#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 1.65 0.21 3.03 0.00 -1.26 -4.92 107.32 106.03 1ik0 s GLY 2 Ca 0.00 0.07 -0.31 0.00 0.00 0.00 0.00 44.72 44.48 1ik0 s GLY 2 CO 0.00 0.47 1.04 -1.05 0.00 0.00 0.00 173.10 173.56 1ik0 n PRO 3 N -3.57 1.07 -2.93 2.90 -0.01 -1.26 -4.95 135.00 126.26 1ik0 n PRO 3 Ca 0.08 0.38 -0.35 0.00 -0.01 0.00 0.00 63.50 63.60 1ik0 n PRO 3 Cb 0.54 -1.78 -0.06 0.00 -0.01 0.00 0.00 33.50 32.18 1ik0 n PRO 3 CO 0.00 0.00 0.00 0.14 -0.01 0.00 0.00 175.50 175.63 1ik0 s VAL 4 N -0.56 4.44 1.04 -1.45 -7.23 -1.26 -5.05 120.40 110.33 1ik0 s VAL 4 Ca 0.68 1.43 -0.12 0.00 -1.81 0.00 0.00 61.98 62.16 1ik0 s VAL 4 Cb -0.82 -3.77 0.21 0.00 0.56 0.00 0.00 36.38 32.56 1ik0 s VAL 4 CO 0.55 -0.06 1.07 -2.16 -0.31 0.00 0.00 175.10 174.19 1ik0 s PRO 5 N -2.59 0.10 0.19 4.82 0.04 -1.26 -4.73 135.00 131.56 1ik0 s PRO 5 Ca 0.53 0.93 -0.12 0.00 0.04 0.00 0.00 61.00 62.38 1ik0 s PRO 5 Cb -0.13 -1.67 0.14 0.00 0.04 0.00 0.00 34.50 32.88 1ik0 s PRO 5 CO 0.18 -3.06 1.81 -1.00 0.04 0.00 0.00 177.00 174.97 1ik0 h PRO 6 N -2.15 0.61 -0.82 0.56 0.13 -1.99 -1.62 132.00 126.73 1ik0 h PRO 6 Ca -0.54 -0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.53 1ik0 h PRO 6 Cb 1.31 -0.14 -0.04 0.00 0.13 0.00 0.00 31.00 32.26 1ik0 h PRO 6 CO 0.51 0.40 0.44 0.66 -0.23 0.00 0.00 178.00 179.78 1ik0 h SER 7 N 0.63 1.02 -0.39 1.44 4.64 -1.96 -0.52 113.55 118.40 1ik0 h SER 7 Ca 0.23 -0.09 -0.13 0.00 -0.47 0.00 0.00 61.79 61.33 1ik0 h SER 7 Cb 0.07 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1ik0 h SER 7 CO -0.12 0.83 -0.26 0.74 -0.87 0.00 0.00 176.83 177.15 1ik0 h THR 8 N 1.14 1.28 -0.74 2.95 2.02 -1.82 -2.72 112.91 115.02 1ik0 h THR 8 Ca 0.29 -1.41 -0.06 0.00 0.77 0.00 0.00 66.41 66.00 1ik0 h THR 8 Cb 0.04 1.32 -0.03 0.00 -1.74 0.00 0.00 68.15 67.74 1ik0 h THR 8 CO -0.05 0.47 0.23 0.00 0.37 0.00 0.00 175.52 176.55 1ik0 h ALA 9 N 0.80 0.97 -0.21 6.16 0.00 -0.86 -2.03 119.26 124.08 1ik0 h ALA 9 Ca 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.77 1ik0 h ALA 9 Cb 0.83 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1ik0 h ALA 9 CO 0.07 0.65 0.14 1.25 0.00 0.00 0.00 179.25 181.36 1ik0 h LEU 10 N 1.10 0.24 -0.69 0.00 5.85 -0.98 0.28 115.31 121.12 1ik0 h LEU 10 Ca 0.24 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.95 1ik0 h LEU 10 Cb 0.31 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.24 1ik0 h LEU 10 CO -0.01 0.18 0.46 0.03 -0.34 0.00 0.00 178.44 178.76 1ik0 h ARG 11 N 0.28 0.91 -0.84 1.25 3.08 -1.29 0.49 114.38 118.26 1ik0 h ARG 11 Ca 0.08 -0.05 -0.04 0.00 0.07 0.00 0.00 59.98 60.04 1ik0 h ARG 11 Cb -0.02 -0.20 -0.04 0.00 0.08 0.00 0.00 29.97 29.78 1ik0 h ARG 11 CO -0.02 0.60 0.38 0.93 -1.07 0.00 0.00 179.97 180.80 1ik0 h GLU 12 N 0.94 1.22 -0.07 0.04 4.39 -0.85 -1.32 114.58 118.92 1ik0 h GLU 12 Ca 0.25 -0.19 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 1ik0 h GLU 12 Cb -0.11 -0.21 -0.00 0.00 -0.10 0.00 0.00 28.75 28.33 1ik0 h GLU 12 CO -0.06 0.95 -0.11 1.25 -1.16 0.00 0.00 179.01 179.89 1ik0 h LEU 13 N 1.20 0.22 -0.05 1.33 5.85 0.63 -2.58 115.31 121.91 1ik0 h LEU 13 Ca 0.29 -0.54 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1ik0 h LEU 13 Cb 0.15 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 41.12 1ik0 h LEU 13 CO -0.03 0.72 0.03 0.40 -0.34 0.00 0.00 178.44 179.22 1ik0 h ILE 14 N -0.28 1.02 -1.00 4.05 2.04 0.06 -0.80 117.51 122.59 1ik0 h ILE 14 Ca 0.01 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1ik0 h ILE 14 Cb 0.67 0.95 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 1ik0 h ILE 14 CO 0.03 0.01 0.66 -0.33 0.00 0.00 0.00 178.15 