#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ik0 s GLY 2 N 0.00 1.61 1.13 3.03 0.00 -1.26 -4.99 107.32 106.85 1ik0 s GLY 2 Ca 0.00 -0.13 -0.17 0.00 0.00 0.00 0.00 44.72 44.43 1ik0 s GLY 2 CO 0.00 0.37 0.34 -1.55 0.00 0.00 0.00 173.10 172.26 1ik0 n PRO 3 N -3.86 -1.81 -2.88 2.90 -0.04 -1.26 -4.95 135.00 123.10 1ik0 n PRO 3 Ca 0.07 -0.51 -0.33 0.00 -0.04 0.00 0.00 63.50 62.69 1ik0 n PRO 3 Cb 0.56 -1.85 -0.07 0.00 -0.04 0.00 0.00 33.50 32.10 1ik0 n PRO 3 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1ik0 s VAL 4 N -2.30 4.44 0.97 0.52 -7.23 -1.26 -5.04 120.40 110.51 1ik0 s VAL 4 Ca 0.60 1.39 -0.11 0.00 -1.81 0.00 0.00 61.98 62.05 1ik0 s VAL 4 Cb -0.16 -3.61 0.17 0.00 0.56 0.00 0.00 36.38 33.34 1ik0 s VAL 4 CO 0.66 -0.28 1.09 -2.16 -0.31 0.00 0.00 175.10 174.10 1ik0 s PRO 5 N -3.11 0.65 0.23 4.82 0.04 -1.26 -4.76 135.00 131.60 1ik0 s PRO 5 Ca 0.60 1.05 -0.08 0.00 0.04 0.00 0.00 61.00 62.62 1ik0 s PRO 5 Cb -0.09 -1.72 0.25 0.00 0.04 0.00 0.00 34.50 32.97 1ik0 s PRO 5 CO 0.14 -2.73 1.86 -1.00 0.04 0.00 0.00 177.00 175.32 1ik0 h PRO 6 N -1.91 0.96 -0.93 0.56 0.13 -1.99 -2.06 132.00 126.75 1ik0 h PRO 6 Ca -0.51 -0.06 0.01 0.00 -0.87 0.00 0.00 66.00 64.58 1ik0 h PRO 6 Cb 1.29 -0.22 -0.05 0.00 0.13 0.00 0.00 31.00 32.16 1ik0 h PRO 6 CO 0.49 0.63 0.62 0.66 -0.23 0.00 0.00 178.00 180.18 1ik0 h SER 7 N 0.99 1.07 -0.29 1.44 4.64 -1.96 0.48 113.55 119.93 1ik0 h SER 7 Ca 0.33 -0.03 -0.07 0.00 -0.47 0.00 0.00 61.79 61.55 1ik0 h SER 7 Cb 0.04 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 1ik0 h SER 7 CO -0.12 0.78 -0.11 0.74 -0.87 0.00 0.00 176.83 177.25 1ik0 h THR 8 N 1.27 1.29 -0.85 2.95 2.02 -1.79 -1.48 112.91 116.32 1ik0 h THR 8 Ca 0.34 -1.18 -0.03 0.00 0.77 0.00 0.00 66.41 66.31 1ik0 h THR 8 Cb -0.14 1.46 -0.04 0.00 -1.74 0.00 0.00 68.15 67.69 1ik0 h THR 8 CO -0.07 0.37 0.40 0.00 0.37 0.00 0.00 175.52 176.59 1ik0 h ALA 9 N 0.76 1.10 0.25 6.16 0.00 -0.86 0.34 119.26 127.00 1ik0 h ALA 9 Ca 0.07 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1ik0 h ALA 9 Cb 0.61 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ik0 h ALA 9 CO 0.04 0.67 -0.12 1.25 0.00 0.00 0.00 179.25 181.08 1ik0 h LEU 10 N 1.21 -0.28 -0.50 0.00 7.12 -0.77 -0.53 115.31 121.57 1ik0 h LEU 10 Ca 0.29 -0.09 0.01 0.00 0.13 0.00 0.00 57.88 58.21 1ik0 h LEU 10 Cb 0.13 0.07 -0.02 0.00 -0.53 0.00 0.00 40.66 40.30 1ik0 h LEU 10 CO -0.04 -0.08 0.33 0.03 -0.13 0.00 0.00 178.44 178.56 1ik0 h ARG 11 N -0.48 0.65 -0.91 1.25 3.08 -1.07 -1.27 114.38 115.64 1ik0 h ARG 11 Ca -0.03 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 59.97 1ik0 h ARG 11 Cb 0.36 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 30.22 1ik0 h ARG 11 CO 0.06 0.43 0.53 0.93 -1.07 0.00 0.00 179.97 180.85 1ik0 h GLU 12 N 0.67 1.24 -0.36 0.04 5.08 -0.83 -0.73 114.58 119.69 1ik0 h GLU 12 Ca 0.18 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 1ik0 h GLU 12 Cb -0.08 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 28.91 1ik0 h GLU 12 CO -0.04 0.88 0.01 1.25 -1.00 0.00 0.00 179.01 180.11 1ik0 h LEU 13 N 1.26 0.62 -0.02 1.33 5.85 -0.58 -0.88 115.31 122.88 1ik0 h LEU 13 Ca 0.32 -0.30 0.00 0.00 0.84 0.00 0.00 57.88 58.74 1ik0 h LEU 13 Cb -0.02 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 40.84 1ik0 h LEU 13 CO -0.06 0.77 0.01 0.40 -0.34 0.00 0.00 178.44 179.22 1ik0 h ILE 14 N 0.45 1.01 -0.98 4.05 2.04 -0.80 0.92 117.51 124.19 1ik0 h ILE 14 Ca 0.10 -0.01 0.01 0.00 1.00 0.00 0.00 64.86 65.96 1ik0 h ILE 14 Cb 0.44 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.45 1ik0 h ILE 14 CO 0.02 0.01 0.65 -0.33 0.00 0.00 0.00 178.15 178.49 1ik0 h GLU 15 N 0.03 1.29 -0.19 2.37 5.08 -1.03 -1.24 114.58 120.89 1ik0 h GLU 