132 CO -0.12 0.37 1.06 0.42 0.23 0.00 0.00 176.91 178.86 1iku s ILE 133 N -5.13 3.42 0.07 1.77 1.01 0.21 -4.57 121.20 117.97 1iku s ILE 133 Ca -0.07 0.64 -0.37 0.00 0.00 0.00 0.00 60.65 60.85 1iku s ILE 133 Cb 0.16 -3.41 -0.18 0.00 0.01 0.00 0.00 42.46 39.04 1iku s ILE 133 CO 0.73 -0.04 1.10 -1.20 0.00 0.00 0.00 174.94 175.54 1iku n SER 134 N 6.65 0.52 -0.06 3.58 7.64 -1.26 -4.66 113.62 126.03 1iku n SER 134 Ca 0.17 1.14 0.23 0.00 1.01 0.00 0.00 58.87 61.42 1iku n SER 134 Cb 0.42 -1.04 0.70 0.00 -1.01 0.00 0.00 64.21 63.28 1iku n SER 134 CO 0.00 0.00 0.00 -0.65 -3.01 0.00 0.00 175.04 171.38 1iku h PRO 135 N 3.28 0.01 0.15 1.43 0.11 -1.90 0.33 132.00 135.42 1iku h PRO 135 Ca -0.47 -0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.35 1iku h PRO 135 Cb 1.39 -0.00 0.02 0.00 0.11 0.00 0.00 31.00 32.52 1iku h PRO 135 CO 0.68 0.01 -1.29 1.49 -0.21 0.00 0.00 178.00 178.68 1iku h GLU 136 N 0.01 0.39 0.00 1.05 4.57 -2.02 -3.08 114.58 115.50 1iku h GLU 136 Ca 0.31 -0.62 0.00 0.00 -1.18 0.00 0.00 59.36 57.86 1iku h GLU 136 Cb 1.22 0.23 0.00 0.00 -0.16 0.00 0.00 28.75 30.04 1iku h GLU 136 CO -0.01 1.29 0.00 -3.47 -1.18 0.00 0.00 179.01 175.64 1iku n ASP 137 N -3.62 0.00 0.11 1.04 2.03 0.23 -2.71 116.55 113.63 1iku n ASP 137 Ca -0.11 0.23 0.11 0.00 0.52 0.00 0.00 54.79 55.54 1iku n ASP 137 Cb 1.03 -0.41 0.01 0.00 -0.72 0.00 0.00 41.12 41.03 1iku n ASP 137 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1iku h THR 138 N 0.00 0.01 0.00 5.18 2.02 -0.40 -3.32 112.91 116.39 1iku h THR 138 Ca 0.00 -1.01 -0.11 0.00 0.77 0.00 0.00 66.41 66.06 1iku h THR 138 Cb 0.40 1.54 -0.02 0.00 -1.74 0.00 0.00 68.15 68.33 1iku h THR 138 CO 0.00 0.00 -0.51 0.11 0.37 0.00 0.00 175.52 175.50 1iku h LYS 139 N 0.00 0.00 0.00 6.66 1.57 -1.43 -3.09 116.57 120.28 1iku h LYS 139 Ca -0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.69 1iku h LYS 139 Cb 1.01 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.30 1iku h LYS 139 CO 0.00 0.51 -0.42 0.45 -0.57 0.00 0.00 179.45 179.42 1iku h HIS 140 N 0.00 0.00 -3.15 -1.35 3.86 -1.66 -3.45 115.15 109.40 1iku h HIS 140 Ca -0.01 0.00 -0.57 0.00 -1.16 0.00 0.00 60.37 58.64 1iku h HIS 140 Cb 1.26 0.00 0.18 0.00 1.06 0.00 0.00 27.41 29.92 1iku h HIS 140 CO 0.00 0.42 -0.38 1.28 0.86 0.00 0.00 177.93 180.11 1iku n LEU 141 N -3.72 0.92 -4.67 2.43 4.77 -1.17 -4.75 117.00 110.81 1iku n LEU 141 Ca -0.01 0.64 -0.52 0.00 -0.03 0.00 0.00 56.01 56.09 1iku n LEU 141 Cb 0.50 -1.21 -0.06 0.00 -2.33 0.00 0.00 43.42 40.32 1iku n LEU 141 CO 0.38 -3.05 1.22 -2.65 -1.33 0.00 0.00 177.39 171.96 1iku n PRO 142 N -0.54 1.51 0.00 3.23 -0.02 -1.26 -4.77 135.00 133.16 1iku n PRO 142 Ca 0.11 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.14 1iku n PRO 142 Cb 0.49 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.70 1iku n PRO 142 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1iku n GLU 143 N 4.56 0.38 0.37 -0.52 1.02 -1.26 -3.75 120.64 121.44 1iku n GLU 143 Ca 0.22 0.00 -0.18 0.00 -0.02 0.00 0.00 57.16 57.18 1iku n GLU 143 Cb 0.20 -1.01 -0.09 0.00 -0.02 0.00 0.00 31.44 30.52 1iku n GLU 143 CO 0.00 0.00 0.00 0.38 1.18 0.00 0.00 177.13 178.69 1iku h ASP 144 N 0.04 -1.23 -0.45 1.62 2.03 -2.00 -3.43 116.42 113.00 1iku h ASP 144 Ca 0.00 0.08 -0.03 0.00 -0.73 0.00 0.00 57.03 56.35 1iku h ASP 144 Cb 0.01 0.37 -0.16 0.00 -0.83 0.00 0.00 39.33 38.73 1iku h ASP 144 CO 0.00 -0.69 -0.24 -0.70 -1.03 0.00 0.00 179.24 176.58 1iku s GLU 145 N -5.72 0.47 -0.91 4.15 2.12 -1.25 -5.07 118.70 112.49 1iku s GLU 145 Ca -0.18 -0.44 -0.00 0.00 0.36 0.00 0.00 54.97 54.72 1iku s GLU 145 Cb 0.03 -0.01 0.28 0.00 0.26 0.00 0.00 34.13 34.69 1iku s GLU 145 CO 0.56 -0.59 1.19 0.27 -0.54 0.00 0.00 175.26 176.15 1iku n ASN 146 N 2.84 5.37 -4.05 -1.70 2.04 -1.26 -4.79 115.26 113.71 1iku n ASN 146 Ca 0.13 -3.42 -0.22 0.00 -0.44 0.00 0.00 54.58 50.63 1iku n ASN 146 Cb 0.62 -1.04 -0.16 0.00 -2.53 0.00 0.00 39.78 36.67 1iku n ASN 146 CO 0.00 0.00 0.00 0.42 -0.44 0.00 0.00 177.26 177.24 1iku s THR 147 N -2.62 1.01 0.61 5.53 -4.23 -1.26 -5.00 115.64 109.67 1iku s THR 147 Ca 0.34 -0.49 0.30 0.00 -1.18 0.00 0.00 61.69 60.66 1iku s THR 147 Cb 0.08 -0.88 0.36 0.00 1.34 0.00 0.00 72.50 73.40 1iku s THR 147 CO 0.05 0.30 2.02 -0.65 -0.54 0.00 0.00 174.62 175.80 1iku h PRO 148 N 6.29 0.00 0.10 3.99 0.10 -1.95 0.25 132.00 140.79 1iku h PRO 148 Ca -0.33 0.00 -0.29 0.00 0.10 0.00 0.00 66.00 65.47 1iku h PRO 148 Cb 1.17 0.00 -0.01 0.00 0.10 0.00 0.00 31.00 32.26 1iku h PRO 148 CO 0.48 0.00 -1.48 0.93 0.10 0.00 0.00 178.00 178.03 1iku h GLU 149 N 0.00 0.21 0.00 1.05 5.08 -1.97 -2.81 114.58 116.15 1iku h GLU 149 Ca 0.10 -0.37 -0.08 0.00 -1.00 0.00 0.00 59.36 58.01 1iku h GLU 149 Cb 0.70 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 30.07 1iku h GLU 149 CO -0.00 1.07 -0.43 0.87 -1.00 0.00 0.00 179.01 179.52 1iku h LYS 150 N 0.06 0.00 -0.01 2.33 1.79 -1.34 -2.35 116.57 117.06 1iku h LYS 150 Ca -0.22 0.00 -0.09 0.00 -2.18 0.00 0.00 60.65 58.16 1iku h LYS 150 Cb 1.99 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 32.65 1iku h LYS 150 CO 0.16 0.35 -0.33 -0.09 -1.08 0.00 0.00 179.45 178.45 1iku h ARG 151 N 0.00 0.24 0.00 3.15 2.43 -0.69 -2.90 114.38 116.61 1iku h ARG 151 Ca -0.01 -0.25 -0.12 0.00 -0.81 0.00 0.00 59.98 