178.52 1ik0 h GLU 15 N 0.06 1.31 -0.20 2.37 5.08 -1.32 -1.71 114.58 120.17 1ik0 h GLU 15 Ca 0.02 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.17 1ik0 h GLU 15 Cb -0.00 -0.30 0.00 0.00 0.50 0.00 0.00 28.75 28.95 1ik0 h GLU 15 CO -0.00 0.87 -0.37 1.49 -1.00 0.00 0.00 179.01 179.99 1ik0 h GLU 16 N 1.35 0.60 -0.72 2.33 4.81 -1.19 -0.61 114.58 121.14 1ik0 h GLU 16 Ca 0.37 -0.38 0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1ik0 h GLU 16 Cb -0.15 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.24 1ik0 h GLU 16 CO -0.08 1.00 0.48 -0.07 -0.73 0.00 0.00 179.01 179.60 1ik0 h LEU 17 N 0.28 0.83 -0.45 1.64 3.38 -0.95 -1.78 115.31 118.27 1ik0 h LEU 17 Ca 0.01 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.83 1ik0 h LEU 17 Cb 0.97 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1ik0 h LEU 17 CO 0.08 0.61 -0.19 0.58 0.09 0.00 0.00 178.44 179.61 1ik0 h VAL 18 N 0.98 1.27 -1.00 1.22 2.07 -1.28 -2.96 116.25 116.55 1ik0 h VAL 18 Ca 0.26 -1.34 0.01 0.00 0.82 0.00 0.00 66.70 66.46 1ik0 h VAL 18 Cb -0.11 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 30.80 1ik0 h VAL 18 CO -0.06 0.46 0.66 0.78 0.02 0.00 0.00 177.57 179.43 1ik0 h ASN 19 N 0.76 1.15 1.58 0.57 2.35 -0.55 -1.33 115.58 120.10 1ik0 h ASN 19 Ca 0.10 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1ik0 h ASN 19 Cb 0.75 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.84 1ik0 h ASN 19 CO 0.06 0.84 0.00 0.16 -1.65 0.00 0.00 177.43 176.84 1ik0 h ILE 20 N 1.36 0.00 0.00 2.81 3.07 -1.29 -3.30 117.51 120.16 1ik0 h ILE 20 Ca 0.37 -0.65 -0.06 0.00 1.55 0.00 0.00 64.86 66.06 1ik0 h ILE 20 Cb -0.15 1.63 -0.01 0.00 -0.27 0.00 0.00 36.82 38.02 1ik0 h ILE 20 CO -0.08 0.00 -2.04 0.35 -1.05 0.00 0.00 178.15 175.33 1ik0 n THR 21 N -2.63 0.24 0.06 0.16 -2.24 -0.98 -3.97 114.28 104.92 1ik0 n THR 21 Ca 0.04 -0.55 -0.21 0.00 -2.27 0.00 0.00 64.05 61.07 1ik0 n THR 21 Cb 0.44 -0.07 -0.11 0.00 -2.10 0.00 0.00 70.33 68.49 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 0.67 -0.61 -0.78 4.20 -1.34 -3.27 115.11 113.98 1ik0 h GLN 22 Ca -0.09 -0.78 0.00 0.00 0.06 0.00 0.00 58.65 57.83 1ik0 h GLN 22 Cb 1.19 0.24 0.00 0.00 0.30 0.00 0.00 27.48 29.21 1ik0 h GLN 22 CO 0.01 1.35 0.00 0.27 -0.67 0.00 0.00 178.83 179.78 1ik0 n ASN 23 N -3.82 3.57 -4.71 1.46 6.94 -1.24 -4.92 115.26 112.53 1ik0 n ASN 23 Ca -0.12 -2.19 -0.41 0.00 -0.02 0.00 0.00 54.58 51.83 1ik0 n ASN 23 Cb 0.92 -0.46 -0.03 0.00 -2.36 0.00 0.00 39.78 37.85 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 -1.52 4.53 0.00 -3.83 -2.07 -1.23 -4.98 119.66 110.54 1ik0 s GLN 24 Ca 0.40 1.27 0.00 0.00 -1.82 0.00 0.00 55.36 55.21 1ik0 s GLN 24 Cb 0.24 -3.46 0.00 0.00 -1.09 0.00 0.00 33.01 28.70 1ik0 s GLN 24 CO 0.23 -0.02 0.00 1.17 -1.32 0.00 0.00 175.29 175.35 1ik0 n LYS 25 N 3.86 0.00 -2.16 9.60 4.81 -1.26 -4.94 118.16 128.08 1ik0 n LYS 25 Ca 0.04 0.09 -0.28 0.00 -0.87 0.00 0.00 58.31 57.28 1ik0 n LYS 25 Cb 0.51 -0.48 0.03 0.00 0.02 0.00 0.00 35.03 35.11 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 -3.97 3.12 0.79 3.14 0.00 -1.26 -5.01 121.76 118.58 1ik0 s ALA 26 Ca 0.00 -0.50 -0.15 0.00 0.00 0.00 0.00 51.96 51.31 1ik0 s ALA 26 Cb 0.00 -2.81 -0.04 0.00 0.00 0.00 0.00 23.12 20.27 1ik0 s ALA 26 CO 0.00 -0.91 0.32 -2.30 0.00 0.00 0.00 175.76 172.87 1ik0 n PRO 27 N -2.76 0.10 0.33 0.00 -0.02 -1.26 -4.92 135.00 126.48 1ik0 n PRO 27 Ca 0.05 0.07 -0.14 0.00 -2.02 0.00 0.00 63.50 61.46 1ik0 n PRO 27 Cb 0.57 -1.70 -0.07 0.00 -0.02 0.00 0.00 33.50 32.28 1ik0 n PRO 27 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1ik0 h LEU 28 N -0.71 -0.74-10.68 2.45 3.38 -1.96 -3.45 