#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 1.68 0.94 3.03 0.00 -1.26 -4.96 107.32 106.75 1ik0 s GLY 2 Ca 0.00 0.26 -0.14 0.00 0.00 0.00 0.00 44.72 44.84 1ik0 s GLY 2 CO 0.00 0.60 0.23 -1.05 0.00 0.00 0.00 173.10 172.88 1ik0 n PRO 3 N -3.51 -0.21 -2.82 2.90 -0.01 -1.26 -4.94 135.00 125.15 1ik0 n PRO 3 Ca 0.09 -0.03 -0.34 0.00 -0.01 0.00 0.00 63.50 63.21 1ik0 n PRO 3 Cb 0.53 -1.72 -0.07 0.00 -0.01 0.00 0.00 33.50 32.23 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 -2.31 4.35 0.83 -1.45 -7.23 -1.26 -5.04 120.40 108.29 1ik0 s VAL 4 Ca 0.55 1.56 -0.11 0.00 -1.81 0.00 0.00 61.98 62.17 1ik0 s VAL 4 Cb -0.22 -3.72 0.09 0.00 0.56 0.00 0.00 36.38 33.09 1ik0 s VAL 4 CO 0.69 -0.18 1.09 -2.16 -0.31 0.00 0.00 175.10 174.24 1ik0 s PRO 5 N -2.84 1.83 0.24 4.82 0.04 -1.26 -4.78 135.00 133.05 1ik0 s PRO 5 Ca 0.58 0.95 -0.04 0.00 0.04 0.00 0.00 61.00 62.53 1ik0 s PRO 5 Cb -0.12 -1.86 0.42 0.00 0.04 0.00 0.00 34.50 32.98 1ik0 s PRO 5 CO 0.16 -1.88 1.76 -1.00 0.04 0.00 0.00 177.00 176.09 1ik0 h PRO 6 N -1.29 0.57 -0.96 0.56 0.13 -1.99 -1.36 132.00 127.66 1ik0 h PRO 6 Ca -0.46 -0.03 0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1ik0 h PRO 6 Cb 1.26 -0.13 -0.05 0.00 0.13 0.00 0.00 31.00 32.21 1ik0 h PRO 6 CO 0.54 0.38 0.62 0.66 -0.23 0.00 0.00 178.00 179.97 1ik0 h SER 7 N 0.58 1.11 -0.48 1.44 4.64 -1.95 -0.66 113.55 118.24 1ik0 h SER 7 Ca 0.40 -0.04 -0.13 0.00 -0.47 0.00 0.00 61.79 61.55 1ik0 h SER 7 Cb 0.51 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 62.31 1ik0 h SER 7 CO -0.32 0.82 -0.23 0.74 -0.87 0.00 0.00 176.83 176.96 1ik0 h THR 8 N 1.31 1.27 -0.63 2.95 2.02 -1.66 -2.63 112.91 115.54 1ik0 h THR 8 Ca 0.35 -1.40 -0.02 0.00 0.77 0.00 0.00 66.41 66.12 1ik0 h THR 8 Cb -0.13 1.14 -0.03 0.00 -1.74 0.00 0.00 68.15 67.38 1ik0 h THR 8 CO -0.07 0.48 0.33 0.00 0.37 0.00 0.00 175.52 176.63 1ik0 h ALA 9 N 0.87 0.81 -0.39 6.16 0.00 -0.46 -1.03 119.26 125.23 1ik0 h ALA 9 Ca 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ik0 h ALA 9 Cb 0.81 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 18.33 1ik0 h ALA 9 CO 0.07 0.34 0.25 1.25 0.00 0.00 0.00 179.25 181.15 1ik0 h LEU 10 N 0.86 0.45 -0.75 0.00 5.85 -1.00 0.32 115.31 121.03 1ik0 h LEU 10 Ca 0.22 -0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.92 1ik0 h LEU 10 Cb 0.06 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.94 1ik0 h LEU 10 CO -0.03 0.35 0.50 0.03 -0.34 0.00 0.00 178.44 178.94 1ik0 h ARG 11 N 0.52 0.98 -0.79 1.25 3.08 -1.12 0.50 114.38 118.80 1ik0 h ARG 11 Ca 0.14 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.08 1ik0 h ARG 11 Cb -0.03 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.76 1ik0 h ARG 11 CO -0.03 0.65 0.29 0.93 -1.07 0.00 0.00 179.97 180.75 1ik0 h GLU 12 N 1.01 1.19 -0.10 0.04 5.08 -0.49 -0.86 114.58 120.45 1ik0 h GLU 12 Ca 0.28 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 1ik0 h GLU 12 Cb -0.11 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 28.95 1ik0 h GLU 12 CO -0.06 0.97 -0.15 1.25 -1.00 0.00 0.00 179.01 180.02 1ik0 h LEU 13 N 1.15 0.31 -0.04 1.33 5.85 0.71 -2.42 115.31 122.21 1ik0 h LEU 13 Ca 0.26 -0.52 0.00 0.00 0.84 0.00 0.00 57.88 58.46 1ik0 h LEU 13 Cb 0.24 -0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.18 1ik0 h LEU 13 CO -0.02 0.77 0.03 0.40 -0.34 0.00 0.00 178.44 179.28 1ik0 h ILE 14 N -0.14 1.02 -0.94 4.05 2.04 0.08 -1.13 117.51 122.49 1ik0 h ILE 14 Ca 0.01 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.85 1ik0 h ILE 14 Cb 0.70 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.71 1ik0 h ILE 14 CO 0.03 0.01 0.62 -0.33 