#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 1.62 1.01 -5.12 0.00 -1.26 -5.00 107.32 98.58 1ik0 s GLY 2 Ca 0.00 -0.35 -0.19 0.00 0.00 0.00 0.00 44.72 44.18 1ik0 s GLY 2 CO 0.00 0.04 -0.54 -1.05 0.00 0.00 0.00 173.10 171.56 1ik0 n PRO 3 N -3.13 -0.36 -2.85 2.90 -0.02 -1.26 -4.92 135.00 125.37 1ik0 n PRO 3 Ca 0.07 -0.09 -0.33 0.00 -2.02 0.00 0.00 63.50 61.13 1ik0 n PRO 3 Cb 0.57 -1.34 -0.07 0.00 -0.02 0.00 0.00 33.50 32.65 1ik0 n PRO 3 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1ik0 s VAL 4 N -2.14 4.41 1.04 -1.45 -7.23 -1.26 -5.03 120.40 108.74 1ik0 s VAL 4 Ca 0.46 1.45 -0.14 0.00 -1.81 0.00 0.00 61.98 61.94 1ik0 s VAL 4 Cb -0.11 -3.63 0.11 0.00 0.56 0.00 0.00 36.38 33.31 1ik0 s VAL 4 CO 0.72 -0.27 0.44 -2.65 -0.31 0.00 0.00 175.10 173.03 1ik0 n PRO 5 N -0.51 -1.07 0.16 4.82 -0.02 -1.26 -4.73 135.00 132.38 1ik0 n PRO 5 Ca 0.06 -0.28 -0.12 0.00 -2.02 0.00 0.00 63.50 61.14 1ik0 n PRO 5 Cb 0.54 -1.91 -0.07 0.00 -0.02 0.00 0.00 33.50 32.04 1ik0 n PRO 5 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 1ik0 h PRO 6 N -1.94 -0.42 -0.84 0.52 0.13 -1.99 -1.58 132.00 125.88 1ik0 h PRO 6 Ca -0.49 0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.65 1ik0 h PRO 6 Cb 1.31 0.10 -0.04 0.00 0.13 0.00 0.00 31.00 32.50 1ik0 h PRO 6 CO 0.38 -0.10 0.48 0.66 -0.23 0.00 0.00 178.00 179.20 1ik0 h SER 7 N -0.87 1.03 -0.46 1.44 4.64 -1.95 -2.34 113.55 115.05 1ik0 h SER 7 Ca -0.05 -0.08 -0.14 0.00 -0.47 0.00 0.00 61.79 61.06 1ik0 h SER 7 Cb 0.53 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 62.34 1ik0 h SER 7 CO 0.07 0.81 -0.27 0.74 -0.87 0.00 0.00 176.83 177.32 1ik0 h THR 8 N 1.17 1.27 -0.70 2.95 2.02 -1.93 -1.44 112.91 116.25 1ik0 h THR 8 Ca 0.30 -1.44 0.01 0.00 0.77 0.00 0.00 66.41 66.05 1ik0 h THR 8 Cb -0.01 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 1ik0 h THR 8 CO -0.05 0.49 0.46 0.00 0.37 0.00 0.00 175.52 176.79 1ik0 h ALA 9 N 0.84 0.89 -0.39 6.16 0.00 -0.91 0.23 119.26 126.07 1ik0 h ALA 9 Ca 0.10 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1ik0 h ALA 9 Cb 0.85 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 1ik0 h ALA 9 CO 0.08 0.31 0.13 1.25 0.00 0.00 0.00 179.25 181.01 1ik0 h LEU 10 N 0.95 0.57 -0.49 0.00 5.85 -1.27 0.35 115.31 121.27 1ik0 h LEU 10 Ca 0.26 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.78 1ik0 h LEU 10 Cb -0.11 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 40.75 1ik0 h LEU 10 CO -0.06 0.62 0.33 0.03 -0.34 0.00 0.00 178.44 179.02 1ik0 h ARG 11 N 0.49 0.65 -0.80 1.25 2.47 -0.54 0.20 114.38 118.09 1ik0 h ARG 11 Ca 0.13 -0.04 -0.04 0.00 -1.26 0.00 0.00 59.98 58.76 1ik0 h ARG 11 Cb 0.25 -0.15 -0.04 0.00 -1.65 0.00 0.00 29.97 28.39 1ik0 h ARG 11 CO -0.00 0.43 0.33 0.93 0.56 0.00 0.00 179.97 182.21 1ik0 h GLU 12 N 0.66 1.20 -0.34 0.04 5.08 -0.30 -1.75 114.58 119.17 1ik0 h GLU 12 Ca 0.18 -0.21 -0.12 0.00 -1.00 0.00 0.00 59.36 58.20 1ik0 h GLU 12 Cb -0.08 -0.20 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 1ik0 h GLU 12 CO -0.04 0.96 -0.26 1.25 -1.00 0.00 0.00 179.01 179.92 1ik0 h LEU 13 N 1.17 0.82 -0.53 1.33 5.85 -0.28 -2.59 115.31 121.07 1ik0 h LEU 13 Ca 0.27 -0.44 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1ik0 h LEU 13 Cb 0.21 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 1ik0 h LEU 13 CO -0.02 1.09 0.30 0.40 -0.34 0.00 0.00 178.44 179.87 1ik0 h ILE 14 N 0.56 1.18 -1.01 4.05 2.04 -0.40 -0.38 117.51 123.54 1ik0 h ILE 14 Ca 0.06 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.50 1ik0 h ILE 14 Cb 0.83 0.49 -0.05 0.00 -0.74 0.00 0.00 36.82 37.35 1ik0 h ILE 14 CO 0.07 0.19 0.67 -0.33 0.00 0.00 0.00 178.15 178.74 