115.31 103.60 1ik0 h LEU 28 Ca -0.45 0.00 -0.46 0.00 0.09 0.00 0.00 57.88 57.07 1ik0 h LEU 28 Cb 1.33 0.19 0.10 0.00 0.09 0.00 0.00 40.66 42.37 1ik0 h LEU 28 CO 0.38 -0.36 0.22 0.00 0.09 0.00 0.00 178.44 178.77 1ik0 n ASN 30 N -3.07 2.30 -1.01 0.00 3.02 -1.26 -4.16 115.26 111.08 1ik0 n ASN 30 Ca 0.12 -1.94 -0.10 0.00 -0.03 0.00 0.00 54.58 52.63 1ik0 n ASN 30 Cb 0.60 -0.62 -0.02 0.00 -0.61 0.00 0.00 39.78 39.13 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 2.99 0.53 3.75 7.41 0.00 -1.26 -4.97 105.19 113.64 1ik0 n GLY 31 Ca 0.19 -0.50 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 1ik0 n GLY 31 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ik0 s SER 32 N -2.70 5.20 0.26 1.61 0.01 -1.26 -4.91 113.70 111.92 1ik0 s SER 32 Ca 0.00 2.42 0.11 0.00 1.31 0.00 0.00 55.95 59.78 1ik0 s SER 32 Cb 0.00 -2.60 -0.05 0.00 0.21 0.00 0.00 66.02 63.58 1ik0 s SER 32 CO 0.00 -1.59 -0.11 -0.04 0.41 0.00 0.00 173.24 171.91 1ik0 s MET 33 N -3.29 1.95 0.17 12.44 -1.94 -1.26 -2.67 119.30 124.69 1ik0 s MET 33 Ca 0.77 -1.58 0.05 0.00 -1.71 0.00 0.00 55.69 53.22 1ik0 s MET 33 Cb -0.31 -1.96 -0.05 0.00 2.01 0.00 0.00 34.83 34.52 1ik0 s MET 33 CO 0.34 0.35 -0.11 0.14 -0.01 0.00 0.00 175.02 175.73 1ik0 s VAL 34 N -2.35 1.35 0.08 -6.03 -7.23 0.74 -4.86 120.40 102.11 1ik0 s VAL 34 Ca 0.30 -2.11 -0.31 0.00 -1.81 0.00 0.00 61.98 58.05 1ik0 s VAL 34 Cb -0.06 -1.91 -0.06 0.00 0.56 0.00 0.00 36.38 34.91 1ik0 s VAL 34 CO 0.17 -0.70 1.23 0.26 -0.31 0.00 0.00 175.10 175.75 1ik0 s TRP 35 N -3.22 3.40 0.45 2.82 0.52 -1.26 -0.48 118.94 121.18 1ik0 s TRP 35 Ca 0.19 1.24 -0.23 0.00 0.02 0.00 0.00 56.10 57.32 1ik0 s TRP 35 Cb 0.02 -3.47 -0.07 0.00 -1.15 0.00 0.00 33.47 28.79 1ik0 s TRP 35 CO 0.03 -1.48 1.17 -1.54 0.02 0.00 0.00 176.95 175.15 1ik0 s SER 36 N 1.01 6.20 0.19 2.95 1.04 -1.09 -4.89 113.70 119.11 1ik0 s SER 36 Ca 0.59 2.33 0.03 0.00 0.48 0.00 0.00 55.95 59.38 1ik0 s SER 36 Cb -0.31 -2.61 -0.05 0.00 0.10 0.00 0.00 66.02 63.16 1ik0 s SER 36 CO 0.30 -0.90 -0.03 0.27 0.98 0.00 0.00 173.24 173.86 1ik0 s ILE 37 N -1.52 1.00 -0.22 -1.02 -4.36 -1.26 -4.86 121.20 108.96 1ik0 s ILE 37 Ca 0.63 -2.03 -0.23 0.00 -0.26 0.00 0.00 60.65 58.75 1ik0 s ILE 37 Cb -0.29 -2.14 -0.01 0.00 1.25 0.00 0.00 42.46 41.27 1ik0 s ILE 37 CO 0.36 -0.49 0.76 0.21 0.24 0.00 0.00 174.94 176.02 1ik0 s ASN 38 N -3.23 6.79 -0.26 4.36 3.04 -1.26 -5.00 114.94 119.38 1ik0 s ASN 38 Ca 0.24 0.97 -0.29 0.00 0.04 0.00 0.00 52.86 53.82 1ik0 s ASN 38 Cb 0.05 -2.41 0.00 0.00 -1.54 0.00 0.00 41.25 37.35 1ik0 s ASN 38 CO 0.05 -0.43 1.22 -0.76 -3.04 0.00 0.00 177.10 174.14 1ik0 s LEU 39 N 2.50 3.99 0.00 3.21 2.01 -1.26 -4.87 118.68 124.26 1ik0 s LEU 39 Ca 0.33 1.33 0.00 0.00 0.01 0.00 0.00 54.13 55.80 1ik0 s LEU 39 Cb -0.16 -3.54 0.00 0.00 0.01 0.00 0.00 46.19 42.50 1ik0 s LEU 39 CO 0.09 -0.91 0.00 0.35 1.01 0.00 0.00 176.35 176.88 1ik0 n THR 40 N 5.83 0.00 0.00 5.49 -2.24 -1.26 -5.07 114.28 117.03 1ik0 n THR 40 Ca 0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1ik0 n THR 40 Cb 0.46 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.69 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 -0.21 6.98 0.00 -1.26 -4.42 120.51 118.60 1ik0 n ALA 41 Ca 0.00 -0.02 -0.02 0.00 0.00 0.00 0.00 53.44 53.40 1ik0 n ALA 41 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 2.38 1.34 0.36 0.00 0.00 -1.26 -4.33 105.19 103.67 1ik0 n GLY 42 Ca 0.00 -0.21 -0.04 0.00 0.00 0.00 0.00 46.02 45.77 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 4.72 1.25 -0.28 1.61 0.00 -1.92 -1.38 114.93 118.93 1ik0 h MET 43 Ca 0.03 -0.16 0.01 0.00 0.00 0.00 0.00 59.70 59.58 1ik0 