15 Ca 0.01 -0.08 -0.16 0.00 -1.00 0.00 0.00 59.36 58.13 1ik0 h GLU 15 Cb -0.00 -0.29 0.00 0.00 0.50 0.00 0.00 28.75 28.96 1ik0 h GLU 15 CO -0.00 0.85 -0.49 1.49 -1.00 0.00 0.00 179.01 179.86 1ik0 h GLU 16 N 1.33 0.67 -0.37 2.33 4.81 -0.83 -1.91 114.58 120.62 1ik0 h GLU 16 Ca 0.36 -0.47 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1ik0 h GLU 16 Cb -0.15 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1ik0 h GLU 16 CO -0.08 1.09 0.24 -0.07 -0.73 0.00 0.00 179.01 179.46 1ik0 h LEU 17 N 0.37 0.42 -0.69 1.64 3.38 -0.52 -2.36 115.31 117.55 1ik0 h LEU 17 Ca -0.01 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.88 1ik0 h LEU 17 Cb 1.10 -0.10 -0.03 0.00 0.09 0.00 0.00 40.66 41.72 1ik0 h LEU 17 CO 0.11 0.30 0.13 0.58 0.09 0.00 0.00 178.44 179.65 1ik0 h VAL 18 N 0.49 1.26 -1.00 1.22 2.07 -1.24 -2.70 116.25 116.36 1ik0 h VAL 18 Ca 0.13 -1.03 0.01 0.00 0.82 0.00 0.00 66.70 66.64 1ik0 h VAL 18 Cb -0.06 0.59 -0.05 0.00 -1.52 0.00 0.00 31.29 30.26 1ik0 h VAL 18 CO -0.03 0.39 0.67 0.78 0.02 0.00 0.00 177.57 179.39 1ik0 h ASN 19 N 1.06 1.15 1.51 0.57 -0.26 -0.96 -0.99 115.58 117.67 1ik0 h ASN 19 Ca 0.21 -0.03 0.00 0.00 -0.56 0.00 0.00 56.30 55.92 1ik0 h ASN 19 Cb 0.42 -0.29 0.00 0.00 -1.06 0.00 0.00 38.32 37.40 1ik0 h ASN 19 CO 0.01 0.83 0.00 0.16 -1.06 0.00 0.00 177.43 177.37 1ik0 h ILE 20 N 1.36 0.00 0.00 2.81 3.07 -1.26 -3.29 117.51 120.20 1ik0 h ILE 20 Ca 0.37 -0.56 0.00 0.00 1.55 0.00 0.00 64.86 66.21 1ik0 h ILE 20 Cb -0.16 1.54 0.00 0.00 -0.27 0.00 0.00 36.82 37.93 1ik0 h ILE 20 CO -0.08 0.00 -1.89 0.35 -1.05 0.00 0.00 178.15 175.48 1ik0 n THR 21 N -2.45 0.06 0.05 0.16 -2.24 -0.82 -3.85 114.28 105.19 1ik0 n THR 21 Ca 0.05 -0.50 -0.20 0.00 -2.27 0.00 0.00 64.05 61.12 1ik0 n THR 21 Cb 0.43 -0.02 -0.11 0.00 -2.10 0.00 0.00 70.33 68.53 1ik0 n THR 21 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 1ik0 h GLN 22 N 0.00 0.70 -0.62 -0.78 4.20 -1.27 -3.27 115.11 114.06 1ik0 h GLN 22 Ca 0.00 -0.77 0.00 0.00 0.06 0.00 0.00 58.65 57.94 1ik0 h GLN 22 Cb 0.99 0.22 0.00 0.00 0.30 0.00 0.00 27.48 29.00 1ik0 h GLN 22 CO 0.00 1.33 0.00 0.09 -0.67 0.00 0.00 178.83 179.58 1ik0 n ASN 23 N -3.85 3.32 -4.72 1.46 3.02 -1.25 -4.92 115.26 108.32 1ik0 n ASN 23 Ca -0.11 -2.01 -0.41 0.00 -0.03 0.00 0.00 54.58 52.02 1ik0 n ASN 23 Cb 0.89 -0.42 -0.04 0.00 -0.61 0.00 0.00 39.78 39.61 1ik0 n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ik0 s GLN 24 N -1.19 4.56 0.00 3.52 -2.07 -1.24 -4.98 119.66 118.26 1ik0 s GLN 24 Ca 0.41 1.30 0.00 0.00 -1.82 0.00 0.00 55.36 55.25 1ik0 s GLN 24 Cb 0.22 -3.43 0.00 0.00 -1.09 0.00 0.00 33.01 28.70 1ik0 s GLN 24 CO 0.28 0.06 0.00 1.17 -1.32 0.00 0.00 175.29 175.47 1ik0 n LYS 25 N 3.54 0.00 -2.18 9.60 4.81 -1.26 -4.93 118.16 127.75 1ik0 n LYS 25 Ca 0.03 0.08 -0.28 0.00 -0.87 0.00 0.00 58.31 57.27 1ik0 n LYS 25 Cb 0.51 -0.48 0.03 0.00 0.02 0.00 0.00 35.03 35.10 1ik0 n LYS 25 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ik0 s ALA 26 N -3.98 3.15 1.02 3.14 0.00 -1.26 -5.02 121.76 118.81 1ik0 s ALA 26 Ca 0.00 -0.47 -0.22 0.00 0.00 0.00 0.00 51.96 51.27 1ik0 s ALA 26 Cb 0.00 -2.81 -0.09 0.00 0.00 0.00 0.00 23.12 20.22 1ik0 s ALA 26 CO 0.00 -0.85 -0.80 -2.30 0.00 0.00 0.00 175.76 171.81 1ik0 n PRO 27 N -2.71 -0.43 0.00 0.00 -0.02 -1.26 -4.75 135.00 125.83 1ik0 n PRO 27 Ca 0.05 -0.12 0.06 0.00 -2.02 0.00 0.00 63.50 61.47 1ik0 n PRO 27 Cb 0.57 -1.27 0.28 0.00 -0.02 0.00 0.00 33.50 33.06 1ik0 n PRO 27 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1ik0 n LEU 28 N 1.70 0.00 0.00 2.45 4.77 -1.26 -4.77 117.00 119.89 1ik0 n LEU 28 Ca -0.00 0.43 -0.16 0.00 -0.03 0.00 0.00 56.01 56.25 1ik0 n LEU 28 Cb 0.66 -0.43 -0.04 0.00 -2.33 0.00 0.00 43.42 41.27 