0.00 0.00 0.00 178.15 178.49 1ik0 h GLU 15 N 0.05 1.23 -0.13 2.37 5.08 -1.21 -1.80 114.58 120.16 1ik0 h GLU 15 Ca 0.01 -0.07 -0.07 0.00 -1.00 0.00 0.00 59.36 58.23 1ik0 h GLU 15 Cb 0.00 -0.28 -0.00 0.00 0.50 0.00 0.00 28.75 28.97 1ik0 h GLU 15 CO -0.00 0.81 -0.18 1.49 -1.00 0.00 0.00 179.01 180.13 1ik0 h GLU 16 N 1.27 0.35 -0.72 2.33 4.81 -1.20 -2.36 114.58 119.06 1ik0 h GLU 16 Ca 0.34 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.37 1ik0 h GLU 16 Cb -0.14 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 1ik0 h GLU 16 CO -0.08 0.78 0.46 -0.07 -0.73 0.00 0.00 179.01 179.38 1ik0 h LEU 17 N -0.05 0.84 -0.47 1.64 3.38 -1.06 -2.60 115.31 117.00 1ik0 h LEU 17 Ca 0.01 -0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 1ik0 h LEU 17 Cb 0.74 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 1ik0 h LEU 17 CO 0.04 0.63 0.03 0.58 0.09 0.00 0.00 178.44 179.81 1ik0 h VAL 18 N 0.98 1.26 -0.97 1.22 2.07 -1.35 -2.73 116.25 116.74 1ik0 h VAL 18 Ca 0.26 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.78 1ik0 h VAL 18 Cb -0.08 0.98 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 1ik0 h VAL 18 CO -0.05 0.35 0.64 -1.13 0.02 0.00 0.00 177.57 177.40 1ik0 h ASN 19 N 0.67 1.11 1.55 0.57 -0.73 -1.13 -0.67 115.58 116.95 1ik0 h ASN 19 Ca 0.14 -0.03 0.00 0.00 1.87 0.00 0.00 56.30 58.28 1ik0 h ASN 19 Cb 0.46 -0.28 0.00 0.00 0.27 0.00 0.00 38.32 38.78 1ik0 h ASN 19 CO 0.02 0.81 0.00 0.16 -0.37 0.00 0.00 177.43 178.05 1ik0 h ILE 20 N 1.31 0.00 0.00 2.57 3.07 -1.39 -3.29 117.51 119.78 1ik0 h ILE 20 Ca 0.35 -0.63 0.00 0.00 1.55 0.00 0.00 64.86 66.13 1ik0 h ILE 20 Cb -0.15 1.60 0.00 0.00 -0.27 0.00 0.00 36.82 38.01 1ik0 h ILE 20 CO -0.08 0.00 -1.77 0.35 -1.05 0.00 0.00 178.15 175.61 1ik0 n THR 21 N -2.60 0.00 0.17 0.16 -2.24 -0.90 -3.90 114.28 104.96 1ik0 n THR 21 Ca 0.04 -0.39 0.05 0.00 -2.27 0.00 0.00 64.05 61.49 1ik0 n THR 21 Cb 0.44 0.21 0.14 0.00 -2.10 0.00 0.00 70.33 69.02 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 -0.09 -0.78 4.20 -1.20 -3.19 115.11 114.05 1ik0 h GLN 22 Ca 0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1ik0 h GLN 22 Cb 0.87 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.65 1ik0 h GLN 22 CO 0.00 0.38 0.00 0.09 -0.67 0.00 0.00 178.83 178.63 1ik0 n ASN 23 N -3.25 3.01 -4.65 1.46 3.02 -1.25 -4.91 115.26 108.69 1ik0 n ASN 23 Ca 0.02 -1.97 -0.41 0.00 -0.03 0.00 0.00 54.58 52.19 1ik0 n ASN 23 Cb 0.64 -0.04 -0.05 0.00 -0.61 0.00 0.00 39.78 39.72 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 -1.85 4.19 0.14 3.52 -2.07 -1.21 -4.91 119.66 117.47 1ik0 s GLN 24 Ca 0.29 0.85 0.05 0.00 -1.82 0.00 0.00 55.36 54.73 1ik0 s GLN 24 Cb 0.20 -3.63 -0.12 0.00 -1.09 0.00 0.00 33.01 28.37 1ik0 s GLN 24 CO 0.29 -0.44 1.32 -0.22 -1.32 0.00 0.00 175.29 174.92 1ik0 h LYS 25 N 7.64 0.08 -4.28 9.60 1.63 -1.91 -3.47 116.57 125.87 1ik0 h LYS 25 Ca -0.25 -0.11 -0.16 0.00 -0.85 0.00 0.00 60.65 59.28 1ik0 h LYS 25 Cb 1.11 0.04 -0.14 0.00 -0.60 0.00 0.00 32.23 32.63 1ik0 h LYS 25 CO 0.84 0.98 -0.58 0.00 -3.45 0.00 0.00 179.45 177.24 1ik0 s ALA 26 N -2.90 0.61 0.13 5.00 0.00 -1.26 -5.11 121.76 118.22 1ik0 s ALA 26 Ca -0.01 -1.30 -0.33 0.00 0.00 0.00 0.00 51.96 50.32 1ik0 s ALA 26 Cb 0.10 0.79 -0.18 0.00 0.00 0.00 0.00 23.12 23.83 1ik0 s ALA 26 CO 0.82 -0.51 0.89 -2.30 0.00 0.00 0.00 175.76 174.66 1ik0 n PRO 27 N -0.10 0.33 -0.29 0.00 -0.02 -1.26 -4.84 135.00 128.82 1ik0 n PRO 27 Ca -0.07 0.12 -0.06 0.00 -2.02 0.00 0.00 63.50 61.47 1ik0 n PRO 27 Cb 0.63 -1.43 0.07 0.00 -0.02 0.00 0.00 33.50 32.75 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 2.32 1.10-10.48 