h MET 43 Cb 0.33 -0.24 -0.02 0.00 0.00 0.00 0.00 31.60 31.67 1ik0 h MET 43 CO 0.31 0.93 0.16 1.88 0.00 0.00 0.00 176.91 180.19 1ik0 h TYR 44 N 1.25 0.29 0.00 -0.22 -1.99 -1.91 0.67 116.97 115.07 1ik0 h TYR 44 Ca 0.31 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 61.05 1ik0 h TYR 44 Cb 0.07 -0.09 0.00 0.00 2.00 0.00 0.00 36.73 38.71 1ik0 h TYR 44 CO 0.01 0.17 -0.00 0.00 -0.00 0.00 0.00 178.16 178.34 1ik0 h ALA 46 N 0.62 0.44 -0.83 0.00 0.00 -1.10 -1.71 119.26 116.69 1ik0 h ALA 46 Ca -0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1ik0 h ALA 46 Cb 0.37 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.98 1ik0 h ALA 46 CO 0.00 -0.09 0.37 0.00 0.00 0.00 0.00 179.25 179.53 1ik0 h ALA 47 N 1.13 1.09 -0.00 0.00 0.00 0.39 -2.85 119.26 119.01 1ik0 h ALA 47 Ca 0.13 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ik0 h ALA 47 Cb -0.05 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.41 1ik0 h ALA 47 CO -0.03 0.67 -0.00 1.25 0.00 0.00 0.00 179.25 181.14 1ik0 h LEU 48 N 1.19 -0.00 -1.45 0.00 5.85 -0.04 -2.01 115.31 118.86 1ik0 h LEU 48 Ca 0.28 0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.02 1ik0 h LEU 48 Cb 0.16 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.16 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 -0.00 0.72 -0.69 1.25 4.11 -1.21 -0.42 114.58 118.33 1ik0 h GLU 49 Ca 0.00 -0.04 -0.06 0.00 0.07 0.00 0.00 59.36 59.33 1ik0 h GLU 49 Cb 0.00 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.06 1ik0 h GLU 49 CO -0.00 0.48 0.19 0.66 0.07 0.00 0.00 179.01 180.40 1ik0 h SER 50 N 0.74 1.02 0.12 3.06 4.64 -1.22 -2.46 113.55 119.45 1ik0 h SER 50 Ca 0.22 -0.20 -0.12 0.00 -0.47 0.00 0.00 61.79 61.23 1ik0 h SER 50 Cb -0.01 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 61.80 1ik0 h SER 50 CO -0.05 0.96 -0.41 -0.07 -0.87 0.00 0.00 176.83 176.39 1ik0 h LEU 51 N 1.04 0.39 -1.89 5.97 3.38 -0.45 -2.63 115.31 121.11 1ik0 h LEU 51 Ca 0.22 -0.17 0.07 0.00 0.09 0.00 0.00 57.88 58.09 1ik0 h LEU 51 Cb 0.33 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1ik0 h LEU 51 CO -0.00 0.76 0.44 0.40 0.09 0.00 0.00 178.44 180.13 1ik0 h ILE 52 N 0.31 0.19 0.00 1.22 1.08 -0.64 1.04 117.51 120.70 1ik0 h ILE 52 Ca 0.03 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.50 1ik0 h ILE 52 Cb 0.86 0.61 0.00 0.00 -3.07 0.00 0.00 36.82 35.22 1ik0 h ILE 52 CO 0.07 0.00 -0.12 0.78 -0.69 0.00 0.00 178.15 178.19 1ik0 h ASN 53 N 0.00 0.00 -3.51 1.72 -0.26 -1.51 -3.44 115.58 108.58 1ik0 h ASN 53 Ca 0.11 -0.02 -0.61 0.00 -0.56 0.00 0.00 56.30 55.22 1ik0 h ASN 53 Cb 0.99 0.00 -0.12 0.00 -1.06 0.00 0.00 38.32 38.13 1ik0 h ASN 53 CO -0.00 0.01 0.10 -0.69 -1.06 0.00 0.00 177.43 175.79 1ik0 s VAL 54 N -3.16 5.01 0.09 2.81 1.01 0.36 -5.05 120.40 121.46 1ik0 s VAL 54 Ca 0.08 1.05 0.07 0.00 0.00 0.00 0.00 61.98 63.18 1ik0 s VAL 54 Cb 0.09 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.54 1ik0 s VAL 54 CO 0.65 0.05 -0.17 -0.44 0.00 0.00 0.00 175.10 175.18 1ik0 s SER 55 N 1.49 2.08 0.00 3.32 0.01 -1.26 -4.81 113.70 114.53 1ik0 s SER 55 Ca 0.25 -0.66 0.00 0.00 1.31 0.00 0.00 55.95 56.84 1ik0 s SER 55 Cb -0.16 -0.09 0.00 0.00 0.21 0.00 0.00 66.02 65.98 1ik0 s SER 55 CO 0.09 -0.02 0.00 0.61 0.41 0.00 0.00 173.24 174.33 1ik0 n GLY 56 N 1.14 1.04 2.62 3.44 0.00 -1.26 -5.03 105.19 107.14 1ik0 n GLY 56 Ca -0.20 -0.47 -0.24 0.00 0.00 0.00 0.00 46.02 45.11 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 8.28 0.54 0.00 0.00 0.87 -1.97 -2.85 113.55 118.42 1ik0 h SER 58 Ca -0.16 -0.24 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 1ik0 h SER 58 Cb 1.03 