1ik0 h GLU 15 N 0.72 1.32 -0.16 2.37 5.08 -1.26 0.37 114.58 123.01 1ik0 h GLU 15 Ca 0.19 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 1ik0 h GLU 15 Cb 0.03 -0.30 -0.00 0.00 0.50 0.00 0.00 28.75 28.98 1ik0 h GLU 15 CO -0.03 0.88 -0.17 1.49 -1.00 0.00 0.00 179.01 180.17 1ik0 h GLU 16 N 1.36 0.41 -0.77 2.33 4.57 -1.03 -1.56 114.58 119.89 1ik0 h GLU 16 Ca 0.37 -0.22 -0.02 0.00 -1.18 0.00 0.00 59.36 58.32 1ik0 h GLU 16 Cb -0.15 0.01 -0.04 0.00 -0.16 0.00 0.00 28.75 28.41 1ik0 h GLU 16 CO -0.08 0.78 0.41 -0.07 -1.18 0.00 0.00 179.01 178.87 1ik0 h LEU 17 N 0.05 0.96 -0.33 1.64 3.38 -0.74 -2.41 115.31 117.86 1ik0 h LEU 17 Ca 0.03 -0.10 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1ik0 h LEU 17 Cb 0.71 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.20 1ik0 h LEU 17 CO 0.04 0.79 -0.11 0.58 0.09 0.00 0.00 178.44 179.83 1ik0 h VAL 18 N 1.06 1.28 -0.97 1.22 2.07 -0.90 -2.97 116.25 117.04 1ik0 h VAL 18 Ca 0.27 -1.19 0.01 0.00 0.82 0.00 0.00 66.70 66.61 1ik0 h VAL 18 Cb 0.05 1.36 -0.05 0.00 -1.52 0.00 0.00 31.29 31.13 1ik0 h VAL 18 CO -0.04 0.39 0.64 -1.13 0.02 0.00 0.00 177.57 177.45 1ik0 h ASN 19 N 0.44 1.11 1.42 0.57 -0.73 -1.04 -0.66 115.58 116.69 1ik0 h ASN 19 Ca 0.08 -0.03 -0.02 0.00 1.87 0.00 0.00 56.30 58.20 1ik0 h ASN 19 Cb 0.62 -0.28 -0.00 0.00 0.27 0.00 0.00 38.32 38.93 1ik0 h ASN 19 CO 0.04 0.81 -0.12 0.16 -0.37 0.00 0.00 177.43 177.95 1ik0 h ILE 20 N 1.31 0.23 0.00 2.57 3.07 -1.41 -3.10 117.51 120.18 1ik0 h ILE 20 Ca 0.35 -1.05 -0.09 0.00 1.55 0.00 0.00 64.86 65.63 1ik0 h ILE 20 Cb -0.15 1.87 -0.02 0.00 -0.27 0.00 0.00 36.82 38.25 1ik0 h ILE 20 CO -0.08 0.11 -1.84 0.35 -1.05 0.00 0.00 178.15 175.65 1ik0 n THR 21 N -3.17 0.51 0.09 0.16 -2.24 -1.00 -3.69 114.28 104.93 1ik0 n THR 21 Ca 0.02 -0.60 -0.05 0.00 -2.27 0.00 0.00 64.05 61.15 1ik0 n THR 21 Cb 0.47 -0.24 -0.02 0.00 -2.10 0.00 0.00 70.33 68.44 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 0.00 -0.36 -0.78 4.20 -1.16 -3.19 115.11 113.82 1ik0 h GLN 22 Ca -0.12 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1ik0 h GLN 22 Cb 1.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.09 1ik0 h GLN 22 CO 0.01 0.86 0.00 0.27 -0.67 0.00 0.00 178.83 179.30 1ik0 n ASN 23 N -3.47 2.85 -4.63 1.46 6.94 -1.17 -4.88 115.26 112.36 1ik0 n ASN 23 Ca -0.00 -1.91 -0.42 0.00 -0.02 0.00 0.00 54.58 52.22 1ik0 n ASN 23 Cb 0.83 -0.23 -0.04 0.00 -2.36 0.00 0.00 39.78 37.98 1ik0 n ASN 23 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1ik0 s GLN 24 N -1.54 4.02 0.24 -3.83 -2.07 -1.21 -4.88 119.66 110.40 1ik0 s GLN 24 Ca 0.37 0.81 0.18 0.00 -1.82 0.00 0.00 55.36 54.90 1ik0 s GLN 24 Cb 0.21 -3.73 0.06 0.00 -1.09 0.00 0.00 33.01 28.46 1ik0 s GLN 24 CO 0.29 -0.76 1.25 -0.22 -1.32 0.00 0.00 175.29 174.53 1ik0 h LYS 25 N 8.06 0.00 -4.10 9.60 3.64 -1.91 -3.47 116.57 128.40 1ik0 h LYS 25 Ca -0.23 0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.04 1ik0 h LYS 25 Cb 1.08 0.00 -0.15 0.00 -0.41 0.00 0.00 32.23 32.75 1ik0 h LYS 25 CO 0.94 0.26 -0.59 0.00 -2.27 0.00 0.00 179.45 177.79 1ik0 s ALA 26 N -3.08 0.28 0.31 5.00 0.00 -1.26 -5.12 121.76 117.89 1ik0 s ALA 26 Ca 0.02 -1.01 -0.24 0.00 0.00 0.00 0.00 51.96 50.72 1ik0 s ALA 26 Cb 0.08 0.32 -0.16 0.00 0.00 0.00 0.00 23.12 23.36 1ik0 s ALA 26 CO 0.76 -0.40 0.30 -2.30 0.00 0.00 0.00 175.76 174.12 1ik0 n PRO 27 N 0.13 0.02 0.00 0.00 -0.02 -1.26 -4.77 135.00 129.10 1ik0 n PRO 27 Ca -0.15 0.01 0.08 0.00 -2.02 0.00 0.00 63.50 61.42 1ik0 n PRO 27 Cb 0.61 -1.02 0.43 0.00 -0.02 0.00 0.00 33.50 33.50 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 2.15 0.00 -4.09 2.45 4.77 -1.26 -4.77 117.00 116.25 1ik0 n