58.79 1iku h ARG 151 Cb 1.29 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.89 1iku h ARG 151 CO 0.05 0.96 -0.58 0.00 -1.51 0.00 0.00 179.97 178.88 1iku h ALA 152 N 0.29 0.92 0.26 2.80 0.00 -1.58 -2.71 119.26 119.23 1iku h ALA 152 Ca -0.04 -0.53 -0.01 0.00 0.00 0.00 0.00 54.91 54.33 1iku h ALA 152 Cb 1.07 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.77 1iku h ALA 152 CO 0.07 0.72 -0.12 0.93 0.00 0.00 0.00 179.25 180.85 1iku h GLU 153 N 0.00 -0.33 -0.92 0.00 4.39 -1.46 0.17 114.58 116.42 1iku h GLU 153 Ca -0.01 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 1iku h GLU 153 Cb 1.11 0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.79 1iku h GLU 153 CO 0.08 -0.17 0.57 -0.22 -1.16 0.00 0.00 179.01 178.11 1iku h LYS 154 N -0.42 1.24 -0.78 2.33 3.64 -1.51 -0.99 116.57 120.09 1iku h LYS 154 Ca -0.04 -0.10 -0.05 0.00 -1.27 0.00 0.00 60.65 59.19 1iku h LYS 154 Cb 0.32 -0.27 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1iku h LYS 154 CO 0.06 0.86 0.30 0.82 -2.27 0.00 0.00 179.45 179.21 1iku h ILE 155 N 1.27 1.26 0.00 2.00 2.04 -1.17 -1.93 117.51 120.97 1iku h ILE 155 Ca 0.33 -0.83 0.00 0.00 1.00 0.00 0.00 64.86 65.36 1iku h ILE 155 Cb -0.08 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 36.35 1iku h ILE 155 CO -0.06 0.34 0.00 1.87 0.00 0.00 0.00 178.15 180.29 1iku n TRP 156 N -4.27 0.88 0.02 1.37 -0.00 0.56 -1.62 117.44 114.39 1iku n TRP 156 Ca 0.07 0.28 -0.12 0.00 -0.00 0.00 0.00 57.50 57.73 1iku n TRP 156 Cb 0.19 -0.96 -0.14 0.00 -0.00 0.00 0.00 31.31 30.41 1iku n TRP 156 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 177.69 178.47 1iku h GLY 157 N 3.84 0.13 1.02 5.87 0.00 -0.49 -3.36 103.07 110.07 1iku h GLY 157 Ca 0.00 -0.33 -0.21 0.00 0.00 0.00 0.00 47.33 46.79 1iku h GLY 157 CO 0.00 0.29 -1.49 0.74 0.00 0.00 0.00 176.54 176.07 1iku h PHE 158 N 0.03 0.00 0.00 5.60 0.04 -1.35 -3.39 116.94 117.87 1iku h PHE 158 Ca -0.24 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.53 1iku h PHE 158 Cb 1.97 0.00 0.00 0.00 2.20 0.00 0.00 35.95 40.12 1iku h PHE 158 CO 0.03 0.73 0.00 1.19 -0.60 0.00 0.00 178.31 179.66 1iku n PHE 159 N -2.96 0.00 0.00 -0.55 3.72 -0.64 -4.83 117.46 112.21 1iku n PHE 159 Ca -0.12 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.28 1iku n PHE 159 Cb 0.91 -0.41 0.00 0.00 -0.94 0.00 0.00 39.48 39.05 1iku n PHE 159 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1iku n GLY 160 N -0.93 0.30 0.00 1.37 0.00 -1.26 -4.93 105.19 99.75 1iku n GLY 160 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1iku n GLY 160 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1iku n LYS 