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 62.84 1ik0 h SER 58 CO 0.39 0.90 0.45 0.00 -0.53 0.00 0.00 176.83 178.04 1ik0 h ALA 59 N 1.13 1.41 0.00 6.23 0.00 -1.94 0.23 119.26 126.31 1ik0 h ALA 59 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ik0 h ALA 59 Cb 0.92 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.71 1ik0 h ALA 59 CO 0.08 -0.41 0.00 0.44 0.00 0.00 0.00 179.25 179.36 1ik0 n ILE 60 N -2.52 0.00 -0.02 0.00 -5.35 -1.11 -4.63 119.36 105.73 1ik0 n ILE 60 Ca -0.01 -0.46 -0.11 0.00 -0.27 0.00 0.00 62.75 61.90 1ik0 n ILE 60 Cb 0.48 1.05 -0.04 0.00 -1.74 0.00 0.00 39.64 39.39 1ik0 n ILE 60 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1ik0 h GLU 61 N 0.00 0.19 -0.67 6.28 4.81 -0.31 0.48 114.58 125.35 1ik0 h GLU 61 Ca 0.00 -0.01 -0.04 0.00 -0.13 0.00 0.00 59.36 59.18 1ik0 h GLU 61 Cb 0.03 -0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1ik0 h GLU 61 CO 0.00 0.13 0.28 0.87 -0.73 0.00 0.00 179.01 179.55 1ik0 h LYS 62 N 0.20 0.99 -1.00 1.92 1.57 -1.84 -2.28 116.57 116.13 1ik0 h LYS 62 Ca 0.05 -0.16 0.02 0.00 -1.87 0.00 0.00 60.65 58.69 1ik0 h LYS 62 Cb -0.02 -0.17 -0.05 0.00 0.08 0.00 0.00 32.23 32.07 1ik0 h LYS 62 CO -0.01 0.80 0.66 1.15 -0.57 0.00 0.00 179.45 181.48 1ik0 h THR 63 N 0.97 1.24 -0.86 -0.16 2.02 -1.54 -1.77 112.91 112.81 1ik0 h THR 63 Ca 0.23 -0.46 0.01 0.00 0.77 0.00 0.00 66.41 66.96 1ik0 h THR 63 Cb 0.17 -0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 66.33 1ik0 h THR 63 CO -0.02 0.24 0.57 1.56 0.37 0.00 0.00 175.52 178.24 1ik0 h GLN 64 N 1.34 1.14 -0.24 6.66 4.20 -0.34 -0.11 115.11 127.74 1ik0 h GLN 64 Ca 0.37 -0.07 -0.02 0.00 0.06 0.00 0.00 58.65 59.00 1ik0 h GLN 64 Cb -0.12 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.39 1ik0 h GLN 64 CO -0.09 0.75 0.09 -0.09 -0.67 0.00 0.00 178.83 178.82 1ik0 h ARG 65 N 1.17 0.37 -0.86 1.46 2.43 -1.24 -0.54 114.38 117.17 1ik0 h ARG 65 Ca 0.32 -0.07 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 1ik0 h ARG 65 Cb -0.14 -0.06 -0.04 0.00 -0.42 0.00 0.00 29.97 29.32 1ik0 h ARG 65 CO -0.07 0.42 0.47 0.52 -1.51 0.00 0.00 179.97 179.80 1ik0 h MET 66 N 0.24 1.20 -0.67 0.20 2.86 -0.92 -1.48 114.93 116.35 1ik0 h MET 66 Ca 0.08 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.54 1ik0 h MET 66 Cb 0.20 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.59 1ik0 h MET 66 CO -0.01 0.88 0.26 -0.07 1.06 0.00 0.00 176.91 179.03 1ik0 h LEU 67 N 1.20 0.91 -1.01 1.22 3.38 -0.75 -1.82 115.31 118.43 1ik0 h LEU 67 Ca 0.30 -0.13 0.02 0.00 0.09 0.00 0.00 57.88 58.16 1ik0 h LEU 67 Cb 0.03 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 1ik0 h LEU 67 CO -0.05 0.81 0.66 0.28 0.09 0.00 0.00 178.44 180.24 1ik0 h SER 68 N 0.97 1.13 -0.99 -0.43 0.02 -0.09 0.15 113.55 114.30 1ik0 h SER 68 Ca 0.23 -0.02 0.29 0.00 -0.84 0.00 0.00 61.79 61.44 1ik0 h SER 68 Cb 0.20 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.43 1ik0 h SER 68 CO -0.02 0.80 0.71 1.23 -1.14 0.00 0.00 176.83 178.41 1ik0 h GLY 69 N 1.32 0.00 -1.43 -3.77 0.00 -0.61 1.17 103.07 99.75 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 -0.08 0.69 0.00 0.00 0.00 176.54 177.05 1ik0 n PHE 70 N -4.23 0.00 -3.64 5.60 3.72 -0.01 -4.61 117.46 114.29 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 -0.01 -0.11 0.00 -0.94 0.00 0.00 39.48 39.48 1ik0 n PHE 70 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ik0 n PRO 72 N 2.47 0.00 -3.79 0.00 -0.02 -1.23 -4.25 135.00 128.18 1ik0 n PRO 72 Ca 0.24 0.00 -0.27 0.00 -2.02 0.00 0.00 63.50 61.45 1ik0 n PRO 72 Cb 0.41 -0.99 -0.17 0.00 -0.02 0.00 0.00 33.50 32.74 1ik0 n PRO 72 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1ik0 