LEU 28 Ca 0.14 0.19 -0.11 0.00 -0.03 0.00 0.00 56.01 56.20 1ik0 n LEU 28 Cb 0.33 -0.19 -0.07 0.00 -2.33 0.00 0.00 43.42 41.16 1ik0 n LEU 28 CO 0.55 -0.09 -0.01 0.00 -1.33 0.00 0.00 177.39 176.51 1ik0 n ASN 30 N -0.39 1.81 -0.06 0.00 3.02 -1.26 -4.21 115.26 114.17 1ik0 n ASN 30 Ca 0.00 -1.62 -0.00 0.00 -0.03 0.00 0.00 54.58 52.93 1ik0 n ASN 30 Cb 0.64 -0.43 -0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1ik0 n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ik0 n GLY 31 N 2.23 0.40 3.78 7.41 0.00 -1.26 -4.99 105.19 112.76 1ik0 n GLY 31 Ca 0.06 -0.87 -0.41 0.00 0.00 0.00 0.00 46.02 44.80 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 1.93 3.85 -4.40 1.61 7.64 -1.26 -4.89 113.62 118.10 1ik0 n SER 32 Ca -0.00 1.23 -0.28 0.00 1.01 0.00 0.00 58.87 60.82 1ik0 n SER 32 Cb 0.50 -1.63 -0.13 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 -2.12 1.43 0.21 1.43 -1.94 -1.26 -2.30 119.30 114.75 1ik0 s MET 33 Ca 0.53 -1.39 0.05 0.00 -1.71 0.00 0.00 55.69 53.17 1ik0 s MET 33 Cb -0.47 -1.88 -0.05 0.00 2.01 0.00 0.00 34.83 34.44 1ik0 s MET 33 CO 0.64 0.44 -0.07 0.14 -0.01 0.00 0.00 175.02 176.16 1ik0 s VAL 34 N -1.21 1.30 0.20 -6.03 -7.23 0.14 -4.87 120.40 102.69 1ik0 s VAL 34 Ca 0.16 -2.09 -0.30 0.00 -1.81 0.00 0.00 61.98 57.94 1ik0 s VAL 34 Cb -0.09 -2.15 -0.08 0.00 0.56 0.00 0.00 36.38 34.61 1ik0 s VAL 34 CO 0.07 -0.50 1.20 0.26 -0.31 0.00 0.00 175.10 175.81 1ik0 s TRP 35 N -3.25 3.42 0.54 2.82 0.52 -1.26 -0.28 118.94 121.45 1ik0 s TRP 35 Ca 0.24 1.44 -0.19 0.00 0.02 0.00 0.00 56.10 57.60 1ik0 s TRP 35 Cb 0.03 -3.43 -0.06 0.00 -1.15 0.00 0.00 33.47 28.86 1ik0 s TRP 35 CO 0.06 -1.19 1.11 -1.54 0.02 0.00 0.00 176.95 175.42 1ik0 s SER 36 N 0.04 5.81 0.17 2.95 1.04 -1.15 -4.86 113.70 117.70 1ik0 s SER 36 Ca 0.52 2.12 -0.00 0.00 0.48 0.00 0.00 55.95 59.07 1ik0 s SER 36 Cb -0.33 -2.58 -0.04 0.00 0.10 0.00 0.00 66.02 63.17 1ik0 s SER 36 CO 0.37 -1.16 0.06 0.27 0.98 0.00 0.00 173.24 173.77 1ik0 s ILE 37 N -1.84 0.28 -0.20 -1.02 -4.36 -1.26 -4.91 121.20 107.88 1ik0 s ILE 37 Ca 0.71 -1.96 -0.23 0.00 -0.26 0.00 0.00 60.65 58.92 1ik0 s ILE 37 Cb -0.22 -2.23 -0.02 0.00 1.25 0.00 0.00 42.46 41.24 1ik0 s ILE 37 CO 0.26 -0.31 0.74 0.21 0.24 0.00 0.00 174.94 176.08 1ik0 s ASN 38 N -3.14 6.79 -0.35 4.36 3.04 -1.26 -5.01 114.94 119.38 1ik0 s ASN 38 Ca 0.29 0.97 -0.28 0.00 0.04 0.00 0.00 52.86 53.87 1ik0 s ASN 38 Cb 0.07 -2.40 0.02 0.00 -1.54 0.00 0.00 41.25 37.40 1ik0 s ASN 38 CO 0.06 -0.38 1.05 -0.76 -3.04 0.00 0.00 177.10 174.04 1ik0 s LEU 39 N 2.25 3.90 0.00 3.21 2.01 -1.26 -4.85 118.68 123.94 1ik0 s LEU 39 Ca 0.33 0.89 0.00 0.00 0.01 0.00 0.00 54.13 55.36 1ik0 s LEU 39 Cb -0.16 -3.49 0.00 0.00 0.01 0.00 0.00 46.19 42.55 1ik0 s LEU 39 CO 0.10 -0.92 0.00 0.35 1.01 0.00 0.00 176.35 176.89 1ik0 n THR 40 N 6.01 0.00 -0.00 5.49 -2.24 -1.26 -5.07 114.28 117.21 1ik0 n THR 40 Ca 0.11 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.87 1ik0 n THR 40 Cb 0.48 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.70 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 2.87 0.61 6.98 0.00 -1.26 -4.64 120.51 122.06 1ik0 n ALA 41 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.36 1ik0 n ALA 41 Cb 0.00 0.43 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 2.97 1.20 0.37 0.00 0.00 -1.26 -4.05 105.19 104.41 1ik0 n GLY 42 Ca -0.03 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.95 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 0.77 1.28 -0.62 1.61 0.00 -1.89 0.06 114.93 116.14 1ik0 h MET 43 Ca 0.00 -0.13 0.01 0.00 0.00 0.00 0.00 59.70 59.58 1ik0 h MET 43 Cb 0.59 -0.26 -0.03 0.00 0.00 0.00 0.00 31.60 31.90 1ik0 