2.45 3.38 -1.97 -3.44 115.31 108.68 1ik0 h LEU 28 Ca -0.40 -0.17 -0.48 0.00 0.09 0.00 0.00 57.88 56.92 1ik0 h LEU 28 Cb 1.41 -0.29 0.07 0.00 0.09 0.00 0.00 40.66 41.94 1ik0 h LEU 28 CO 0.63 0.97 0.31 0.00 0.09 0.00 0.00 178.44 180.45 1ik0 n ASN 30 N -2.87 3.95 -0.70 0.00 3.02 -1.26 -4.13 115.26 113.27 1ik0 n ASN 30 Ca 0.06 -2.22 -0.09 0.00 -0.03 0.00 0.00 54.58 52.30 1ik0 n ASN 30 Cb 0.58 -0.95 -0.04 0.00 -0.61 0.00 0.00 39.78 38.76 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 3.56 1.08 3.78 7.41 0.00 -1.26 -4.96 105.19 114.80 1ik0 n GLY 31 Ca 0.35 -0.62 -0.41 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.90 6.21 0.22 1.61 0.01 -1.26 -4.89 113.70 112.69 1ik0 s SER 32 Ca 0.00 3.01 0.09 0.00 1.31 0.00 0.00 55.95 60.36 1ik0 s SER 32 Cb 0.00 -2.66 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 1ik0 s SER 32 CO 0.00 -0.96 -0.08 -0.04 0.41 0.00 0.00 173.24 172.57 1ik0 s MET 33 N -2.20 2.10 0.20 12.44 -1.94 -1.26 -2.61 119.30 126.03 1ik0 s MET 33 Ca 0.55 -1.36 0.06 0.00 -1.71 0.00 0.00 55.69 53.23 1ik0 s MET 33 Cb -0.46 -2.12 -0.05 0.00 2.01 0.00 0.00 34.83 34.21 1ik0 s MET 33 CO 0.61 0.40 -0.09 0.14 -0.01 0.00 0.00 175.02 176.07 1ik0 s VAL 34 N -1.97 1.37 0.10 -6.03 -7.23 0.75 -4.83 120.40 102.56 1ik0 s VAL 34 Ca 0.27 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 58.03 1ik0 s VAL 34 Cb -0.08 -2.07 -0.06 0.00 0.56 0.00 0.00 36.38 34.73 1ik0 s VAL 34 CO 0.17 -0.57 1.18 0.26 -0.31 0.00 0.00 175.10 175.83 1ik0 s TRP 35 N -3.20 3.47 0.57 2.82 0.52 -1.26 -0.19 118.94 121.66 1ik0 s TRP 35 Ca 0.22 1.38 -0.19 0.00 0.02 0.00 0.00 56.10 57.54 1ik0 s TRP 35 Cb 0.02 -3.39 -0.05 0.00 -1.15 0.00 0.00 33.47 28.91 1ik0 s TRP 35 CO 0.05 -1.12 1.12 -1.54 0.02 0.00 0.00 176.95 175.49 1ik0 s SER 36 N 0.69 5.60 0.17 2.95 1.04 -1.21 -4.89 113.70 118.04 1ik0 s SER 36 Ca 0.56 2.14 0.02 0.00 0.48 0.00 0.00 55.95 59.14 1ik0 s SER 36 Cb -0.30 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.20 1ik0 s SER 36 CO 0.31 -1.30 -0.01 0.27 0.98 0.00 0.00 173.24 173.49 1ik0 s ILE 37 N -1.89 0.73 -0.20 -1.02 -4.36 -1.26 -4.96 121.20 108.24 1ik0 s ILE 37 Ca 0.71 -1.98 -0.22 0.00 -0.26 0.00 0.00 60.65 58.90 1ik0 s ILE 37 Cb -0.23 -2.06 -0.02 0.00 1.25 0.00 0.00 42.46 41.40 1ik0 s ILE 37 CO 0.30 -0.53 0.69 0.20 0.24 0.00 0.00 174.94 175.84 1ik0 s ASN 38 N -3.16 6.76 -0.41 4.36 0.01 -1.26 -5.01 114.94 116.23 1ik0 s ASN 38 Ca 0.22 0.93 -0.28 0.00 -0.71 0.00 0.00 52.86 53.02 1ik0 s ASN 38 Cb 0.06 -2.38 0.02 0.00 0.41 0.00 0.00 41.25 39.36 1ik0 s ASN 38 CO 0.03 -0.32 1.06 -0.76 -1.51 0.00 0.00 177.10 175.59 1ik0 s LEU 39 N 2.05 3.82 0.00 0.60 2.01 -1.26 -4.84 118.68 121.07 1ik0 s LEU 39 Ca 0.31 0.61 0.00 0.00 0.01 0.00 0.00 54.13 55.06 1ik0 s LEU 39 Cb -0.16 -3.46 0.00 0.00 0.01 0.00 0.00 46.19 42.58 1ik0 s LEU 39 CO 0.11 -1.06 0.00 0.35 1.01 0.00 0.00 176.35 176.76 1ik0 n THR 40 N 6.38 0.00 0.00 5.49 -2.24 -1.26 -5.06 114.28 117.59 1ik0 n THR 40 Ca 0.10 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.88 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 -0.27 6.98 0.00 -1.26 -4.47 120.51 118.48 1ik0 n ALA 41 Ca 0.00 -0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 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 2.49 1.50 0.35 0.00 0.00 -1.26 -4.34 105.19 103.93 1ik0 n GLY 42 Ca 0.00 -0.28 -0.04 0.00 0.00 0.00 0.00 46.02 45.70 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 4.51 1.21 -0.14 1.61 0.00 -1.90 0.01 114.93 120.23 1ik0 h MET 43 Ca 0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 59.70 59.59 1ik0 h MET 43 Cb 0.44 -0.23 -0.01 0.00 0.00 0.00 0.00 