s HIS 73 N -1.24 1.16 0.37 6.00 -3.43 -1.26 -5.13 115.29 111.77 1ik0 s HIS 73 Ca 0.00 -0.80 -0.25 0.00 -0.80 0.00 0.00 55.06 53.20 1ik0 s HIS 73 Cb 0.00 -1.07 -0.09 0.00 -1.43 0.00 0.00 32.58 29.99 1ik0 s HIS 73 CO 0.00 -0.56 1.08 0.15 -2.00 0.00 0.00 174.74 173.41 1ik0 s LYS 74 N 1.81 4.26 -0.12 -0.38 1.02 -1.26 -5.04 119.74 120.03 1ik0 s LYS 74 Ca 0.00 1.63 0.01 0.00 0.02 0.00 0.00 55.97 57.63 1ik0 s LYS 74 Cb -0.16 -2.72 -0.01 0.00 -0.52 0.00 0.00 37.83 34.42 1ik0 s LYS 74 CO -0.07 -0.08 -0.15 0.08 -0.92 0.00 0.00 175.35 174.20 1ik0 s VAL 75 N -1.50 2.89 0.52 3.17 1.01 -1.26 -5.11 120.40 120.11 1ik0 s VAL 75 Ca 0.54 -0.73 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1ik0 s VAL 75 Cb -0.26 -2.19 0.02 0.00 0.00 0.00 0.00 36.38 33.95 1ik0 s VAL 75 CO 0.32 0.53 0.74 -0.44 0.00 0.00 0.00 175.10 176.26 1ik0 s SER 76 N 0.28 5.48 0.00 3.32 0.01 -1.26 -4.94 113.70 116.58 1ik0 s SER 76 Ca -0.11 0.12 0.07 0.00 1.31 0.00 0.00 55.95 57.34 1ik0 s SER 76 Cb -0.16 -1.13 0.36 0.00 0.21 0.00 0.00 66.02 65.30 1ik0 s SER 76 CO 0.06 -0.99 1.12 0.00 0.41 0.00 0.00 173.24 173.84 1ik0 n ALA 77 N -2.26 1.49 -0.10 1.44 0.00 -1.26 -2.15 120.51 117.67 1ik0 n ALA 77 Ca 0.05 -0.03 -0.15 0.00 0.00 0.00 0.00 53.44 53.31 1ik0 n ALA 77 Cb 0.59 -1.12 -0.14 0.00 0.00 0.00 0.00 19.45 18.78 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 -0.68 -0.64 3.67 0.00 0.00 -1.26 -4.89 105.19 101.39 1ik0 n GLY 78 Ca 0.03 -0.23 -0.39 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.52 4.22 0.07 1.61 -1.52 -0.91 -5.07 119.66 115.54 1ik0 s GLN 79 Ca -0.23 0.43 0.06 0.00 -1.95 0.00 0.00 55.36 53.67 1ik0 s GLN 79 Cb 0.08 -3.54 -0.03 0.00 -0.22 0.00 0.00 33.01 29.30 1ik0 s GLN 79 CO 0.71 -0.10 -0.16 -0.06 -0.25 0.00 0.00 175.29 175.43 1ik0 s PHE 80 N 1.47 1.34 0.00 0.91 0.08 -1.26 -4.21 117.98 116.31 1ik0 s PHE 80 Ca 0.25 -0.42 0.00 0.00 0.12 0.00 0.00 56.93 56.87 1ik0 s PHE 80 Cb -0.15 -0.76 0.00 0.00 -0.57 0.00 0.00 43.02 41.53 1ik0 s PHE 80 CO 0.10 0.08 0.00 0.43 -0.10 0.00 0.00 175.22 175.73 1ik0 n SER 81 N 1.42 4.06 -0.15 1.36 7.64 -1.26 -4.83 113.62 121.86 1ik0 n SER 81 Ca -0.20 0.00 0.02 0.00 1.01 0.00 0.00 58.87 59.70 1ik0 n SER 81 Cb 0.54 0.33 0.03 0.00 -1.01 0.00 0.00 64.21 64.10 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 -1.90 1.84 -0.90 6.43 2.88 -1.26 -4.62 113.62 116.09 1ik0 n SER 82 Ca 0.00 -1.64 0.05 0.00 -1.33 0.00 0.00 58.87 55.95 1ik0 n SER 82 Cb 0.43 -0.04 0.19 0.00 -0.75 0.00 0.00 64.21 64.03 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 -0.06 2.57 0.06 2.46 7.99 -1.26 -4.08 117.00 124.68 1ik0 n LEU 83 Ca 0.03 -1.30 -0.10 0.00 -0.01 0.00 0.00 56.01 54.63 1ik0 n LEU 83 Cb 0.21 -0.38 0.01 0.00 -0.11 0.00 0.00 43.42 43.15 1ik0 n LEU 83 CO 0.02 0.49 0.30 0.45 -1.51 0.00 0.00 177.39 177.15 1ik0 h HIS 84 N 2.20 0.49 -3.94 -1.77 3.86 -1.94 -3.44 115.15 110.61 1ik0 h HIS 84 Ca 0.00 -0.24 -0.49 0.00 -1.16 0.00 0.00 60.37 58.48 1ik0 h HIS 84 Cb 0.79 -0.07 0.02 0.00 1.06 0.00 0.00 27.41 29.22 1ik0 h HIS 84 CO 0.37 1.01 0.43 0.54 0.86 0.00 0.00 177.93 181.15 1ik0 s VAL 85 N -3.47 3.58 -1.27 2.45 0.11 -1.26 -4.94 120.40 115.61 1ik0 s VAL 85 Ca -0.05 1.27 -0.09 0.00 -2.93 0.00 0.00 61.98 60.18 1ik0 s VAL 85 Cb 0.10 -3.69 0.18 0.00 -1.53 0.00 0.00 36.38 31.44 1ik0 s VAL 85 CO 0.84 0.07 1.86 0.54 -3.33 0.00 0.00 175.10 175.07 1ik0 n ARG 86 N 0.09 3.68 -2.17 1.54 1.74 -1.26 -4.98 116.66 115.30 1ik0 n ARG 86 Ca 0.04 -3.58 -0.28 0.00 -0.77 0.00 0.00 57.85 53.26 1ik0 n ARG 86 Cb 0.48 -2.90 0.16 0.00 -1.02 0.00 0.00 32.46 29.19 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 0.69 3.49 