1ik0 n LEU 28 CO 0.48 -0.25 0.09 0.00 -1.33 0.00 0.00 177.39 176.38 1ik0 n ASN 30 N -1.66 1.85 -0.66 0.00 5.03 -1.26 -4.24 115.26 114.32 1ik0 n ASN 30 Ca 0.03 -1.68 -0.06 0.00 0.87 0.00 0.00 54.58 53.73 1ik0 n ASN 30 Cb 0.58 -0.45 -0.01 0.00 -1.02 0.00 0.00 39.78 38.88 1ik0 n ASN 30 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ik0 n GLY 31 N 2.36 0.36 3.78 7.41 0.00 -1.26 -4.96 105.19 112.87 1ik0 n GLY 31 Ca 0.08 -0.66 -0.41 0.00 0.00 0.00 0.00 46.02 45.03 1ik0 n GLY 31 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1ik0 n SER 32 N 0.82 3.86 -4.72 1.61 7.64 -1.26 -4.86 113.62 116.71 1ik0 n SER 32 Ca -0.07 1.23 -0.27 0.00 1.01 0.00 0.00 58.87 60.76 1ik0 n SER 32 Cb 0.44 -1.63 -0.07 0.00 -1.01 0.00 0.00 64.21 61.95 1ik0 n SER 32 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 1ik0 s MET 33 N -2.10 2.62 0.18 1.43 -1.94 -1.26 -2.51 119.30 115.71 1ik0 s MET 33 Ca 0.53 -0.96 0.05 0.00 -1.71 0.00 0.00 55.69 53.60 1ik0 s MET 33 Cb -0.47 -2.50 -0.05 0.00 2.01 0.00 0.00 34.83 33.82 1ik0 s MET 33 CO 0.64 0.48 -0.09 0.14 -0.01 0.00 0.00 175.02 176.18 1ik0 s VAL 34 N -1.65 1.31 0.06 -6.03 -7.23 0.13 -4.85 120.40 102.14 1ik0 s VAL 34 Ca 0.28 -2.10 -0.31 0.00 -1.81 0.00 0.00 61.98 58.05 1ik0 s VAL 34 Cb -0.10 -2.01 -0.06 0.00 0.56 0.00 0.00 36.38 34.77 1ik0 s VAL 34 CO 0.20 -0.62 1.25 0.26 -0.31 0.00 0.00 175.10 175.88 1ik0 s TRP 35 N -3.24 3.35 0.55 2.82 0.52 -1.26 -0.05 118.94 121.62 1ik0 s TRP 35 Ca 0.21 1.19 -0.19 0.00 0.02 0.00 0.00 56.10 57.33 1ik0 s TRP 35 Cb 0.02 -3.49 -0.05 0.00 -1.15 0.00 0.00 33.47 28.80 1ik0 s TRP 35 CO 0.04 -1.58 1.11 -1.54 0.02 0.00 0.00 176.95 175.00 1ik0 s SER 36 N 1.15 5.73 0.20 2.95 1.04 -0.97 -4.88 113.70 118.92 1ik0 s SER 36 Ca 0.60 2.11 0.03 0.00 0.48 0.00 0.00 55.95 59.16 1ik0 s SER 36 Cb -0.31 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.19 1ik0 s SER 36 CO 0.29 -1.21 -0.00 0.27 0.98 0.00 0.00 173.24 173.57 1ik0 s ILE 37 N -1.90 0.86 -0.24 -1.02 -4.36 -1.26 -4.80 121.20 108.49 1ik0 s ILE 37 Ca 0.71 -2.01 -0.23 0.00 -0.26 0.00 0.00 60.65 58.85 1ik0 s ILE 37 Cb -0.22 -2.23 -0.01 0.00 1.25 0.00 0.00 42.46 41.24 1ik0 s ILE 37 CO 0.28 -0.40 0.77 0.21 0.24 0.00 0.00 174.94 176.05 1ik0 s ASN 38 N -3.24 6.78 -0.43 4.36 3.04 -1.26 -4.99 114.94 119.20 1ik0 s ASN 38 Ca 0.26 0.97 -0.29 0.00 0.04 0.00 0.00 52.86 53.84 1ik0 s ASN 38 Cb 0.06 -2.41 0.02 0.00 -1.54 0.00 0.00 41.25 37.38 1ik0 s ASN 38 CO 0.06 -0.46 1.16 -0.76 -3.04 0.00 0.00 177.10 174.07 1ik0 s LEU 39 N 2.65 3.71 0.00 3.21 2.01 -1.26 -4.86 118.68 124.13 1ik0 s LEU 39 Ca 0.33 0.67 0.00 0.00 0.01 0.00 0.00 54.13 55.14 1ik0 s LEU 39 Cb -0.15 -3.55 0.00 0.00 0.01 0.00 0.00 46.19 42.50 1ik0 s LEU 39 CO 0.08 -1.19 0.00 0.35 1.01 0.00 0.00 176.35 176.61 1ik0 n THR 40 N 6.63 0.00 0.00 5.49 -2.24 -1.26 -5.07 114.28 117.83 1ik0 n THR 40 Ca 0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 1ik0 n THR 40 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1ik0 n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ik0 n ALA 41 N -3.00 0.00 -0.26 6.98 0.00 -1.26 -4.45 120.51 118.52 1ik0 n ALA 41 Ca 0.00 -0.01 -0.04 0.00 0.00 0.00 0.00 53.44 53.39 1ik0 n ALA 41 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 1ik0 n ALA 41 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ik0 n GLY 42 N 2.45 1.58 0.34 0.00 0.00 -1.26 -4.38 105.19 103.92 1ik0 n GLY 42 Ca 0.00 -0.31 -0.04 0.00 0.00 0.00 0.00 46.02 45.66 1ik0 n GLY 42 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1ik0 h MET 43 N 5.41 1.11 -0.24 1.61 0.00 -1.91 -2.51 114.93 118.40 1ik0 h MET 43 Ca 0.06 -0.19 0.00 0.00 0.00 0.00 0.00 59.70 59.58 1ik0 h MET 43 Cb 0.36 -0.19 -0.01 0.00 0.00 0.00 0.00 31.60 31.76 