31.60 31.80 1ik0 h MET 43 CO 0.30 0.90 0.09 1.88 0.00 0.00 0.00 176.91 180.08 1ik0 h TYR 44 N 1.21 0.19 -0.01 -0.22 0.05 -1.95 0.15 116.97 116.39 1ik0 h TYR 44 Ca 0.30 -0.00 -0.00 0.00 0.05 0.00 0.00 58.73 59.08 1ik0 h TYR 44 Cb 0.05 -0.06 -0.00 0.00 1.01 0.00 0.00 36.73 37.73 1ik0 h TYR 44 CO 0.01 0.17 -0.00 0.00 -1.05 0.00 0.00 178.16 177.29 1ik0 h ALA 46 N 0.68 0.42 -0.71 0.00 0.00 -0.93 -2.37 119.26 116.36 1ik0 h ALA 46 Ca 0.00 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.85 1ik0 h ALA 46 Cb 0.33 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 1ik0 h ALA 46 CO 0.00 -0.11 0.27 0.00 0.00 0.00 0.00 179.25 179.41 1ik0 h ALA 47 N 1.12 1.15 -0.00 0.00 0.00 -0.66 -2.91 119.26 117.95 1ik0 h ALA 47 Ca 0.12 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ik0 h ALA 47 Cb -0.05 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1ik0 h ALA 47 CO -0.03 0.61 0.00 1.25 0.00 0.00 0.00 179.25 181.08 1ik0 h LEU 48 N 1.02 0.00 -1.02 0.00 5.85 -0.53 -1.96 115.31 118.67 1ik0 h LEU 48 Ca 0.24 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.98 1ik0 h LEU 48 Cb 0.21 -0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.18 1ik0 h LEU 48 CO -0.02 0.01 0.66 1.05 -0.34 0.00 0.00 178.44 179.80 1ik0 h GLU 49 N -0.00 1.25 -1.01 1.25 4.11 -1.36 -0.50 114.58 118.31 1ik0 h GLU 49 Ca 0.00 -0.08 0.01 0.00 0.07 0.00 0.00 59.36 59.36 1ik0 h GLU 49 Cb 0.01 -0.28 -0.05 0.00 0.50 0.00 0.00 28.75 28.92 1ik0 h GLU 49 CO -0.00 0.83 0.67 0.77 0.07 0.00 0.00 179.01 181.34 1ik0 h SER 50 N 1.29 1.16 -0.40 3.06 0.02 -1.27 -2.30 113.55 115.10 1ik0 h SER 50 Ca 0.39 -0.03 -0.14 0.00 -0.84 0.00 0.00 61.79 61.16 1ik0 h SER 50 Cb -0.04 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.20 1ik0 h SER 50 CO -0.11 0.84 -0.30 -0.07 -1.14 0.00 0.00 176.83 176.04 1ik0 h LEU 51 N 1.37 0.98 -1.42 5.07 3.38 -0.48 -2.66 115.31 121.53 1ik0 h LEU 51 Ca 0.37 -0.41 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1ik0 h LEU 51 Cb -0.16 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.32 1ik0 h LEU 51 CO -0.08 1.20 0.20 0.40 0.09 0.00 0.00 178.44 180.24 1ik0 h ILE 52 N 0.78 0.00 0.00 1.22 1.08 -0.55 0.60 117.51 120.64 1ik0 h ILE 52 Ca 0.08 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.55 1ik0 h ILE 52 Cb 0.88 0.47 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1ik0 h ILE 52 CO 0.08 0.00 -0.39 0.78 -0.69 0.00 0.00 178.15 177.93 1ik0 h ASN 53 N 0.00 0.00 -3.54 1.72 2.35 -1.42 -3.44 115.58 111.25 1ik0 h ASN 53 Ca 0.00 -0.11 -0.61 0.00 -0.55 0.00 0.00 56.30 55.02 1ik0 h ASN 53 Cb 0.40 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 38.64 1ik0 h ASN 53 CO 0.00 0.06 0.05 -0.69 -1.65 0.00 0.00 177.43 175.20 1ik0 s VAL 54 N -3.16 5.03 0.14 2.81 1.01 0.21 -5.06 120.40 121.39 1ik0 s VAL 54 Ca 0.07 0.97 0.11 0.00 0.00 0.00 0.00 61.98 63.13 1ik0 s VAL 54 Cb 0.12 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1ik0 s VAL 54 CO 0.68 0.06 -0.26 -0.44 0.00 0.00 0.00 175.10 175.14 1ik0 s SER 55 N 1.52 3.28 0.00 3.32 0.01 -1.26 -4.75 113.70 115.81 1ik0 s SER 55 Ca 0.23 -0.78 0.00 0.00 1.31 0.00 0.00 55.95 56.72 1ik0 s SER 55 Cb -0.16 -0.22 0.00 0.00 0.21 0.00 0.00 66.02 65.85 1ik0 s SER 55 CO 0.09 0.15 0.00 0.61 0.41 0.00 0.00 173.24 174.50 1ik0 n GLY 56 N 0.76 0.98 2.65 3.44 0.00 -1.26 -5.01 105.19 106.74 1ik0 n GLY 56 Ca -0.17 -0.49 -0.21 0.00 0.00 0.00 0.00 46.02 45.15 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 6.95 0.73 -0.40 0.00 0.87 -1.97 -2.69 113.55 117.04 1ik0 h SER 58 Ca 0.06 -0.11 0.12 0.00 -1.23 0.00 0.00 61.79 60.63 1ik0 h SER 58 Cb 1.02 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.78 