0.12 0.55 1.01 -1.26 -5.07 116.67 116.21 1ik0 s ASP 87 Ca 0.39 0.01 -0.06 0.00 0.71 0.00 0.00 52.55 53.60 1ik0 s ASP 87 Cb 0.09 -0.15 -0.06 0.00 1.01 0.00 0.00 42.92 43.82 1ik0 s ASP 87 CO 0.01 -2.46 0.38 -0.89 0.21 0.00 0.00 175.17 172.42 1ik0 s THR 88 N -3.64 5.15 0.39 -1.27 2.01 -1.26 -4.89 115.64 112.13 1ik0 s THR 88 Ca 0.72 0.16 -0.17 0.00 0.31 0.00 0.00 61.69 62.70 1ik0 s THR 88 Cb -0.04 -3.62 -0.09 0.00 0.01 0.00 0.00 72.50 68.75 1ik0 s THR 88 CO 0.50 0.11 0.85 -0.54 -0.69 0.00 0.00 174.62 174.84 1ik0 s LYS 89 N -2.45 4.06 0.14 4.92 1.02 -1.26 -2.67 119.74 123.51 1ik0 s LYS 89 Ca 0.39 0.85 0.04 0.00 0.02 0.00 0.00 55.97 57.27 1ik0 s LYS 89 Cb -0.13 -2.30 -0.04 0.00 -0.52 0.00 0.00 37.83 34.84 1ik0 s LYS 89 CO 0.22 0.03 -0.10 0.96 -0.92 0.00 0.00 175.35 175.54 1ik0 s ILE 90 N -2.16 1.12 0.46 2.17 -4.36 0.37 -4.87 121.20 113.92 1ik0 s ILE 90 Ca 0.57 -2.05 -0.24 0.00 -0.26 0.00 0.00 60.65 58.68 1ik0 s ILE 90 Cb -0.10 -1.83 -0.07 0.00 1.25 0.00 0.00 42.46 41.71 1ik0 s ILE 90 CO 0.18 -0.76 1.28 -1.61 0.24 0.00 0.00 174.94 174.27 1ik0 s GLU 91 N -3.76 3.70 0.27 0.37 2.02 -1.26 -0.18 118.70 119.86 1ik0 s GLU 91 Ca 0.16 2.07 -0.01 0.00 0.02 0.00 0.00 54.97 57.21 1ik0 s GLU 91 Cb 0.03 -2.53 0.46 0.00 0.10 0.00 0.00 34.13 32.19 1ik0 s GLU 91 CO -0.00 -0.69 1.86 0.28 0.02 0.00 0.00 175.26 176.73 1ik0 h VAL 92 N 2.03 1.03 -0.93 2.63 2.07 -1.85 -1.04 116.25 120.19 1ik0 h VAL 92 Ca -0.50 -0.38 0.12 0.00 0.82 0.00 0.00 66.70 66.76 1ik0 h VAL 92 Cb 1.26 -0.18 -0.08 0.00 -1.52 0.00 0.00 31.29 30.76 1ik0 h VAL 92 CO 0.60 0.20 0.56 0.00 0.02 0.00 0.00 177.57 178.96 1ik0 h ALA 93 N 1.49 1.39 -0.03 1.67 0.00 -1.90 -0.47 119.26 121.40 1ik0 h ALA 93 Ca 0.46 0.03 -0.21 0.00 0.00 0.00 0.00 54.91 55.19 1ik0 h ALA 93 Cb 0.29 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ik0 h ALA 93 CO -0.21 0.15 -0.88 1.96 0.00 0.00 0.00 179.25 180.27 1ik0 h GLN 94 N 0.89 0.43 -0.03 0.00 4.20 -1.60 -2.90 115.11 116.10 1ik0 h GLN 94 Ca 0.46 -0.42 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1ik0 h GLN 94 Cb 0.47 0.11 -0.00 0.00 0.30 0.00 0.00 27.48 28.36 1ik0 h GLN 94 CO -0.27 1.08 0.02 0.35 -0.67 0.00 0.00 178.83 179.34 1ik0 h PHE 95 N 0.26 0.04 -0.23 2.96 3.04 -0.14 -0.95 116.94 121.92 1ik0 h PHE 95 Ca -0.07 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.88 1ik0 h PHE 95 Cb 1.50 -0.01 -0.01 0.00 2.56 0.00 0.00 35.95 39.98 1ik0 h PHE 95 CO 0.06 0.02 0.12 0.28 -2.02 0.00 0.00 178.31 176.77 1ik0 h VAL 96 N 0.04 1.12 -0.36 1.41 2.07 -1.19 -2.03 116.25 117.32 1ik0 h VAL 96 Ca 0.01 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1ik0 h VAL 96 Cb -0.00 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 30.66 1ik0 h VAL 96 CO -0.00 0.12 0.24 0.11 0.02 0.00 0.00 177.57 178.05 1ik0 h LYS 97 N 0.26 0.48 -1.00 1.57 1.57 -1.35 -0.92 116.57 117.17 1ik0 h LYS 97 Ca 0.08 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1ik0 h LYS 97 Cb 0.08 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 32.23 1ik0 h LYS 97 CO -0.01 0.32 0.66 -0.44 -0.57 0.00 0.00 179.45 179.41 1ik0 h ASP 98 N 0.49 1.16 -0.56 0.86 3.32 -1.05 -1.29 116.42 119.35 1ik0 h ASP 98 Ca 0.13 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.10 1ik0 h ASP 98 Cb -0.06 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.18 1ik0 h ASP 98 CO -0.03 0.84 0.18 0.25 -1.72 0.00 0.00 179.24 178.76 1ik0 h LEU 99 N 1.36 0.85 -0.89 1.55 5.85 -0.83 -2.84 115.31 120.37 1ik0 h LEU 99 Ca 0.37 -0.14 0.08 0.00 0.84 0.00 0.00 57.88 59.02 1ik0 h LEU 99 Cb -0.15 -0.22 -0.07 0.00 0.37 0.00 0.00 40.66 40.59 1ik0 h LEU 99 CO -0.08 0.80 0.54 0.25 -0.34 0.00 0.00 