161 N 0.00 0.00 -0.01 1.61 5.02 -1.26 -5.00 118.16 118.52 1iku n LYS 161 Ca 0.00 0.00 -0.01 0.00 -2.02 0.00 0.00 58.31 56.28 1iku n LYS 161 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 35.03 35.02 1iku n LYS 161 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1iku n LYS 162 N 0.00 -2.07 0.00 1.97 4.76 -1.26 -4.41 118.16 117.15 1iku n LYS 162 Ca 0.00 -0.04 0.05 0.00 -2.87 0.00 0.00 58.31 55.45 1iku n LYS 162 Cb 0.00 -0.05 0.30 0.00 -1.84 0.00 0.00 35.03 33.44 1iku n LYS 162 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1iku n ASP 163 N -3.07 0.00 -3.40 4.39 2.03 -1.26 -3.46 116.55 111.77 1iku n ASP 163 Ca 0.00 -0.31 -0.38 0.00 0.52 0.00 0.00 54.79 54.62 1iku n ASP 163 Cb 0.02 -0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.43 1iku n ASP 163 CO 0.00 0.00 0.00 -0.67 -1.92 0.00 0.00 177.20 174.61 1iku n ASP 164 N -1.00 6.85 -3.26 1.67 2.03 -1.26 -4.89 116.55 116.69 1iku n ASP 164 Ca 0.08 -3.71 0.03 0.00 0.52 0.00 0.00 54.79 51.71 1iku n ASP 164 Cb 0.03 -1.04 -0.03 0.00 -0.72 0.00 0.00 41.12 39.37 1iku n ASP 164 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 1iku s ASP 165 N -1.72 -0.59 0.64 1.67 2.15 -1.22 -4.94 116.67 112.66 1iku s ASP 165 Ca 0.42 0.56 -0.03 0.00 0.43 0.00 0.00 52.55 53.93 1iku s ASP 165 Cb 0.24 1.57 0.05 0.00 -0.30 0.00 0.00 42.92 44.49 1iku s ASP 165 CO -0.17 -0.11 0.91 -0.54 -0.17 0.00 0.00 175.17 175.09 1iku s LYS 166 N 2.69 2.32 -0.20 4.34 3.01 -1.26 -4.70 119.74 125.93 1iku s LYS 166 Ca 0.01 -0.51 -0.04 0.00 -1.01 0.00 0.00 55.97 54.42 1iku s LYS 166 Cb -0.09 -2.31 -0.02 0.00 -1.01 0.00 0.00 37.83 34.41 1iku s LYS 166 CO -0.15 -1.03 -0.03 -0.51 0.51 0.00 0.00 175.35 174.14 1iku s LEU 167 N -5.04 3.10 0.58 3.17 1.43 -1.08 -4.97 118.68 115.87 1iku s LEU 167 Ca 0.59 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 53.43 1iku s LEU 167 Cb -0.10 -1.78 0.04 0.00 0.03 0.00 0.00 46.19 44.38 1iku s LEU 167 CO 0.42 0.05 0.81 0.42 0.23 0.00 0.00 176.35 178.28 1iku s THR 168 N 1.08 2.59 0.13 5.49 -4.23 -1.26 -2.35 115.64 117.08 1iku s THR 168 Ca 0.02 -0.63 -0.27 0.00 -1.18 0.00 0.00 61.69 59.63 1iku s THR 168 Cb -0.15 -2.96 -0.07 0.00 1.34 0.00 0.00 72.50 70.67 1iku s THR 168 CO 0.01 0.00 1.46 -0.33 -0.54 0.00 0.00 174.62 175.21 1iku h GLU 169 N -0.03 -0.08 -0.48 3.99 5.08 -1.97 0.19 114.58 121.29 1iku h GLU 169 Ca -0.42 0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 57.89 1iku h GLU 169 Cb 1.30 0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.54 1iku h GLU 169 CO 0.52 -0.05 0.05 0.87 -1.00 0.00 0.00 179.01 179.39 1iku h LYS 170 N -0.08 0.76 0.14 2.33 1.79 -1.94 -2.51 116.57 