h MET 43 CO 0.00 0.91 0.40 1.88 0.00 0.00 0.00 176.91 180.10 1ik0 h TYR 44 N 1.30 0.76 0.33 -0.22 -1.99 -1.93 2.11 116.97 117.33 1ik0 h TYR 44 Ca 0.33 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 61.07 1ik0 h TYR 44 Cb -0.03 -0.25 0.00 0.00 2.00 0.00 0.00 36.73 38.45 1ik0 h TYR 44 CO 0.01 0.47 -0.16 0.00 -0.00 0.00 0.00 178.16 178.48 1ik0 h ALA 46 N -0.44 0.70 -0.81 0.00 0.00 -0.84 -2.79 119.26 115.08 1ik0 h ALA 46 Ca -0.04 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.66 1ik0 h ALA 46 Cb 0.52 -0.21 -0.04 0.00 0.00 0.00 0.00 17.79 18.07 1ik0 h ALA 46 CO 0.07 0.32 0.34 0.00 0.00 0.00 0.00 179.25 179.99 1ik0 h ALA 47 N 1.06 1.05 0.00 0.00 0.00 0.34 -2.84 119.26 118.88 1ik0 h ALA 47 Ca 0.18 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ik0 h ALA 47 Cb 0.20 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1ik0 h ALA 47 CO -0.01 0.66 -0.00 1.25 0.00 0.00 0.00 179.25 181.15 1ik0 h LEU 48 N 1.18 -0.00 -1.49 0.00 5.85 -0.99 -2.39 115.31 117.47 1ik0 h LEU 48 Ca 0.27 -0.00 0.04 0.00 0.84 0.00 0.00 57.88 59.03 1ik0 h LEU 48 Cb 0.19 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.19 1ik0 h LEU 48 CO -0.03 -0.00 0.39 1.05 -0.34 0.00 0.00 178.44 179.51 1ik0 h GLU 49 N -0.01 0.64 -0.84 1.25 4.11 -1.39 -0.79 114.58 117.55 1ik0 h GLU 49 Ca -0.00 -0.04 -0.03 0.00 0.07 0.00 0.00 59.36 59.36 1ik0 h GLU 49 Cb 0.01 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.07 1ik0 h GLU 49 CO 0.00 0.42 0.40 0.66 0.07 0.00 0.00 179.01 180.57 1ik0 h SER 50 N 0.66 1.11 0.24 3.06 4.64 -1.20 -2.31 113.55 119.75 1ik0 h SER 50 Ca 0.24 -0.14 -0.12 0.00 -0.47 0.00 0.00 61.79 61.30 1ik0 h SER 50 Cb 0.13 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.92 1ik0 h SER 50 CO -0.07 0.94 -0.47 -0.07 -0.87 0.00 0.00 176.83 176.29 1ik0 h LEU 51 N 1.21 0.29 -2.41 5.97 3.38 -0.74 -2.79 115.31 120.22 1ik0 h LEU 51 Ca 0.29 -0.14 0.01 0.00 0.09 0.00 0.00 57.88 58.13 1ik0 h LEU 51 Cb 0.13 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ik0 h LEU 51 CO -0.04 0.73 0.19 0.40 0.09 0.00 0.00 178.44 179.81 1ik0 h ILE 52 N 0.22 0.10 0.00 1.22 1.08 -0.71 0.59 117.51 120.01 1ik0 h ILE 52 Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.48 1ik0 h ILE 52 Cb 0.92 0.82 0.00 0.00 -3.07 0.00 0.00 36.82 35.49 1ik0 h ILE 52 CO 0.07 0.00 -0.13 0.59 -0.69 0.00 0.00 178.15 177.99 1ik0 n ASN 53 N -3.15 0.16 -4.64 1.72 5.03 -1.05 -4.73 115.26 108.59 1ik0 n ASN 53 Ca -0.02 0.31 -0.40 0.00 0.87 0.00 0.00 54.58 55.34 1ik0 n ASN 53 Cb 0.26 -0.31 -0.06 0.00 -1.02 0.00 0.00 39.78 38.64 1ik0 n ASN 53 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1ik0 s VAL 54 N -3.00 5.02 0.08 2.41 1.01 0.21 -5.05 120.40 121.08 1ik0 s VAL 54 Ca 0.13 1.10 0.06 0.00 0.00 0.00 0.00 61.98 63.28 1ik0 s VAL 54 Cb 0.18 -3.91 -0.03 0.00 0.00 0.00 0.00 36.38 32.62 1ik0 s VAL 54 CO 0.58 0.09 -0.16 -0.44 0.00 0.00 0.00 175.10 175.16 1ik0 s SER 55 N 1.33 1.98 0.00 3.32 0.01 -1.26 -4.78 113.70 114.30 1ik0 s SER 55 Ca 0.26 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.87 1ik0 s SER 55 Cb -0.16 -0.08 0.00 0.00 0.21 0.00 0.00 66.02 65.99 1ik0 s SER 55 CO 0.09 -0.04 0.00 0.61 0.41 0.00 0.00 173.24 174.32 1ik0 n GLY 56 N 1.17 0.86 2.66 3.44 0.00 -1.26 -5.04 105.19 107.02 1ik0 n GLY 56 Ca -0.20 -0.58 -0.21 0.00 0.00 0.00 0.00 46.02 45.03 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 7.43 0.85 0.00 0.00 0.87 -1.96 -3.11 113.55 117.63 1ik0 h SER 58 Ca -0.01 -0.41 0.00 0.00 -1.23 0.00 0.00 61.79 60.14 1ik0 h SER 58 Cb 1.03 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 1ik0 h SER 58 CO 0.27 1.16 0.43 0.00 -0.53 0.00 0.00 176.83 178.16 1ik0 n ALA 59 