1ik0 h MET 43 CO 0.50 0.89 0.16 1.88 0.00 0.00 0.00 176.91 180.34 1ik0 h TYR 44 N 1.09 0.30 -0.01 -0.22 -1.99 -1.91 0.68 116.97 114.91 1ik0 h TYR 44 Ca 0.25 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 60.99 1ik0 h TYR 44 Cb 0.19 -0.10 -0.00 0.00 2.00 0.00 0.00 36.73 38.82 1ik0 h TYR 44 CO 0.02 0.19 0.00 0.00 -0.00 0.00 0.00 178.16 178.36 1ik0 h ALA 46 N 0.72 0.67 -0.84 0.00 0.00 -1.33 -2.08 119.26 116.40 1ik0 h ALA 46 Ca 0.00 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.83 1ik0 h ALA 46 Cb 0.29 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1ik0 h ALA 46 CO 0.00 0.12 0.39 0.00 0.00 0.00 0.00 179.25 179.75 1ik0 h ALA 47 N 1.19 1.08 0.03 0.00 0.00 0.52 -2.78 119.26 119.29 1ik0 h ALA 47 Ca 0.19 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ik0 h ALA 47 Cb -0.07 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.39 1ik0 h ALA 47 CO -0.04 0.66 -0.01 1.25 0.00 0.00 0.00 179.25 181.11 1ik0 h LEU 48 N 1.20 -0.03 -1.28 0.00 5.85 0.10 -2.23 115.31 118.92 1ik0 h LEU 48 Ca 0.28 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.01 1ik0 h LEU 48 Cb 0.14 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.14 1ik0 h LEU 48 CO -0.03 -0.02 0.49 1.05 -0.34 0.00 0.00 178.44 179.59 1ik0 h GLU 49 N -0.04 0.97 -0.82 1.25 4.11 -1.31 -0.75 114.58 118.00 1ik0 h GLU 49 Ca -0.00 -0.06 -0.02 0.00 0.07 0.00 0.00 59.36 59.35 1ik0 h GLU 49 Cb 0.03 -0.22 -0.04 0.00 0.50 0.00 0.00 28.75 29.02 1ik0 h GLU 49 CO 0.01 0.64 0.44 0.66 0.07 0.00 0.00 179.01 180.83 1ik0 h SER 50 N 1.00 1.02 -0.41 3.06 4.64 -1.20 -2.13 113.55 119.53 1ik0 h SER 50 Ca 0.27 -0.09 -0.13 0.00 -0.47 0.00 0.00 61.79 61.37 1ik0 h SER 50 Cb -0.12 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.70 1ik0 h SER 50 CO -0.06 0.82 -0.25 -0.07 -0.87 0.00 0.00 176.83 176.40 1ik0 h LEU 51 N 1.14 0.96 -1.08 5.97 3.38 -0.63 -2.48 115.31 122.57 1ik0 h LEU 51 Ca 0.29 -0.38 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1ik0 h LEU 51 Cb 0.04 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.52 1ik0 h LEU 51 CO -0.05 1.15 0.24 0.40 0.09 0.00 0.00 178.44 180.28 1ik0 h ILE 52 N 0.79 0.00 0.00 1.22 1.08 -0.49 1.04 117.51 121.16 1ik0 h ILE 52 Ca 0.10 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.57 1ik0 h ILE 52 Cb 0.82 0.36 0.00 0.00 -3.07 0.00 0.00 36.82 34.93 1ik0 h ILE 52 CO 0.07 0.00 -0.32 0.59 -0.69 0.00 0.00 178.15 177.80 1ik0 n ASN 53 N -2.16 0.55 -4.69 1.72 3.02 -0.93 -4.77 115.26 107.99 1ik0 n ASN 53 Ca -0.01 0.23 -0.39 0.00 -0.03 0.00 0.00 54.58 54.39 1ik0 n ASN 53 Cb 0.26 -0.19 -0.06 0.00 -0.61 0.00 0.00 39.78 39.18 1ik0 n ASN 53 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ik0 s VAL 54 N -3.08 5.14 0.08 2.41 1.01 0.36 -5.07 120.40 121.25 1ik0 s VAL 54 Ca 0.10 0.98 0.06 0.00 0.00 0.00 0.00 61.98 63.12 1ik0 s VAL 54 Cb 0.15 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 1ik0 s VAL 54 CO 0.65 0.25 -0.16 -0.44 0.00 0.00 0.00 175.10 175.40 1ik0 s SER 55 N 0.88 1.91 0.00 3.32 0.01 -1.26 -4.81 113.70 113.75 1ik0 s SER 55 Ca 0.26 -0.63 0.00 0.00 1.31 0.00 0.00 55.95 56.89 1ik0 s SER 55 Cb -0.15 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.00 1ik0 s SER 55 CO 0.10 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.33 1ik0 n GLY 56 N 1.24 0.83 2.62 3.44 0.00 -1.26 -5.04 105.19 107.01 1ik0 n GLY 56 Ca -0.21 -0.63 -0.23 0.00 0.00 0.00 0.00 46.02 44.96 1ik0 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ik0 h SER 58 N 7.26 0.00 -0.68 0.00 0.87 -1.96 -3.06 113.55 115.97 1ik0 h SER 58 Ca 0.02 0.00 0.10 0.00 -1.23 0.00 0.00 61.79 60.68 1ik0 h SER 58 Cb 1.02 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.93 1ik0 h SER 58 CO 0.26 0.28 0.45 0.00 -0.53 0.00 