117.06 1iku h LYS 170 Ca 0.12 -0.18 -0.01 0.00 -2.18 0.00 0.00 60.65 58.40 1iku h LYS 170 Cb 0.38 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 30.93 1iku h LYS 170 CO -0.73 0.74 -0.07 1.49 -1.08 0.00 0.00 179.45 179.80 1iku h GLU 171 N 0.72 -0.18 -0.58 3.15 4.57 -1.35 0.26 114.58 121.18 1iku h GLU 171 Ca 0.15 0.01 0.03 0.00 -1.18 0.00 0.00 59.36 58.37 1iku h GLU 171 Cb 0.37 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.96 1iku h GLU 171 CO 0.01 -0.09 0.35 0.35 -1.18 0.00 0.00 179.01 178.45 1iku h PHE 172 N -0.22 0.64 0.58 0.92 3.57 -0.65 1.19 116.94 122.97 1iku h PHE 172 Ca -0.02 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 1iku h PHE 172 Cb 0.18 -0.21 0.01 0.00 2.79 0.00 0.00 35.95 38.72 1iku h PHE 172 CO -0.06 0.36 -0.28 0.82 -2.23 0.00 0.00 178.31 176.92 1iku h ILE 173 N 0.68 0.15 0.00 1.41 1.08 -1.25 -2.52 117.51 117.06 1iku h ILE 173 Ca 0.24 -0.41 0.00 0.00 -0.39 0.00 0.00 64.86 64.30 1iku h ILE 173 Cb 0.05 0.21 0.00 0.00 -3.07 0.00 0.00 36.82 34.01 1iku h ILE 173 CO -0.11 0.02 0.00 -0.33 -0.69 0.00 0.00 178.15 177.04 1iku h GLU 174 N -1.14 0.00 -0.13 2.37 4.39 -0.41 -1.01 114.58 118.66 1iku h GLU 174 Ca -0.08 0.00 -0.22 0.00 0.34 0.00 0.00 59.36 59.40 1iku h GLU 174 Cb 0.64 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.30 1iku h GLU 174 CO 0.13 0.00 -0.80 0.78 -1.16 0.00 0.00 179.01 177.96 1iku h GLY 175 N 0.90 0.80 0.85 -3.84 0.00 0.16 -1.85 103.07 100.10 1iku h GLY 175 Ca 0.00 -1.15 -0.29 0.00 0.00 0.00 0.00 47.33 45.88 1iku h GLY 175 CO 0.00 1.02 -1.40 -0.91 0.00 0.00 0.00 176.54 175.26 1iku h THR 176 N 0.48 1.17 0.64 4.70 1.35 -0.97 -3.09 112.91 117.19 1iku h THR 176 Ca -0.06 -2.53 -0.03 0.00 -0.55 0.00 0.00 66.41 63.24 1iku h THR 176 Cb 1.42 2.91 0.01 0.00 -1.73 0.00 0.00 68.15 70.76 1iku h THR 176 CO 0.16 0.78 -0.31 0.25 -0.25 0.00 0.00 175.52 176.15 1iku h LEU 177 N -0.10 -0.73 0.27 3.87 5.85 -1.30 -3.32 115.31 119.85 1iku h LEU 177 Ca -0.27 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.45 1iku h LEU 177 Cb 1.93 0.19 -0.04 0.00 0.37 0.00 0.00 40.66 43.11 1iku h LEU 177 CO 0.17 -0.36 -0.47 0.00 -0.34 0.00 0.00 178.44 177.43 1iku h ALA 178 N -1.07 -0.95 -2.60 1.25 0.00 -1.52 -3.40 119.26 110.96 1iku h ALA 178 Ca -0.09 -0.13 -0.52 0.00 0.00 0.00 0.00 54.91 54.17 1iku h ALA 178 Cb 0.69 0.75 0.00 0.00 0.00 0.00 0.00 17.79 19.23 1iku h ALA 178 CO 0.15 -1.09 0.47 1.21 0.00 0.00 0.00 179.25 179.99 1iku s ASN 179 N -4.57 7.26 0.02 0.00 3.04 -1.17 -4.93 114.94 114.58 1iku s ASN 179 Ca -0.17 2.02 0.03 0.00 0.04 0.00 0.00 52.86 54.79 1iku s ASN 179 Cb 0.06 -2.60 -0.25 0.00 -1.54 0.00 0.00 41.25 36.93 