N -2.54 0.26 -0.03 6.23 0.00 -1.26 0.76 120.51 123.94 1ik0 n ALA 59 Ca -0.03 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1ik0 n ALA 59 Cb 0.56 -0.28 0.00 0.00 0.00 0.00 0.00 19.45 19.73 1ik0 n ALA 59 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1ik0 n ILE 60 N -1.36 0.00 -0.37 0.00 -5.35 -1.17 -4.69 119.36 106.42 1ik0 n ILE 60 Ca -0.00 -0.46 -0.02 0.00 -0.27 0.00 0.00 62.75 61.99 1ik0 n ILE 60 Cb 0.43 1.03 0.11 0.00 -1.74 0.00 0.00 39.64 39.46 1ik0 n ILE 60 CO 0.00 0.00 0.00 1.05 -1.76 0.00 0.00 176.55 175.84 1ik0 h GLU 61 N 0.00 1.30 -0.88 6.28 4.11 0.28 -1.06 114.58 124.61 1ik0 h GLU 61 Ca 0.00 -0.08 -0.03 0.00 0.07 0.00 0.00 59.36 59.33 1ik0 h GLU 61 Cb 0.01 -0.29 -0.04 0.00 0.50 0.00 0.00 28.75 28.93 1ik0 h GLU 61 CO 0.00 0.86 0.45 0.87 0.07 0.00 0.00 179.01 181.25 1ik0 h LYS 62 N 1.34 1.25 -0.97 1.06 1.57 -1.84 -2.13 116.57 116.85 1ik0 h LYS 62 Ca 0.36 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.98 1ik0 h LYS 62 Cb -0.16 -0.23 -0.05 0.00 0.08 0.00 0.00 32.23 31.87 1ik0 h LYS 62 CO -0.08 0.94 0.64 1.15 -0.57 0.00 0.00 179.45 181.53 1ik0 h THR 63 N 1.24 1.25 -0.83 -0.16 2.02 -1.51 -1.85 112.91 113.08 1ik0 h THR 63 Ca 0.30 -0.46 0.01 0.00 0.77 0.00 0.00 66.41 67.04 1ik0 h THR 63 Cb 0.08 -0.18 -0.04 0.00 -1.74 0.00 0.00 68.15 66.27 1ik0 h THR 63 CO -0.04 0.24 0.55 1.56 0.37 0.00 0.00 175.52 178.20 1ik0 h GLN 64 N 1.32 1.10 -0.34 6.66 4.20 -0.69 -0.52 115.11 126.83 1ik0 h GLN 64 Ca 0.36 -0.07 -0.04 0.00 0.06 0.00 0.00 58.65 58.96 1ik0 h GLN 64 Cb -0.15 -0.25 -0.01 0.00 0.30 0.00 0.00 27.48 27.37 1ik0 h GLN 64 CO -0.08 0.73 0.06 0.00 -0.67 0.00 0.00 178.83 178.88 1ik0 h ARG 65 N 1.13 0.56 -0.69 1.46 3.08 -1.10 -2.50 114.38 116.33 1ik0 h ARG 65 Ca 0.31 -0.14 -0.08 0.00 0.07 0.00 0.00 59.98 60.13 1ik0 h ARG 65 Cb -0.13 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 29.83 1ik0 h ARG 65 CO -0.07 0.63 0.13 0.52 -1.07 0.00 0.00 179.97 180.11 1ik0 h MET 66 N 0.40 1.12 -1.00 0.04 2.86 -1.01 -2.74 114.93 114.61 1ik0 h MET 66 Ca 0.10 -0.29 0.01 0.00 -2.06 0.00 0.00 59.70 57.46 1ik0 h MET 66 Cb 0.34 -0.14 -0.05 0.00 0.06 0.00 0.00 31.60 31.81 1ik0 h MET 66 CO 0.00 1.02 0.66 -0.07 1.06 0.00 0.00 176.91 179.58 1ik0 h LEU 67 N 1.06 1.15 -1.02 1.22 3.38 -0.97 -1.80 115.31 118.33 1ik0 h LEU 67 Ca 0.21 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.17 1ik0 h LEU 67 Cb 0.43 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.83 1ik0 h LEU 67 CO 0.01 0.84 0.66 0.28 0.09 0.00 0.00 178.44 180.32 1ik0 h SER 68 N 1.36 1.12 -0.59 -0.43 0.02 -1.15 -0.59 113.55 113.29 1ik0 h SER 68 Ca 0.37 -0.02 0.17 0.00 -0.84 0.00 0.00 61.79 61.47 1ik0 h SER 68 Cb -0.15 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 62.09 1ik0 h SER 68 CO -0.08 0.79 0.71 1.23 -1.14 0.00 0.00 176.83 178.34 1ik0 h GLY 69 N 1.32 0.00 0.54 -3.77 0.00 -1.17 1.19 103.07 101.18 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 -0.10 0.00 -1.43 0.69 0.00 0.00 0.00 176.54 175.70 1ik0 n PHE 70 N -3.49 0.52 -3.47 5.60 3.01 -0.25 -4.75 117.46 114.63 1ik0 n PHE 70 Ca 0.12 0.15 -0.26 0.00 1.01 0.00 0.00 57.45 58.48 1ik0 n PHE 70 Cb 0.92 -0.73 -0.12 0.00 -0.01 0.00 0.00 39.48 39.53 1ik0 n PHE 70 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ik0 n PRO 72 N 4.83 0.00 -3.03 0.00 -0.02 -1.12 -4.52 135.00 131.15 1ik0 n PRO 72 Ca 0.01 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.06 1ik0 n PRO 72 Cb 0.42 -1.32 -0.06 0.00 -0.02 0.00 0.00 33.50 32.52 1ik0 n PRO 72 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1ik0 s HIS 73 N 1.48 3.00 -0.91 6.00 2.46 -1.26 -4.98 115.29 121.07 1ik0 s HIS 73 Ca 0.00 -0.04 -0.23 0.00 0.47 