0.00 176.83 177.29 1ik0 h ALA 59 N 1.72 1.95 -0.01 6.23 0.00 -1.93 -2.08 119.26 125.13 1ik0 h ALA 59 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ik0 h ALA 59 Cb 0.72 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.40 1ik0 h ALA 59 CO 0.04 -0.10 -0.49 0.44 0.00 0.00 0.00 179.25 179.14 1ik0 n ILE 60 N -4.48 0.00 -0.36 0.00 -5.35 -1.16 -4.30 119.36 103.71 1ik0 n ILE 60 Ca 0.11 -0.22 -0.03 0.00 -0.27 0.00 0.00 62.75 62.35 1ik0 n ILE 60 Cb 0.38 1.12 0.10 0.00 -1.74 0.00 0.00 39.64 39.49 1ik0 n ILE 60 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 1ik0 h GLU 61 N 2.08 1.25 -0.84 6.28 5.08 -1.39 -0.47 114.58 126.57 1ik0 h GLU 61 Ca 0.00 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.24 1ik0 h GLU 61 Cb 0.70 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 29.64 1ik0 h GLU 61 CO 0.00 0.83 0.38 0.87 -1.00 0.00 0.00 179.01 180.10 1ik0 h LYS 62 N 1.29 1.22 -1.00 2.33 1.57 -1.75 -2.11 116.57 118.12 1ik0 h LYS 62 Ca 0.35 -0.19 0.01 0.00 -1.87 0.00 0.00 60.65 58.94 1ik0 h LYS 62 Cb -0.14 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 31.91 1ik0 h LYS 62 CO -0.07 0.95 0.66 1.15 -0.57 0.00 0.00 179.45 181.57 1ik0 h THR 63 N 1.20 1.25 -0.82 -0.16 2.02 -1.37 -1.97 112.91 113.06 1ik0 h THR 63 Ca 0.29 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1ik0 h THR 63 Cb 0.15 -0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 66.31 1ik0 h THR 63 CO -0.03 0.25 0.52 1.56 0.37 0.00 0.00 175.52 178.18 1ik0 h GLN 64 N 1.35 1.10 -0.07 6.66 4.20 -0.49 -0.41 115.11 127.45 1ik0 h GLN 64 Ca 0.37 -0.08 -0.00 0.00 0.06 0.00 0.00 58.65 58.99 1ik0 h GLN 64 Cb -0.15 -0.24 -0.00 0.00 0.30 0.00 0.00 27.48 27.38 1ik0 h GLN 64 CO -0.08 0.75 0.03 -0.09 -0.67 0.00 0.00 178.83 178.77 1ik0 h ARG 65 N 1.12 0.10 -0.91 1.46 2.43 -1.07 0.30 114.38 117.81 1ik0 h ARG 65 Ca 0.30 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.46 1ik0 h ARG 65 Cb -0.09 -0.02 -0.04 0.00 -0.42 0.00 0.00 29.97 29.40 1ik0 h ARG 65 CO -0.06 0.19 0.60 0.52 -1.51 0.00 0.00 179.97 179.71 1ik0 h MET 66 N -0.01 1.20 -0.70 0.20 2.86 -1.13 -1.53 114.93 115.83 1ik0 h MET 66 Ca 0.02 -0.07 -0.08 0.00 -2.06 0.00 0.00 59.70 57.52 1ik0 h MET 66 Cb 0.12 -0.27 -0.03 0.00 0.06 0.00 0.00 31.60 31.48 1ik0 h MET 66 CO -0.00 0.80 0.14 -0.07 1.06 0.00 0.00 176.91 178.83 1ik0 h LEU 67 N 1.23 1.08 -1.08 1.22 3.38 -0.70 -2.56 115.31 117.89 1ik0 h LEU 67 Ca 0.33 -0.25 0.04 0.00 0.09 0.00 0.00 57.88 58.10 1ik0 h LEU 67 Cb -0.14 -0.29 -0.06 0.00 0.09 0.00 0.00 40.66 40.27 1ik0 h LEU 67 CO -0.07 1.05 0.62 0.28 0.09 0.00 0.00 178.44 180.41 1ik0 h SER 68 N 1.07 1.02 -0.99 -0.43 0.02 0.54 -0.24 113.55 114.54 1ik0 h SER 68 Ca 0.21 -0.01 0.29 0.00 -0.84 0.00 0.00 61.79 61.44 1ik0 h SER 68 Cb 0.41 -0.23 -0.04 0.00 0.14 0.00 0.00 62.40 62.68 1ik0 h SER 68 CO 0.01 0.70 0.72 1.23 -1.14 0.00 0.00 176.83 178.34 1ik0 h GLY 69 N 1.18 0.00 -0.73 -3.77 0.00 -0.91 1.71 103.07 100.54 1ik0 h GLY 69 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.71 1ik0 h GLY 69 CO -0.12 0.00 -0.12 0.69 0.00 0.00 0.00 176.54 176.99 1ik0 n PHE 70 N -4.23 0.00 -3.53 5.60 3.72 -0.13 -4.57 117.46 114.32 1ik0 n PHE 70 Ca 0.21 0.00 -0.28 0.00 -0.05 0.00 0.00 57.45 57.33 1ik0 n PHE 70 Cb 1.06 -0.03 -0.11 0.00 -0.94 0.00 0.00 39.48 39.46 1ik0 n PHE 70 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ik0 h PRO 72 N 5.98 0.00 -5.58 0.00 0.11 -1.80 -3.40 132.00 127.30 1ik0 h PRO 72 Ca 0.18 0.00 -0.60 0.00 0.11 0.00 0.00 66.00 65.68 1ik0 h PRO 72 Cb 0.90 0.00 -0.11 0.00 0.11 0.00 0.00 31.00 31.90 1ik0 h PRO 72 CO 0.43 0.00 0.17 -3.38 -0.21 0.00 0.00 178.00 175.00 1ik0 s HIS 73 N -4.27 3.32 0.34 0.65 -3.43 -1.26 -5.04 115.29 105.60 1ik0 s HIS 73 Ca -0.04 