178.44 179.62 1ik0 h LEU 100 N 0.88 0.83 -0.91 2.25 5.85 0.03 -0.58 115.31 123.66 1ik0 h LEU 100 Ca 0.20 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.96 1ik0 h LEU 100 Cb 0.26 -0.14 -0.05 0.00 0.37 0.00 0.00 40.66 41.11 1ik0 h LEU 100 CO -0.01 0.50 0.61 -0.07 -0.34 0.00 0.00 178.44 179.13 1ik0 h LEU 101 N 0.95 1.05 -0.31 2.25 -0.00 -1.37 -2.50 115.31 115.38 1ik0 h LEU 101 Ca 0.41 -0.03 -0.18 0.00 -0.00 0.00 0.00 57.88 58.07 1ik0 h LEU 101 Cb 0.27 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 40.67 1ik0 h LEU 101 CO -0.21 0.76 -0.53 0.45 -0.00 0.00 0.00 178.44 178.91 1ik0 h HIS 102 N 1.24 1.12 -0.01 1.13 3.86 -1.36 -2.52 115.15 118.61 1ik0 h HIS 102 Ca 0.34 -0.39 0.00 0.00 -1.16 0.00 0.00 60.37 59.16 1ik0 h HIS 102 Cb -0.14 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 28.12 1ik0 h HIS 102 CO -0.01 1.23 0.00 -0.07 0.86 0.00 0.00 177.93 179.94 1ik0 h LEU 103 N 0.69 0.00 -1.38 2.43 3.38 -0.78 -2.12 115.31 117.54 1ik0 h LEU 103 Ca 0.02 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.93 1ik0 h LEU 103 Cb 1.14 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.88 1ik0 h LEU 103 CO 0.12 0.00 -0.31 0.07 0.09 0.00 0.00 178.44 178.41 1ik0 h LYS 104 N 0.01 0.00 -0.17 1.13 2.10 -1.52 -3.11 116.57 115.01 1ik0 h LYS 104 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.64 1ik0 h LYS 104 Cb 0.00 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.32 1ik0 h LYS 104 CO -0.00 0.31 0.05 -0.22 -2.00 0.00 0.00 179.45 177.59 1ik0 h LYS 105 N 0.00 0.27 0.00 0.07 3.64 -0.94 -2.69 116.57 116.93 1ik0 h LYS 105 Ca -0.00 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 1ik0 h LYS 105 Cb 0.57 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1ik0 h LYS 105 CO 0.04 0.40 -0.07 -0.07 -2.27 0.00 0.00 179.45 177.48 1ik0 h LEU 106 N 0.09 0.00 -1.01 5.20 -0.00 -1.36 -2.15 115.31 116.08 1ik0 h LEU 106 Ca 0.05 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.94 1ik0 h LEU 106 Cb 0.25 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.86 1ik0 h LEU 106 CO -0.00 0.07 0.67 0.15 -0.00 0.00 0.00 178.44 179.33 1ik0 h PHE 107 N 0.00 1.27 -0.40 1.13 3.57 -1.47 -1.20 116.94 119.84 1ik0 h PHE 107 Ca -0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1ik0 h PHE 107 Cb 0.13 -0.43 -0.02 0.00 2.79 0.00 0.00 35.95 38.42 1ik0 h PHE 107 CO 0.00 0.80 0.26 0.00 -2.23 0.00 0.00 178.31 177.14 1ik0 h ARG 108 N 1.37 0.52 0.00 1.11 3.08 -1.38 -0.80 114.38 118.27 1ik0 h ARG 108 Ca 0.37 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1ik0 h ARG 108 Cb -0.16 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 29.77 1ik0 h ARG 108 CO -0.08 0.35 -0.30 0.39 -1.07 0.00 0.00 179.97 179.26 1ik0 n GLU 109 N -4.48 0.21 -0.74 0.04 1.02 -0.58 -4.89 120.64 111.23 1ik0 n GLU 109 Ca 0.03 0.11 0.00 0.00 -0.02 0.00 0.00 57.16 57.28 1ik0 n GLU 109 Cb 0.06 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 29.80 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 1.37 0.22 3.36 0.62 0.00 -0.31 -4.90 105.19 105.55 1ik0 n GLY 110 Ca 0.05 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.95 3.08 -0.01 1.61 0.52 -1.24 -5.04 118.95 116.92 1ik0 s ARG 111 Ca 0.00 -1.49 -0.14 0.00 -0.52 0.00 0.00 55.73 53.58 1ik0 s ARG 111 Cb 0.00 -4.31 -0.05 0.00 0.52 0.00 0.00 34.95 31.11 1ik0 s ARG 111 CO 0.00 -1.49 0.38 -0.06 0.02 0.00 0.00 175.30 174.15 1ik0 s PHE 112 N 2.30 3.71 0.00 -0.53 0.08 -1.26 -4.88 117.98 117.41 1ik0 s PHE 112 Ca 0.10 0.94 0.00 0.00 0.12 0.00 0.00 56.93 58.10 1ik0 s PHE 112 Cb -0.24 -2.25 0.00 0.00 -0.57 0.00 0.00 43.02 39.96 1ik0 s PHE 112 CO 0.04 0.65 0.00 0.09 -0.10 0.00 0.00 175.22 175.90