0.00 0.00 55.06 55.26 1ik0 s HIS 73 Cb 0.00 -3.58 0.06 0.00 -0.13 0.00 0.00 32.58 28.92 1ik0 s HIS 73 CO 0.00 -1.00 1.33 0.15 -2.47 0.00 0.00 174.74 172.75 1ik0 s LYS 74 N 3.12 3.46 -0.21 2.88 1.02 -1.26 -4.97 119.74 123.78 1ik0 s LYS 74 Ca 0.25 -0.96 -0.14 0.00 0.02 0.00 0.00 55.97 55.13 1ik0 s LYS 74 Cb -0.14 -4.93 -0.04 0.00 -0.52 0.00 0.00 37.83 32.19 1ik0 s LYS 74 CO 0.19 -2.11 0.34 0.14 -0.92 0.00 0.00 175.35 172.99 1ik0 s VAL 75 N 4.81 5.24 0.37 3.17 -7.23 -1.26 -5.04 120.40 120.47 1ik0 s VAL 75 Ca 0.40 0.57 0.04 0.00 -1.81 0.00 0.00 61.98 61.18 1ik0 s VAL 75 Cb -0.04 -3.67 -0.01 0.00 0.56 0.00 0.00 36.38 33.23 1ik0 s VAL 75 CO -0.02 0.29 0.54 -0.94 -0.31 0.00 0.00 175.10 174.65 1ik0 s SER 76 N 0.99 5.94 0.39 4.85 1.04 -1.25 -4.95 113.70 120.72 1ik0 s SER 76 Ca 0.16 0.02 0.27 0.00 0.48 0.00 0.00 55.95 56.88 1ik0 s SER 76 Cb -0.14 -1.40 1.44 0.00 0.10 0.00 0.00 66.02 66.02 1ik0 s SER 76 CO 0.07 -0.51 1.81 0.00 0.98 0.00 0.00 173.24 175.59 1ik0 h ALA 77 N 0.72 1.00 0.00 5.32 0.00 -1.98 -1.77 119.26 122.55 1ik0 h ALA 77 Ca -0.46 0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.09 1ik0 h ALA 77 Cb 1.25 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.98 1ik0 h ALA 77 CO 0.55 0.00 -2.30 0.41 0.00 0.00 0.00 179.25 177.91 1ik0 n GLY 78 N -1.22 -0.95 3.65 0.00 0.00 -1.26 -4.88 105.19 100.54 1ik0 n GLY 78 Ca -0.02 -0.29 -0.40 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.51 4.19 0.04 1.61 -1.52 -0.67 -5.05 119.66 115.76 1ik0 s GLN 79 Ca -0.11 0.62 0.05 0.00 -1.95 0.00 0.00 55.36 53.97 1ik0 s GLN 79 Cb 0.06 -3.59 -0.02 0.00 -0.22 0.00 0.00 33.01 29.24 1ik0 s GLN 79 CO 0.81 -0.28 -0.15 -0.06 -0.25 0.00 0.00 175.29 175.36 1ik0 s PHE 80 N 2.06 1.28 0.00 0.91 0.08 -1.26 -3.96 117.98 117.09 1ik0 s PHE 80 Ca 0.29 -0.35 0.00 0.00 0.12 0.00 0.00 56.93 56.98 1ik0 s PHE 80 Cb -0.16 -0.76 0.00 0.00 -0.57 0.00 0.00 43.02 41.53 1ik0 s PHE 80 CO 0.10 0.04 0.00 0.43 -0.10 0.00 0.00 175.22 175.69 1ik0 n SER 81 N 1.92 2.71 -0.79 1.36 7.64 -1.26 -4.80 113.62 120.39 1ik0 n SER 81 Ca -0.18 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.82 1ik0 n SER 81 Cb 0.55 0.00 0.15 0.00 -1.01 0.00 0.00 64.21 63.90 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 -2.55 2.57 -1.16 6.43 2.88 -1.26 -4.27 113.62 116.26 1ik0 n SER 82 Ca 0.00 -1.82 -0.02 0.00 -1.33 0.00 0.00 58.87 55.70 1ik0 n SER 82 Cb 0.46 0.08 0.10 0.00 -0.75 0.00 0.00 64.21 64.10 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 0.90 3.31 0.06 2.46 4.32 -1.26 -4.06 117.00 122.74 1ik0 n LEU 83 Ca 0.14 -1.70 -0.12 0.00 -0.02 0.00 0.00 56.01 54.31 1ik0 n LEU 83 Cb 0.54 -0.59 -0.02 0.00 -1.62 0.00 0.00 43.42 41.73 1ik0 n LEU 83 CO 0.18 0.51 0.25 0.45 -1.22 0.00 0.00 177.39 177.55 1ik0 h HIS 84 N 0.91 0.57 -3.86 -1.77 3.86 -1.94 -3.44 115.15 109.48 1ik0 h HIS 84 Ca 0.09 -0.29 -0.50 0.00 -1.16 0.00 0.00 60.37 58.52 1ik0 h HIS 84 Cb 1.27 -0.07 0.02 0.00 1.06 0.00 0.00 27.41 29.69 1ik0 h HIS 84 CO 0.44 1.09 0.45 0.14 0.86 0.00 0.00 177.93 180.91 1ik0 s VAL 85 N -3.38 3.58 -1.34 2.45 -7.23 -1.26 -4.92 120.40 108.30 1ik0 s VAL 85 Ca -0.06 1.44 -0.06 0.00 -1.81 0.00 0.00 61.98 61.50 1ik0 s VAL 85 Cb 0.09 -3.86 0.11 0.00 0.56 0.00 0.00 36.38 33.29 1ik0 s VAL 85 CO 0.86 0.23 2.37 0.54 -0.31 0.00 0.00 175.10 178.79 1ik0 n ARG 86 N 0.72 4.46 -2.02 4.82 5.12 -1.26 -4.96 116.66 123.54 1ik0 n ARG 86 Ca 0.01 -3.40 -0.29 0.00 -1.93 0.00 0.00 57.85 52.25 1ik0 n ARG 86 Cb 0.47 -2.67 0.15 0.00 -1.16 0.00 0.00 32.46 29.24 1ik0 n ARG 86 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 1ik0 s ASP 87 N 0.52 3.70 0.41 0.55 1.01 -1.26 -5.06 116.67 116.53 1ik0 s ASP 87 Ca 