1ik0 h SER 58 CO 0.22 0.69 0.51 0.00 -0.53 0.00 0.00 176.83 177.72 1ik0 h ALA 59 N 1.41 2.08 -0.00 6.23 0.00 -1.97 -0.21 119.26 126.80 1ik0 h ALA 59 Ca 0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1ik0 h ALA 59 Cb 0.22 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1ik0 h ALA 59 CO -0.01 -0.72 -0.72 0.44 0.00 0.00 0.00 179.25 178.24 1ik0 n ILE 60 N -3.52 0.00 -0.38 0.00 -5.35 -1.02 -4.43 119.36 104.66 1ik0 n ILE 60 Ca 0.07 -0.14 -0.02 0.00 -0.27 0.00 0.00 62.75 62.39 1ik0 n ILE 60 Cb 0.68 1.00 0.11 0.00 -1.74 0.00 0.00 39.64 39.69 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 0.03 1.32 -0.89 6.28 5.08 -0.97 -0.78 114.58 124.65 1ik0 h GLU 61 Ca 0.00 -0.08 -0.02 0.00 -1.00 0.00 0.00 59.36 58.26 1ik0 h GLU 61 Cb 0.36 -0.30 -0.04 0.00 0.50 0.00 0.00 28.75 29.27 1ik0 h GLU 61 CO 0.00 0.88 0.47 0.87 -1.00 0.00 0.00 179.01 180.23 1ik0 h LYS 62 N 1.36 1.24 -0.96 2.33 1.57 -1.77 -2.09 116.57 118.26 1ik0 h LYS 62 Ca 0.37 -0.15 0.01 0.00 -1.87 0.00 0.00 60.65 59.01 1ik0 h LYS 62 Cb -0.16 -0.24 -0.05 0.00 0.08 0.00 0.00 32.23 31.87 1ik0 h LYS 62 CO -0.08 0.92 0.63 1.15 -0.57 0.00 0.00 179.45 181.50 1ik0 h THR 63 N 1.24 1.24 -1.01 -0.16 2.02 -1.41 -1.97 112.91 112.87 1ik0 h THR 63 Ca 0.31 -0.44 0.01 0.00 0.77 0.00 0.00 66.41 67.06 1ik0 h THR 63 Cb 0.05 -0.16 -0.05 0.00 -1.74 0.00 0.00 68.15 66.24 1ik0 h THR 63 CO -0.05 0.24 0.67 1.56 0.37 0.00 0.00 175.52 178.31 1ik0 h GLN 64 N 1.29 1.32 -0.33 6.66 4.20 -0.63 -0.69 115.11 126.94 1ik0 h GLN 64 Ca 0.35 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.97 1ik0 h GLN 64 Cb -0.14 -0.30 -0.02 0.00 0.30 0.00 0.00 27.48 27.33 1ik0 h GLN 64 CO -0.08 0.87 0.15 0.00 -0.67 0.00 0.00 178.83 179.11 1ik0 h ARG 65 N 1.36 0.48 -0.73 1.46 3.08 -1.21 -1.10 114.38 117.72 1ik0 h ARG 65 Ca 0.37 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 60.28 1ik0 h ARG 65 Cb -0.14 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.79 1ik0 h ARG 65 CO -0.09 0.45 0.20 0.52 -1.07 0.00 0.00 179.97 179.99 1ik0 h MET 66 N 0.40 1.15 -0.85 0.04 2.86 -1.16 -2.55 114.93 114.81 1ik0 h MET 66 Ca 0.11 -0.26 -0.03 0.00 -2.06 0.00 0.00 59.70 57.46 1ik0 h MET 66 Cb 0.13 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.60 1ik0 h MET 66 CO -0.01 0.99 0.40 -0.07 1.06 0.00 0.00 176.91 179.28 1ik0 h LEU 67 N 1.09 1.11 -1.68 1.22 3.38 -0.87 -1.84 115.31 117.72 1ik0 h LEU 67 Ca 0.23 -0.14 0.10 0.00 0.09 0.00 0.00 57.88 58.17 1ik0 h LEU 67 Cb 0.34 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 1ik0 h LEU 67 CO -0.00 0.94 0.40 0.28 0.09 0.00 0.00 178.44 180.14 1ik0 h SER 68 N 1.21 0.32 -0.56 -0.43 0.02 -0.78 0.60 113.55 113.93 1ik0 h SER 68 Ca 0.29 0.01 0.11 0.00 -0.84 0.00 0.00 61.79 61.36 1ik0 h SER 68 Cb 0.13 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 62.58 1ik0 h SER 68 CO -0.04 0.19 0.38 1.23 -1.14 0.00 0.00 176.83 177.45 1ik0 h GLY 69 N 0.36 0.43 0.72 -3.77 0.00 -1.20 0.16 103.07 99.76 1ik0 h GLY 69 Ca 0.27 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.48 1ik0 h GLY 69 CO -0.07 0.07 -0.82 0.69 0.00 0.00 0.00 176.54 176.41 1ik0 n PHE 70 N -4.46 0.20 -3.55 5.60 3.72 0.13 -4.54 117.46 114.57 1ik0 n PHE 70 Ca 0.09 0.06 -0.27 0.00 -0.05 0.00 0.00 57.45 57.28 1ik0 n PHE 70 Cb 0.42 -0.37 -0.10 0.00 -0.94 0.00 0.00 39.48 38.49 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 2.32 0.00 -3.56 0.00 -0.02 -1.01 -4.43 135.00 128.30 1ik0 n PRO 72 Ca 0.26 0.03 -0.38 0.00 -2.02 0.00 0.00 63.50 61.39 1ik0 n PRO 72 Cb 0.44 -1.51 -0.11 0.00 -0.02 0.00 0.00 33.50 32.30 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 -1.87 3.22 0.05 6.00 -3.43 -1.26 -5.06 115.29 112.95 1ik0 s HIS 73 Ca 0.00 0.12 -0.30 0.00 -0.80 0.00 0.00 55.06 54.08 1ik0 s HIS 73 Cb 0.00 -2.41 -0.04 0.00 -1.43 0.00 0.00 32.58 28.69 1ik0 s HIS 73 CO 0.00 -0.19 1.01 0.15 -2.00 0.00 0.00 174.74 173.71 1ik0 s LYS 74 N 1.79 4.59 -0.23 -0.38 1.02 -1.26 -5.03 119.74 120.24 1ik0 s LYS 74 Ca 0.08 1.50 -0.07 0.00 0.02 0.00 0.00 55.97 57.50 1ik0 s LYS 74 Cb -0.16 -3.41 -0.03 0.00 -0.52 0.00 0.00 37.83 33.71 1ik0 s LYS 74 CO 0.11 0.01 0.05 0.14 -0.92 0.00 0.00 175.35 174.74 1ik0 s VAL 75 N 0.63 4.25 0.51 3.17 -7.23 -1.26 -5.06 120.40 115.41 1ik0 s VAL 75 Ca 0.51 -0.20 0.00 0.00 -1.81 0.00 0.00 61.98 60.48 1ik0 s VAL 75 Cb -0.23 -2.97 0.02 0.00 0.56 0.00 0.00 36.38 33.76 1ik0 s VAL 75 CO 0.29 0.37 0.74 -0.94 -0.31 0.00 0.00 175.10 175.26 1ik0 s SER 76 N 1.35 5.55 0.00 4.85 1.04 -1.26 -4.92 113.70 120.31 1ik0 s SER 76 Ca 0.05 0.19 0.04 0.00 0.48 0.00 0.00 55.95 56.71 1ik0 s SER 76 Cb -0.15 -1.25 0.19 0.00 0.10 0.00 0.00 66.02 64.92 1ik0 s SER 76 CO 0.03 -0.94 0.84 0.00 0.98 0.00 0.00 173.24 174.14 1ik0 n ALA 77 N -2.25 1.47 -0.11 5.32 0.00 -1.26 -1.55 120.51 122.12 1ik0 n ALA 77 Ca 0.05 -0.02 -0.14 0.00 0.00 0.00 0.00 53.44 53.33 1ik0 n ALA 77 Cb 0.59 -1.06 -0.13 0.00 0.00 0.00 0.00 19.45 18.85 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 -0.90 -0.62 3.67 0.00 0.00 -1.26 -4.90 105.19 101.18 1ik0 n GLY 78 Ca 0.02 -0.23 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.48 4.22 0.07 1.61 -0.21 -0.60 -5.06 119.66 117.21 1ik0 s GLN 79 Ca -0.22 0.43 0.06 0.00 0.02 0.00 0.00 55.36 55.64 1ik0 s GLN 79 Cb 0.07 -3.54 -0.03 0.00 1.00 0.00 0.00 33.01 30.51 1ik0 s GLN 79 CO 0.67 -0.10 -0.15 -0.06 -2.12 0.00 0.00 175.29 173.53 1ik0 s PHE 80 N 1.47 1.29 0.00 0.91 0.08 -1.26 -4.18 117.98 116.29 1ik0 s PHE 80 Ca 0.25 -0.45 0.00 0.00 0.12 0.00 0.00 56.93 56.85 1ik0 s PHE 80 Cb -0.15 -0.73 0.00 0.00 -0.57 0.00 0.00 43.02 41.57 1ik0 s PHE 80 CO 0.10 0.07 0.00 0.43 -0.10 0.00 0.00 175.22 175.72 1ik0 n SER 81 N 1.30 0.49 -0.85 1.36 7.64 -1.26 -4.85 113.62 117.45 1ik0 n SER 81 Ca -0.21 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.78 1ik0 n SER 81 Cb 0.54 0.00 0.09 0.00 -1.01 0.00 0.00 64.21 63.83 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 -2.84 2.77 -0.79 6.43 2.88 -1.26 -4.37 113.62 116.45 1ik0 n SER 82 Ca 0.00 -1.89 0.02 0.00 -1.33 0.00 0.00 58.87 55.67 1ik0 n SER 82 Cb 0.42 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 63.99 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 1.19 2.06 0.23 2.46 4.32 -1.26 -3.80 117.00 122.21 1ik0 n LEU 83 Ca 0.12 -1.04 0.13 0.00 -0.02 0.00 0.00 56.01 55.21 1ik0 n LEU 83 Cb 0.53 -0.48 0.34 0.00 -1.62 0.00 0.00 43.42 42.19 1ik0 n LEU 83 CO 0.13 0.33 0.85 0.45 -1.22 0.00 0.00 177.39 177.94 1ik0 h HIS 84 N 1.06 0.00 -3.96 -1.77 3.86 -1.95 -3.44 115.15 108.95 1ik0 h HIS 84 Ca 0.00 0.00 -0.47 0.00 -1.16 0.00 0.00 60.37 58.74 1ik0 h HIS 84 Cb 0.79 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.27 1ik0 h HIS 84 CO 0.26 0.03 0.39 0.14 0.86 0.00 0.00 177.93 179.62 1ik0 s VAL 85 N -3.36 3.88 -0.43 2.45 -7.23 -1.25 -4.93 120.40 109.54 1ik0 s VAL 85 Ca 0.05 1.43 -0.03 0.00 -1.81 0.00 0.00 61.98 61.61 1ik0 s VAL 85 Cb 0.07 -3.73 0.12 0.00 0.56 0.00 0.00 36.38 33.40 1ik0 s VAL 85 CO 0.63 -0.01 2.53 0.54 -0.31 0.00 0.00 175.10 178.48 1ik0 n ARG 86 N -0.04 2.24 -1.87 4.82 1.74 -1.26 -4.95 116.66 117.35 1ik0 n ARG 86 Ca 0.05 -2.17 -0.29 0.00 -0.77 0.00 0.00 57.85 54.67 1ik0 n ARG 86 Cb 0.50 -2.00 0.08 0.00 -1.02 0.00 0.00 32.46 30.03 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 