1iku s ASN 179 CO 0.62 -0.25 0.90 0.11 -3.04 0.00 0.00 177.10 175.44 1iku h LYS 180 N 5.55 0.12 0.55 0.43 1.57 -1.79 -3.26 116.57 119.74 1iku h LYS 180 Ca -0.43 -0.21 -0.03 0.00 -1.87 0.00 0.00 60.65 58.11 1iku h LYS 180 Cb 1.21 0.08 0.00 0.00 0.08 0.00 0.00 32.23 33.60 1iku h LYS 180 CO 0.74 0.93 -0.30 0.93 -0.57 0.00 0.00 179.45 181.18 1iku h GLU 181 N 0.03 -0.75 -0.80 3.15 4.39 -1.92 -1.65 114.58 117.03 1iku h GLU 181 Ca -0.20 0.05 0.19 0.00 0.34 0.00 0.00 59.36 59.75 1iku h GLU 181 Cb 1.95 0.17 -0.13 0.00 -0.10 0.00 0.00 28.75 30.64 1iku h GLU 181 CO 0.13 -0.50 0.10 0.82 -1.16 0.00 0.00 179.01 178.41 1iku h ILE 182 N -0.78 0.34 -0.80 3.13 2.04 -1.88 0.58 117.51 120.15 1iku h ILE 182 Ca -0.07 -0.05 0.12 0.00 1.00 0.00 0.00 64.86 65.86 1iku h ILE 182 Cb 0.61 0.17 -0.08 0.00 -0.74 0.00 0.00 36.82 36.78 1iku h ILE 182 CO 0.10 0.03 0.41 0.25 0.00 0.00 0.00 178.15 178.94 1iku h LEU 183 N 0.16 0.51 -0.85 1.44 5.85 -1.54 1.01 115.31 121.89 1iku h LEU 183 Ca 0.47 0.08 0.00 0.00 0.84 0.00 0.00 57.88 59.26 1iku h LEU 183 Cb 0.87 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.89 1iku h LEU 183 CO -0.65 0.25 0.00 -0.09 -0.34 0.00 0.00 178.44 177.61 1iku h ARG 184 N 0.63 0.00 0.00 1.25 2.43 0.11 0.40 114.38 119.19 1iku h ARG 184 Ca 0.42 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.59 1iku h ARG 184 Cb 0.53 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1iku h ARG 184 CO -0.32 0.00 -1.44 1.28 -1.51 0.00 0.00 179.97 177.98 1iku n LEU 185 N -2.67 0.47 -0.10 3.80 4.77 0.19 -4.52 117.00 118.94 1iku n LEU 185 Ca 0.02 0.17 -0.13 0.00 -0.03 0.00 0.00 56.01 56.04 1iku n LEU 185 Cb 0.31 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.33 1iku n LEU 185 CO 0.25 -0.09 -0.76 0.00 -1.33 0.00 0.00 177.39 175.46 1iku n ILE 186 N -2.46 1.49 -2.54 -0.08 0.00 0.29 -4.69 119.36 111.38 1iku n ILE 186 Ca -0.02 0.05 -0.42 0.00 0.00 0.00 0.00 62.75 62.37 1iku n ILE 186 Cb 0.55 -2.26 -0.01 0.00 0.00 0.00 0.00 39.64 37.92 1iku n ILE 186 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 176.55 174.97 1iku s GLN 187 N -2.71 3.80 -0.07 9.51 0.74 0.14 -4.81 119.66 126.26 1iku s GLN 187 Ca -0.29 -1.72 -0.35 0.00 0.05 0.00 0.00 55.36 53.06 1iku s GLN 187 Cb 0.06 -5.47 -0.17 0.00 1.10 0.00 0.00 33.01 28.53 1iku s GLN 187 CO 0.41 -2.35 0.98 0.34 -0.55 0.00 0.00 175.29 174.12 1iku n PHE 188 N 8.89 0.70 0.00 1.67 -0.00 -1.26 -4.73 117.46 122.73 1iku n PHE 188 Ca 0.45 0.90 0.00 0.00 -0.00 0.00 0.00 57.45 58.80 1iku n PHE 188 Cb 0.47 -1.78 0.00 0.00 -0.00 0.00 0.00 39.48 38.18 1iku n PHE 188 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 176.76 174.85