0.54 0.33 -0.02 0.00 0.71 0.00 0.00 52.55 54.11 1ik0 s ASP 87 Cb 0.18 -0.56 -0.03 0.00 1.01 0.00 0.00 42.92 43.51 1ik0 s ASP 87 CO -0.08 -2.36 0.66 0.42 0.21 0.00 0.00 175.17 174.02 1ik0 s THR 88 N -3.69 5.00 0.46 -1.27 -4.23 -1.26 -4.87 115.64 105.79 1ik0 s THR 88 Ca 0.69 -0.15 -0.08 0.00 -1.18 0.00 0.00 61.69 60.97 1ik0 s THR 88 Cb -0.06 -3.86 -0.05 0.00 1.34 0.00 0.00 72.50 69.87 1ik0 s THR 88 CO 0.50 -0.70 0.81 -0.54 -0.54 0.00 0.00 174.62 174.16 1ik0 s LYS 89 N -4.52 3.66 0.13 3.99 1.02 -1.26 -2.95 119.74 119.81 1ik0 s LYS 89 Ca 0.43 0.40 0.04 0.00 0.02 0.00 0.00 55.97 56.86 1ik0 s LYS 89 Cb -0.10 -2.34 -0.04 0.00 -0.52 0.00 0.00 37.83 34.82 1ik0 s LYS 89 CO 0.40 -0.17 -0.09 0.96 -0.92 0.00 0.00 175.35 175.53 1ik0 s ILE 90 N -2.63 1.01 0.48 2.17 -4.36 0.61 -4.88 121.20 113.61 1ik0 s ILE 90 Ca 0.50 -2.02 -0.23 0.00 -0.26 0.00 0.00 60.65 58.65 1ik0 s ILE 90 Cb -0.10 -1.79 -0.07 0.00 1.25 0.00 0.00 42.46 41.75 1ik0 s ILE 90 CO 0.40 -0.79 1.23 -1.61 0.24 0.00 0.00 174.94 174.40 1ik0 s GLU 91 N -3.78 3.58 0.24 0.37 8.01 -1.26 -0.68 118.70 125.18 1ik0 s GLU 91 Ca 0.15 1.92 -0.06 0.00 0.01 0.00 0.00 54.97 56.99 1ik0 s GLU 91 Cb 0.03 -2.37 0.29 0.00 -4.31 0.00 0.00 34.13 27.77 1ik0 s GLU 91 CO -0.01 -0.74 1.89 0.28 0.01 0.00 0.00 175.26 176.69 1ik0 h VAL 92 N 1.76 1.17 -1.01 2.63 2.07 -1.80 -1.49 116.25 119.58 1ik0 h VAL 92 Ca -0.50 -0.41 0.17 0.00 0.82 0.00 0.00 66.70 66.79 1ik0 h VAL 92 Cb 1.26 -0.12 -0.10 0.00 -1.52 0.00 0.00 31.29 30.81 1ik0 h VAL 92 CO 0.59 0.22 0.62 0.00 0.02 0.00 0.00 177.57 179.02 1ik0 h ALA 93 N 1.38 1.63 -0.05 1.67 0.00 -1.91 0.82 119.26 122.80 1ik0 h ALA 93 Ca 0.37 0.06 -0.23 0.00 0.00 0.00 0.00 54.91 55.11 1ik0 h ALA 93 Cb -0.01 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ik0 h ALA 93 CO -0.12 0.03 -0.89 1.96 0.00 0.00 0.00 179.25 180.23 1ik0 h GLN 94 N 0.83 0.59 -0.19 0.00 4.20 -1.68 -2.88 115.11 115.98 1ik0 h GLN 94 Ca 0.56 -0.56 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ik0 h GLN 94 Cb 0.78 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.69 1ik0 h GLN 94 CO -0.35 1.18 0.13 0.35 -0.67 0.00 0.00 178.83 179.47 1ik0 h PHE 95 N 0.36 0.24 -0.23 2.96 3.04 -0.02 -0.31 116.94 122.99 1ik0 h PHE 95 Ca -0.08 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.86 1ik0 h PHE 95 Cb 1.52 -0.08 -0.01 0.00 2.56 0.00 0.00 35.95 39.94 1ik0 h PHE 95 CO 0.08 0.15 0.08 0.28 -2.02 0.00 0.00 178.31 176.88 1ik0 h VAL 96 N 0.26 1.18 -0.65 1.41 2.07 -0.99 -1.96 116.25 117.56 1ik0 h VAL 96 Ca 0.07 -0.54 -0.03 0.00 0.82 0.00 0.00 66.70 67.02 1ik0 h VAL 96 Cb -0.03 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.82 1ik0 h VAL 96 CO -0.02 0.18 0.30 0.11 0.02 0.00 0.00 177.57 178.16 1ik0 h LYS 97 N 0.21 0.95 -0.65 1.57 1.57 -1.34 0.29 116.57 119.17 1ik0 h LYS 97 Ca 0.07 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 58.71 1ik0 h LYS 97 Cb 0.20 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.31 1ik0 h LYS 97 CO -0.00 0.77 0.43 -0.44 -0.57 0.00 0.00 179.45 179.63 1ik0 h ASP 98 N 0.90 0.74 -0.66 0.86 3.32 -0.93 -1.92 116.42 118.73 1ik0 h ASP 98 Ca 0.22 -0.02 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 1ik0 h ASP 98 Cb 0.15 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 39.48 1ik0 h ASP 98 CO -0.02 0.54 0.17 0.25 -1.72 0.00 0.00 179.24 178.45 1ik0 h LEU 99 N 0.88 1.01 -0.67 1.55 5.85 -0.92 -2.99 115.31 120.03 1ik0 h LEU 99 Ca 0.24 -0.21 0.10 0.00 0.84 0.00 0.00 57.88 58.85 1ik0 h LEU 99 Cb -0.10 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 40.59 1ik0 h LEU 99 CO -0.05 0.97 0.29 0.25 -0.34 0.00 0.00 178.44 179.56 1ik0 h LEU 100 N 1.02 0.33 -0.49 2.25 