0.21 4.62 0.57 0.55 1.01 -1.26 -5.06 116.67 117.31 1ik0 s ASP 87 Ca 0.51 0.87 -0.02 0.00 0.71 0.00 0.00 52.55 54.62 1ik0 s ASP 87 Cb 0.35 -1.43 0.03 0.00 1.01 0.00 0.00 42.92 42.88 1ik0 s ASP 87 CO -0.15 -1.84 0.83 0.42 0.21 0.00 0.00 175.17 174.64 1ik0 s THR 88 N -3.51 3.01 0.33 -1.27 -4.23 -1.26 -4.89 115.64 103.82 1ik0 s THR 88 Ca 0.61 -0.42 -0.01 0.00 -1.18 0.00 0.00 61.69 60.69 1ik0 s THR 88 Cb -0.11 -3.17 -0.04 0.00 1.34 0.00 0.00 72.50 70.52 1ik0 s THR 88 CO 0.50 -0.15 0.54 -0.54 -0.54 0.00 0.00 174.62 174.43 1ik0 s LYS 89 N -4.88 3.52 0.22 3.99 1.02 -1.26 -3.36 119.74 118.99 1ik0 s LYS 89 Ca 0.56 -0.25 0.05 0.00 0.02 0.00 0.00 55.97 56.34 1ik0 s LYS 89 Cb -0.10 -2.67 -0.05 0.00 -0.52 0.00 0.00 37.83 34.49 1ik0 s LYS 89 CO 0.41 0.17 -0.05 0.96 -0.92 0.00 0.00 175.35 175.92 1ik0 s ILE 90 N -2.24 1.24 0.40 2.17 -4.36 0.73 -4.84 121.20 114.30 1ik0 s ILE 90 Ca 0.41 -2.07 -0.26 0.00 -0.26 0.00 0.00 60.65 58.46 1ik0 s ILE 90 Cb -0.10 -2.22 -0.09 0.00 1.25 0.00 0.00 42.46 41.31 1ik0 s ILE 90 CO 0.34 -0.45 1.31 -1.61 0.24 0.00 0.00 174.94 174.78 1ik0 s GLU 91 N -3.79 3.98 0.24 0.37 8.01 -1.26 -0.18 118.70 126.06 1ik0 s GLU 91 Ca 0.25 2.18 -0.07 0.00 0.01 0.00 0.00 54.97 57.34 1ik0 s GLU 91 Cb 0.04 -2.77 0.24 0.00 -4.31 0.00 0.00 34.13 27.33 1ik0 s GLU 91 CO 0.07 -0.49 1.91 0.28 0.01 0.00 0.00 175.26 177.03 1ik0 h VAL 92 N 2.49 1.22 -0.88 2.63 2.07 -1.84 -1.94 116.25 120.00 1ik0 h VAL 92 Ca -0.50 -0.42 0.16 0.00 0.82 0.00 0.00 66.70 66.76 1ik0 h VAL 92 Cb 1.25 -0.11 -0.10 0.00 -1.52 0.00 0.00 31.29 30.80 1ik0 h VAL 92 CO 0.63 0.22 0.47 0.00 0.02 0.00 0.00 177.57 178.91 1ik0 h ALA 93 N 1.35 1.36 -0.00 1.67 0.00 -1.91 0.60 119.26 122.32 1ik0 h ALA 93 Ca 0.34 0.09 -0.20 0.00 0.00 0.00 0.00 54.91 55.14 1ik0 h ALA 93 Cb -0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1ik0 h ALA 93 CO -0.08 -0.10 -0.87 0.37 0.00 0.00 0.00 179.25 178.57 1ik0 h GLN 94 N 0.64 0.26 -0.48 0.00 4.15 -1.80 -2.94 115.11 114.94 1ik0 h GLN 94 Ca 0.49 -0.27 0.00 0.00 0.77 0.00 0.00 58.65 59.64 1ik0 h GLN 94 Cb 0.72 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 1ik0 h GLN 94 CO -0.38 0.98 0.32 0.35 -1.93 0.00 0.00 178.83 178.17 1ik0 h PHE 95 N 0.15 0.60 -0.15 3.99 3.04 -0.21 -0.97 116.94 123.39 1ik0 h PHE 95 Ca -0.05 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.90 1ik0 h PHE 95 Cb 1.49 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 39.79 1ik0 h PHE 95 CO 0.04 0.38 0.05 0.28 -2.02 0.00 0.00 178.31 177.04 1ik0 h VAL 96 N 0.65 1.17 -0.34 1.41 2.07 -1.13 -1.82 116.25 118.26 1ik0 h VAL 96 Ca 0.18 -0.52 0.00 0.00 0.82 0.00 0.00 66.70 67.18 1ik0 h VAL 96 Cb -0.08 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1ik0 h VAL 96 CO -0.04 0.16 0.22 0.11 0.02 0.00 0.00 177.57 178.05 1ik0 h LYS 97 N 0.08 0.45 -0.96 1.57 1.57 -1.32 0.02 116.57 117.98 1ik0 h LYS 97 Ca 0.05 -0.03 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 1ik0 h LYS 97 Cb 0.20 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.36 1ik0 h LYS 97 CO -0.00 0.30 0.62 -0.44 -0.57 0.00 0.00 179.45 179.36 1ik0 h ASP 98 N 0.46 1.11 -0.53 0.86 3.32 -1.11 -1.13 116.42 119.39 1ik0 h ASP 98 Ca 0.12 -0.04 -0.04 0.00 0.02 0.00 0.00 57.03 57.10 1ik0 h ASP 98 Cb -0.05 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.20 1ik0 h ASP 98 CO -0.03 0.81 0.20 0.25 -1.72 0.00 0.00 179.24 178.75 1ik0 h LEU 99 N 1.30 0.78 -0.73 1.55 5.85 -0.72 -2.87 115.31 120.47 1ik0 h LEU 99 Ca 0.35 -0.11 0.06 0.00 0.84 0.00 0.00 57.88 59.02 1ik0 h LEU 99 Cb -0.14 -0.20 -0.06 0.00 0.37 0.00 0.00 40.66 40.64 1ik0 h LEU 99 CO -0.07 0.72 0.42 0.25 -0.34 0.00 0.00 178.44 179.42 1ik0 h LEU 100 N 0.83 0.64 -0.74 2.25 5.85 0.30 -0.63 115.31 123.82 1ik0 h LEU 100 Ca 0.19 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.95 1ik0 h LEU 100 Cb 0.21 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 1ik0 h LEU 100 CO -0.01 0.41 0.49 -0.07 -0.34 0.00 0.00 178.44 178.92 1ik0 h LEU 101 N 0.77 0.85 -0.65 2.25 -0.00 -1.35 -2.39 115.31 114.80 1ik0 h LEU 101 Ca 0.32 -0.02 -0.14 0.00 -0.00 0.00 0.00 57.88 58.04 1ik0 h LEU 101 Cb 0.18 -0.21 -0.01 0.00 -0.00 0.00 0.00 40.66 40.62 1ik0 h LEU 101 CO -0.18 0.61 -0.44 0.45 -0.00 0.00 0.00 178.44 178.88 1ik0 h HIS 102 N 1.00 0.65 0.49 1.13 3.86 -1.43 -2.37 115.15 118.48 1ik0 h HIS 102 Ca 0.27 -0.20 -0.02 0.00 -1.16 0.00 0.00 60.37 59.26 1ik0 h HIS 102 Cb -0.11 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.22 1ik0 h HIS 102 CO -0.02 0.89 -0.30 -0.07 0.86 0.00 0.00 177.93 179.29 1ik0 h LEU 103 N 0.44 -0.74 -1.43 2.43 3.38 -0.62 -2.51 115.31 116.26 1ik0 h LEU 103 Ca 0.03 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1ik0 h LEU 103 Cb 0.95 0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1ik0 h LEU 103 CO 0.08 -0.47 -0.07 0.07 0.09 0.00 0.00 178.44 178.14 1ik0 h LYS 104 N -0.75 0.00 -0.36 1.13 2.10 -1.56 -3.16 116.57 113.97 1ik0 h LYS 104 Ca -0.06 0.00 -0.05 0.00 -2.00 0.00 0.00 60.65 58.54 1ik0 h LYS 104 Cb 0.61 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.92 1ik0 h LYS 104 CO 0.06 0.07 0.03 -0.22 -2.00 0.00 0.00 179.45 177.39 1ik0 h LYS 105 N 0.00 0.62 0.00 0.07 3.64 -0.99 -2.45 116.57 117.47 1ik0 h LYS 105 Ca -0.00 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.18 1ik0 h LYS 105 Cb 0.56 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1ik0 h LYS 105 CO 0.01 0.71 -0.07 -0.07 -2.27 0.00 0.00 179.45 177.76 1ik0 h LEU 106 N 0.45 0.00 -1.03 5.20 -0.00 -1.47 -2.53 115.31 115.93 1ik0 h LEU 106 Ca 0.11 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 58.00 1ik0 h LEU 106 Cb 0.41 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.03 1ik0 h LEU 106 CO 0.01 0.07 0.66 0.15 -0.00 0.00 0.00 178.44 179.33 1ik0 h PHE 107 N 0.00 1.24 -0.95 1.13 3.57 -1.51 -0.66 116.94 119.76 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 0.19 -0.42 -0.05 0.00 2.79 0.00 0.00 35.95 38.46 1ik0 h PHE 107 CO 0.00 0.78 0.63 0.00 -2.23 0.00 0.00 178.31 177.50 1ik0 h ARG 108 N 1.34 1.26 0.00 1.11 3.08 -1.50 -1.02 114.38 118.64 1ik0 h ARG 108 Ca 0.36 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.34 1ik0 h ARG 108 Cb -0.15 -0.28 0.00 0.00 0.08 0.00 0.00 29.97 29.61 1ik0 h ARG 108 CO -0.08 0.83 -0.22 0.39 -1.07 0.00 0.00 179.97 179.82 1ik0 n GLU 109 N -4.39 0.09 -0.95 0.04 1.02 -0.89 -4.88 120.64 110.67 1ik0 n GLU 109 Ca 0.11 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.30 1ik0 n GLU 109 Cb 0.01 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 29.86 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 1.44 0.19 3.40 0.62 0.00 -0.31 -4.91 105.19 105.63 1ik0 n GLY 110 Ca 0.06 0.00 -0.44 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 -1.23 3.23 0.14 1.61 0.52 -1.18 -5.01 118.95 117.03 1ik0 s ARG 111 Ca 0.00 -1.45 -0.13 0.00 -0.52 0.00 0.00 55.73 53.63 1ik0 s ARG 111 Cb 0.00 -4.42 -0.07 0.00 0.52 0.00 0.00 34.95 30.99 1ik0 s ARG 111 CO 0.00 -1.62 0.51 -0.06 0.02 0.00 0.00 175.30 174.16 1ik0 s PHE 112 N 2.67 3.58 -2.00 -0.53 0.08 -1.26 -4.81 117.98 115.71 1ik0 s PHE 112 Ca 0.19 0.97 0.32 0.00 0.12 0.00 0.00 56.93 58.53 1ik0 s PHE 112 Cb -0.17 -2.31 1.90 0.00 -0.57 0.00 0.00 43.02 41.87 1ik0 s PHE 112 CO 0.02 0.43 2.22 0.09 -0.10 0.00 0.00 175.22 177.88