0.88 -0.26 0.00 -0.80 0.00 0.00 55.06 54.84 1ik0 s HIS 73 Cb 0.12 -2.84 -0.10 0.00 -1.43 0.00 0.00 32.58 28.33 1ik0 s HIS 73 CO 0.39 -0.28 0.99 0.15 -2.00 0.00 0.00 174.74 173.99 1ik0 s LYS 74 N 2.32 4.47 -0.13 -0.38 -0.14 -1.26 -5.05 119.74 119.57 1ik0 s LYS 74 Ca 0.28 1.43 0.01 0.00 -1.36 0.00 0.00 55.97 56.32 1ik0 s LYS 74 Cb -0.16 -2.76 -0.01 0.00 -1.68 0.00 0.00 37.83 33.22 1ik0 s LYS 74 CO 0.09 0.15 -0.16 0.14 -0.76 0.00 0.00 175.35 174.82 1ik0 s VAL 75 N -1.58 2.81 0.44 3.17 -7.23 -1.26 -5.07 120.40 111.67 1ik0 s VAL 75 Ca 0.52 -0.75 0.03 0.00 -1.81 0.00 0.00 61.98 59.97 1ik0 s VAL 75 Cb -0.21 -2.16 0.01 0.00 0.56 0.00 0.00 36.38 34.58 1ik0 s VAL 75 CO 0.27 0.53 0.62 -0.55 -0.31 0.00 0.00 175.10 175.66 1ik0 s SER 76 N 0.38 5.72 0.00 4.85 0.15 -1.25 -4.93 113.70 118.62 1ik0 s SER 76 Ca -0.12 -0.01 0.04 0.00 0.70 0.00 0.00 55.95 56.55 1ik0 s SER 76 Cb -0.16 -1.18 0.22 0.00 -1.71 0.00 0.00 66.02 63.19 1ik0 s SER 76 CO 0.06 -0.73 0.89 0.00 1.20 0.00 0.00 173.24 174.65 1ik0 n ALA 77 N -1.98 1.47 -0.06 5.45 0.00 -1.26 -1.60 120.51 122.53 1ik0 n ALA 77 Ca 0.03 -0.02 -0.05 0.00 0.00 0.00 0.00 53.44 53.40 1ik0 n ALA 77 Cb 0.58 -1.07 -0.09 0.00 0.00 0.00 0.00 19.45 18.88 1ik0 n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ik0 n GLY 78 N -0.88 -0.57 3.63 0.00 0.00 -1.26 -4.93 105.19 101.17 1ik0 n GLY 78 Ca 0.02 -0.20 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 1ik0 n GLY 78 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1ik0 s GLN 79 N -2.29 4.10 0.09 1.61 -0.21 -0.63 -5.06 119.66 117.28 1ik0 s GLN 79 Ca -0.06 0.39 0.06 0.00 0.02 0.00 0.00 55.36 55.77 1ik0 s GLN 79 Cb 0.04 -3.64 -0.03 0.00 1.00 0.00 0.00 33.01 30.38 1ik0 s GLN 79 CO 0.47 -0.33 -0.15 -0.06 -2.12 0.00 0.00 175.29 173.10 1ik0 s PHE 80 N 2.25 1.34 0.00 0.91 0.08 -1.26 -3.97 117.98 117.32 1ik0 s PHE 80 Ca 0.23 -0.50 0.00 0.00 0.12 0.00 0.00 56.93 56.78 1ik0 s PHE 80 Cb -0.16 -0.73 0.00 0.00 -0.57 0.00 0.00 43.02 41.57 1ik0 s PHE 80 CO 0.09 0.10 0.00 0.43 -0.10 0.00 0.00 175.22 175.74 1ik0 n SER 81 N 0.96 3.48 -0.77 1.36 7.64 -1.26 -4.82 113.62 120.20 1ik0 n SER 81 Ca -0.19 0.00 0.09 0.00 1.01 0.00 0.00 58.87 59.78 1ik0 n SER 81 Cb 0.55 0.00 0.10 0.00 -1.01 0.00 0.00 64.21 63.86 1ik0 n SER 81 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1ik0 n SER 82 N -2.36 2.66 -0.46 6.43 2.88 -1.26 -4.41 113.62 117.10 1ik0 n SER 82 Ca 0.00 -1.79 0.03 0.00 -1.33 0.00 0.00 58.87 55.78 1ik0 n SER 82 Cb 0.43 -0.06 0.09 0.00 -0.75 0.00 0.00 64.21 63.92 1ik0 n SER 82 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 1ik0 n LEU 83 N 1.03 1.27 0.03 2.46 7.99 -1.26 -3.87 117.00 124.65 1ik0 n LEU 83 Ca 0.12 -0.64 -0.11 0.00 -0.01 0.00 0.00 56.01 55.37 1ik0 n LEU 83 Cb 0.46 -0.22 0.01 0.00 -0.11 0.00 0.00 43.42 43.56 1ik0 n LEU 83 CO 0.11 0.27 0.34 0.45 -1.51 0.00 0.00 177.39 177.06 1ik0 h HIS 84 N 1.05 0.67 -4.18 -1.77 3.86 -1.94 -3.44 115.15 109.39 1ik0 h HIS 84 Ca 0.00 -0.29 -0.49 0.00 -1.16 0.00 0.00 60.37 58.43 1ik0 h HIS 84 Cb 0.39 -0.11 0.05 0.00 1.06 0.00 0.00 27.41 28.81 1ik0 h HIS 84 CO 0.16 1.06 0.38 0.14 0.86 0.00 0.00 177.93 180.53 1ik0 s VAL 85 N -3.67 3.94 -1.25 2.45 -7.23 -1.25 -4.95 120.40 108.45 1ik0 s VAL 85 Ca -0.07 0.95 -0.10 0.00 -1.81 0.00 0.00 61.98 60.96 1ik0 s VAL 85 Cb 0.10 -3.45 0.18 0.00 0.56 0.00 0.00 36.38 33.77 1ik0 s VAL 85 CO 0.85 -0.51 1.75 0.54 -0.31 0.00 0.00 175.10 177.42 1ik0 n ARG 86 N -1.84 3.66 -2.04 4.82 1.74 -1.26 -4.99 116.66 116.75 1ik0 n ARG 86 Ca 0.08 -3.70 -0.28 0.00 -0.77 0.00 0.00 57.85 53.19 1ik0 n ARG 86 Cb 0.53 -2.90 0.07 0.00 -1.02 0.00 0.00 32.46 29.14 1ik0 n ARG 86 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ik0 s ASP 87 N 0.97 4.86 