5.85 -0.13 -0.25 115.31 123.89 1ik0 h LEU 100 Ca 0.22 0.07 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1ik0 h LEU 100 Cb 0.35 0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.39 1ik0 h LEU 100 CO 0.00 0.19 0.33 -0.07 -0.34 0.00 0.00 178.44 178.54 1ik0 h LEU 101 N 0.49 0.56 -0.62 2.25 -0.00 -1.36 -2.58 115.31 114.06 1ik0 h LEU 101 Ca 0.34 -0.02 -0.11 0.00 -0.00 0.00 0.00 57.88 58.09 1ik0 h LEU 101 Cb 0.40 -0.14 -0.02 0.00 -0.00 0.00 0.00 40.66 40.90 1ik0 h LEU 101 CO -0.30 0.41 -0.08 0.45 -0.00 0.00 0.00 178.44 178.92 1ik0 h HIS 102 N 0.67 1.11 -0.04 1.13 3.86 -1.36 -1.59 115.15 118.93 1ik0 h HIS 102 Ca 0.18 -0.22 0.01 0.00 -1.16 0.00 0.00 60.37 59.18 1ik0 h HIS 102 Cb -0.08 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 28.11 1ik0 h HIS 102 CO -0.04 1.02 -0.01 -0.07 0.86 0.00 0.00 177.93 179.69 1ik0 h LEU 103 N 0.90 -0.04 -1.48 2.43 3.38 -0.76 -1.45 115.31 118.29 1ik0 h LEU 103 Ca 0.15 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 1ik0 h LEU 103 Cb 0.64 0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1ik0 h LEU 103 CO 0.04 -0.01 -0.18 0.07 0.09 0.00 0.00 178.44 178.45 1ik0 h LYS 104 N -0.00 0.00 -0.00 1.13 2.10 -1.43 -3.17 116.57 115.20 1ik0 h LYS 104 Ca 0.02 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.67 1ik0 h LYS 104 Cb 0.03 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.36 1ik0 h LYS 104 CO -0.04 0.18 0.00 -0.22 -2.00 0.00 0.00 179.45 177.37 1ik0 h LYS 105 N 0.00 0.01 -0.06 0.07 3.64 -0.23 -2.70 116.57 117.29 1ik0 h LYS 105 Ca -0.00 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1ik0 h LYS 105 Cb 0.56 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 1ik0 h LYS 105 CO 0.02 0.21 -0.07 -0.07 -2.27 0.00 0.00 179.45 177.28 1ik0 h LEU 106 N -0.20 0.08 -1.36 5.20 -0.00 -1.44 -1.78 115.31 115.81 1ik0 h LEU 106 Ca 0.00 -0.01 0.01 0.00 -0.00 0.00 0.00 57.88 57.88 1ik0 h LEU 106 Cb 0.21 -0.02 -0.03 0.00 -0.00 0.00 0.00 40.66 40.81 1ik0 h LEU 106 CO -0.00 0.17 0.44 0.15 -0.00 0.00 0.00 178.44 179.19 1ik0 h PHE 107 N 0.09 0.82 -1.01 1.13 3.57 -1.49 -0.35 116.94 119.71 1ik0 h PHE 107 Ca 0.02 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.55 1ik0 h PHE 107 Cb 0.18 -0.28 -0.05 0.00 2.79 0.00 0.00 35.95 38.60 1ik0 h PHE 107 CO 0.00 0.51 0.67 0.00 -2.23 0.00 0.00 178.31 177.26 1ik0 h ARG 108 N 0.88 1.33 0.00 1.11 2.47 -1.16 -2.01 114.38 116.99 1ik0 h ARG 108 Ca 0.24 -0.08 0.00 0.00 -1.26 0.00 0.00 59.98 58.88 1ik0 h ARG 108 Cb -0.09 -0.30 0.00 0.00 -1.65 0.00 0.00 29.97 27.93 1ik0 h ARG 108 CO -0.05 0.88 -0.51 0.93 0.56 0.00 0.00 179.97 181.77 1ik0 h GLU 109 N 1.37 0.00 0.00 0.04 5.08 -1.44 -3.47 114.58 116.15 1ik0 h GLU 109 Ca 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.73 1ik0 h GLU 109 Cb -0.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.09 1ik0 h GLU 109 CO -0.08 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.34 1ik0 n GLY 110 N 1.24 0.43 3.39 -3.84 0.00 -0.21 -4.95 105.19 101.26 1ik0 n GLY 110 Ca 0.03 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.60 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 -0.49 3.29 0.16 1.61 0.52 -1.21 -5.02 118.95 117.81 1ik0 s ARG 111 Ca 0.00 -1.58 -0.12 0.00 -0.52 0.00 0.00 55.73 53.51 1ik0 s ARG 111 Cb 0.00 -4.46 -0.07 0.00 0.52 0.00 0.00 34.95 30.94 1ik0 s ARG 111 CO 0.00 -1.59 0.52 -0.06 0.02 0.00 0.00 175.30 174.19 1ik0 s PHE 112 N 2.40 3.54 0.00 -0.53 0.08 -1.26 -4.84 117.98 117.37 1ik0 s PHE 112 Ca 0.19 0.94 0.00 0.00 0.12 0.00 0.00 56.93 58.18 1ik0 s PHE 112 Cb -0.16 -2.29 0.00 0.00 -0.57 0.00 0.00 43.02 40.00 1ik0 s PHE 112 CO 0.00 0.40 0.00 0.09 -0.10 0.00 0.00 175.22 175.61