0.15 0.55 1.01 -1.26 -5.06 116.67 117.89 1ik0 s ASP 87 Ca 0.39 0.73 -0.08 0.00 0.71 0.00 0.00 52.55 54.30 1ik0 s ASP 87 Cb 0.07 -1.37 -0.06 0.00 1.01 0.00 0.00 42.92 42.56 1ik0 s ASP 87 CO 0.01 -1.64 0.45 -0.89 0.21 0.00 0.00 175.17 173.31 1ik0 s THR 88 N -3.38 5.05 0.32 -1.27 2.01 -1.26 -4.85 115.64 112.26 1ik0 s THR 88 Ca 0.60 0.34 -0.21 0.00 0.31 0.00 0.00 61.69 62.74 1ik0 s THR 88 Cb -0.11 -3.64 -0.10 0.00 0.01 0.00 0.00 72.50 68.67 1ik0 s THR 88 CO 0.48 0.09 0.84 -0.54 -0.69 0.00 0.00 174.62 174.80 1ik0 s LYS 89 N -2.44 4.28 0.17 4.92 1.02 -1.26 -2.29 119.74 124.14 1ik0 s LYS 89 Ca 0.40 1.01 0.04 0.00 0.02 0.00 0.00 55.97 57.44 1ik0 s LYS 89 Cb -0.13 -2.58 -0.05 0.00 -0.52 0.00 0.00 37.83 34.55 1ik0 s LYS 89 CO 0.21 0.21 -0.06 0.96 -0.92 0.00 0.00 175.35 175.74 1ik0 s ILE 90 N -1.81 1.04 0.49 2.17 -4.36 0.92 -4.86 121.20 114.78 1ik0 s ILE 90 Ca 0.52 -2.03 -0.23 0.00 -0.26 0.00 0.00 60.65 58.65 1ik0 s ILE 90 Cb -0.14 -1.98 -0.07 0.00 1.25 0.00 0.00 42.46 41.52 1ik0 s ILE 90 CO 0.19 -0.63 1.23 -1.61 0.24 0.00 0.00 174.94 174.37 1ik0 s GLU 91 N -3.80 3.56 0.26 0.37 2.02 -1.26 0.20 118.70 120.05 1ik0 s GLU 91 Ca 0.20 1.94 -0.03 0.00 0.02 0.00 0.00 54.97 57.10 1ik0 s GLU 91 Cb 0.04 -2.37 0.39 0.00 0.10 0.00 0.00 34.13 32.28 1ik0 s GLU 91 CO 0.02 -0.76 1.89 0.28 0.02 0.00 0.00 175.26 176.71 1ik0 h VAL 92 N 1.76 1.12 -1.00 2.63 2.07 -1.82 -1.10 116.25 119.91 1ik0 h VAL 92 Ca -0.50 -0.41 0.17 0.00 0.82 0.00 0.00 66.70 66.77 1ik0 h VAL 92 Cb 1.26 -0.20 -0.10 0.00 -1.52 0.00 0.00 31.29 30.74 1ik0 h VAL 92 CO 0.59 0.22 0.61 0.00 0.02 0.00 0.00 177.57 179.01 1ik0 h ALA 93 N 1.44 1.60 -0.02 1.67 0.00 -1.90 0.15 119.26 122.20 1ik0 h ALA 93 Ca 0.42 0.06 -0.21 0.00 0.00 0.00 0.00 54.91 55.19 1ik0 h ALA 93 Cb 0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ik0 h ALA 93 CO -0.16 0.04 -0.87 1.96 0.00 0.00 0.00 179.25 180.22 1ik0 h GLN 94 N 0.83 0.37 -0.01 0.00 4.20 -1.60 -2.85 115.11 116.05 1ik0 h GLN 94 Ca 0.55 -0.37 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1ik0 h GLN 94 Cb 0.76 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 28.64 1ik0 h GLN 94 CO -0.35 1.04 0.01 0.35 -0.67 0.00 0.00 178.83 179.22 1ik0 h PHE 95 N 0.22 0.02 -0.20 2.96 3.04 0.12 0.12 116.94 123.22 1ik0 h PHE 95 Ca -0.06 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.88 1ik0 h PHE 95 Cb 1.49 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.98 1ik0 h PHE 95 CO 0.05 0.01 0.10 0.28 -2.02 0.00 0.00 178.31 176.73 1ik0 h VAL 96 N 0.02 1.13 -0.43 1.41 2.07 -1.09 -1.45 116.25 117.91 1ik0 h VAL 96 Ca 0.01 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1ik0 h VAL 96 Cb -0.00 1.01 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 1ik0 h VAL 96 CO -0.00 0.13 0.28 0.11 0.02 0.00 0.00 177.57 178.10 1ik0 h LYS 97 N 0.20 0.57 -0.83 1.57 1.57 -1.33 0.46 116.57 118.77 1ik0 h LYS 97 Ca 0.07 -0.04 0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1ik0 h LYS 97 Cb 0.11 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.26 1ik0 h LYS 97 CO -0.01 0.40 0.55 -0.44 -0.57 0.00 0.00 179.45 179.38 1ik0 h ASP 98 N 0.58 0.95 -0.54 0.86 3.32 -0.81 -1.73 116.42 119.06 1ik0 h ASP 98 Ca 0.16 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.12 1ik0 h ASP 98 Cb -0.05 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.24 1ik0 h ASP 98 CO -0.03 0.69 0.11 0.25 -1.72 0.00 0.00 179.24 178.54 1ik0 h LEU 99 N 1.13 0.88 -0.66 1.55 5.85 -0.68 -2.96 115.31 120.41 1ik0 h LEU 99 Ca 0.30 -0.18 0.08 0.00 0.84 0.00 0.00 57.88 58.92 1ik0 h LEU 99 Cb -0.13 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.60 1ik0 h LEU 99 CO -0.07 0.87 0.33 0.25 -0.34 0.00 0.00 178.44 179.48 1ik0 h LEU 100 N 0.88 0.43 -0.63 2.25 5.85 0.01 -0.44 115.31 123.67 1ik0 h LEU 100 Ca 0.18 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.96 1ik0 h LEU 100 Cb 0.36 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.34 1ik0 h LEU 100 CO 0.01 0.26 0.42 -0.07 -0.34 0.00 0.00 178.44 178.71 1ik0 h LEU 101 N 0.58 0.72 -0.55 2.25 -0.00 -1.34 -2.71 115.31 114.26 1ik0 h LEU 101 Ca 0.32 -0.02 -0.15 0.00 -0.00 0.00 0.00 57.88 58.03 1ik0 h LEU 101 Cb 0.30 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 40.78 1ik0 h LEU 101 CO -0.24 0.52 -0.44 0.45 -0.00 0.00 0.00 178.44 178.73 1ik0 h HIS 102 N 0.85 0.81 0.08 1.13 3.86 -1.42 -2.73 115.15 117.73 1ik0 h HIS 102 Ca 0.23 -0.25 -0.00 0.00 -1.16 0.00 0.00 60.37 59.19 1ik0 h HIS 102 Cb -0.10 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 28.20 1ik0 h HIS 102 CO -0.03 0.99 -0.04 -0.07 0.86 0.00 0.00 177.93 179.64 1ik0 h LEU 103 N 0.54 -0.10 -1.39 2.43 3.38 -0.79 -2.06 115.31 117.32 1ik0 h LEU 103 Ca 0.04 0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 1ik0 h LEU 103 Cb 0.98 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.75 1ik0 h LEU 103 CO 0.09 -0.07 -0.11 0.07 0.09 0.00 0.00 178.44 178.51 1ik0 h LYS 104 N -0.11 0.00 -0.00 1.13 2.10 -1.58 -3.18 116.57 114.93 1ik0 h LYS 104 Ca -0.01 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.64 1ik0 h LYS 104 Cb 0.09 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.42 1ik0 h LYS 104 CO 0.01 0.11 0.00 -0.22 -2.00 0.00 0.00 179.45 177.36 1ik0 h LYS 105 N 0.00 0.00 0.00 0.07 3.64 -1.04 -2.66 116.57 116.58 1ik0 h LYS 105 Ca -0.00 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1ik0 h LYS 105 Cb 0.58 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1ik0 h LYS 105 CO 0.01 0.19 -0.10 -0.07 -2.27 0.00 0.00 179.45 177.21 1ik0 h LEU 106 N -0.18 0.00 -1.04 5.20 -0.00 -1.48 -2.18 115.31 115.63 1ik0 h LEU 106 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 57.91 1ik0 h LEU 106 Cb 0.18 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.79 1ik0 h LEU 106 CO -0.00 0.10 0.65 0.15 -0.00 0.00 0.00 178.44 179.34 1ik0 h PHE 107 N 0.00 1.22 -0.69 1.13 3.57 -1.50 -0.23 116.94 120.43 1ik0 h PHE 107 Ca -0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.54 1ik0 h PHE 107 Cb 0.20 -0.41 -0.03 0.00 2.79 0.00 0.00 35.95 38.49 1ik0 h PHE 107 CO 0.00 0.73 0.46 0.00 -2.23 0.00 0.00 178.31 177.27 1ik0 h ARG 108 N 1.28 0.91 0.00 1.11 3.08 -1.33 -1.16 114.38 118.27 1ik0 h ARG 108 Ca 0.38 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.38 1ik0 h ARG 108 Cb -0.05 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.79 1ik0 h ARG 108 CO -0.11 0.60 -0.28 0.39 -1.07 0.00 0.00 179.97 179.50 1ik0 n GLU 109 N -4.43 0.16 -0.83 0.04 1.02 -0.51 -4.90 120.64 111.19 1ik0 n GLU 109 Ca 0.07 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1ik0 n GLU 109 Cb 0.04 -1.64 0.00 0.00 -0.02 0.00 0.00 31.44 29.81 1ik0 n GLU 109 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ik0 n GLY 110 N 1.40 0.35 3.38 0.62 0.00 -0.21 -4.93 105.19 105.80 1ik0 n GLY 110 Ca 0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.63 1ik0 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ik0 s ARG 111 N -0.79 3.05 -0.14 1.61 0.52 -1.22 -5.02 118.95 116.97 1ik0 s ARG 111 Ca 0.00 -1.30 -0.13 0.00 -0.52 0.00 0.00 55.73 53.78 1ik0 s ARG 111 Cb 0.00 -4.27 -0.05 0.00 0.52 0.00 0.00 34.95 31.15 1ik0 s ARG 111 CO 0.00 -1.56 0.30 -0.06 0.02 0.00 0.00 175.30 174.00 1ik0 s PHE 112 N 2.77 3.51 0.00 -0.53 0.08 -1.26 -4.83 117.98 117.71 1ik0 s PHE 112 Ca 0.12 0.65 0.00 0.00 0.12 0.00 0.00 56.93 57.82 1ik0 s PHE 112 Cb -0.24 -2.31 0.00 0.00 -0.57 0.00 0.00 43.02 39.91 1ik0 s PHE 112 CO 0.06 0.33 0.00 -1.71 -0.10 0.00 0.00 175.22 173.80