#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 1.67 0.60 3.03 0.00 -1.26 -4.95 107.32 106.42 1ik0 s GLY 2 Ca 0.00 0.22 -0.18 0.00 0.00 0.00 0.00 44.72 44.77 1ik0 s GLY 2 CO 0.00 0.56 0.41 -1.05 0.00 0.00 0.00 173.10 173.01 1ik0 n PRO 3 N -3.43 0.39 -2.82 2.90 -0.01 -1.26 -4.94 135.00 125.82 1ik0 n PRO 3 Ca 0.09 0.16 -0.33 0.00 -0.01 0.00 0.00 63.50 63.40 1ik0 n PRO 3 Cb 0.53 -1.62 -0.07 0.00 -0.01 0.00 0.00 33.50 32.34 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 -1.80 4.38 1.11 -1.45 -7.23 -1.26 -5.03 120.40 109.11 1ik0 s VAL 4 Ca 0.66 1.52 -0.12 0.00 -1.81 0.00 0.00 61.98 62.22 1ik0 s VAL 4 Cb -0.43 -3.65 0.24 0.00 0.56 0.00 0.00 36.38 33.11 1ik0 s VAL 4 CO 0.57 -0.26 1.00 -0.81 -0.31 0.00 0.00 175.10 175.29 1ik0 n PRO 5 N -0.49 -1.90 0.00 4.82 -0.04 -1.26 -4.68 135.00 131.46 1ik0 n PRO 5 Ca 0.06 -0.51 -0.11 0.00 -0.04 0.00 0.00 63.50 62.90 1ik0 n PRO 5 Cb 0.54 -2.20 -0.05 0.00 -0.04 0.00 0.00 33.50 31.75 1ik0 n PRO 5 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 1ik0 h PRO 6 N -2.45 0.07 -0.83 0.54 0.13 -2.00 -1.70 132.00 125.76 1ik0 h PRO 6 Ca -0.56 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.56 1ik0 h PRO 6 Cb 1.32 -0.01 -0.04 0.00 0.13 0.00 0.00 31.00 32.39 1ik0 h PRO 6 CO 0.46 0.04 0.50 0.66 -0.23 0.00 0.00 178.00 179.43 1ik0 h SER 7 N 0.07 1.00 -0.42 1.44 4.64 -1.94 -2.35 113.55 115.99 1ik0 h SER 7 Ca 0.04 -0.06 -0.15 0.00 -0.47 0.00 0.00 61.79 61.15 1ik0 h SER 7 Cb 0.02 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.85 1ik0 h SER 7 CO -0.04 0.77 -0.33 0.74 -0.87 0.00 0.00 176.83 177.10 1ik0 h THR 8 N 1.15 1.27 -0.75 2.95 2.02 -1.85 -2.84 112.91 114.86 1ik0 h THR 8 Ca 0.30 -1.50 -0.00 0.00 0.77 0.00 0.00 66.41 65.98 1ik0 h THR 8 Cb -0.04 1.29 -0.04 0.00 -1.74 0.00 0.00 68.15 67.62 1ik0 h THR 8 CO -0.06 0.51 0.47 0.00 0.37 0.00 0.00 175.52 176.81 1ik0 h ALA 9 N 0.80 0.96 -0.17 6.16 0.00 -0.92 -0.80 119.26 125.29 1ik0 h ALA 9 Ca 0.08 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ik0 h ALA 9 Cb 0.92 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1ik0 h ALA 9 CO 0.09 0.41 0.11 1.25 0.00 0.00 0.00 179.25 181.11 1ik0 h LEU 10 N 1.02 0.19 -0.73 0.00 5.85 -1.35 0.21 115.31 120.51 1ik0 h LEU 10 Ca 0.27 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.00 1ik0 h LEU 10 Cb -0.06 -0.05 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 1ik0 h LEU 10 CO -0.05 0.14 0.48 0.03 -0.34 0.00 0.00 178.44 178.70 1ik0 h ARG 11 N 0.23 0.95 -0.85 1.25 2.47 -1.22 0.52 114.38 117.74 1ik0 h ARG 11 Ca 0.06 -0.06 -0.03 0.00 -1.26 0.00 0.00 59.98 58.69 1ik0 h ARG 11 Cb -0.02 -0.22 -0.04 0.00 -1.65 0.00 0.00 29.97 28.04 1ik0 h ARG 11 CO -0.02 0.63 0.40 0.93 0.56 0.00 0.00 179.97 182.48 1ik0 h GLU 12 N 0.98 1.22 -0.19 0.04 5.08 -0.57 0.08 114.58 121.23 1ik0 h GLU 12 Ca 0.27 -0.18 -0.09 0.00 -1.00 0.00 0.00 59.36 58.36 1ik0 h GLU 12 Cb -0.11 -0.22 -0.00 0.00 0.50 0.00 0.00 28.75 28.92 1ik0 h GLU 12 CO -0.06 0.94 -0.22 1.25 -1.00 0.00 0.00 179.01 179.92 1ik0 h LEU 13 N 1.21 0.51 0.00 1.33 5.85 0.37 -2.26 115.31 122.33 1ik0 h LEU 13 Ca 0.29 -0.49 -0.00 0.00 0.84 0.00 0.00 57.88 58.52 1ik0 h LEU 13 Cb 0.12 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.01 1ik0 h LEU 13 CO -0.04 0.90 -0.00 0.40 -0.34 0.00 0.00 178.44 179.37 1ik0 h ILE 14 N 0.13 1.01 -0.99 4.05 2.04 0.31 -0.89 117.51 123.18 1ik0 h ILE 14 Ca 0.03 -0.05 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1ik0 h ILE 14 Cb 0.77 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.85 1ik0 h ILE 14 CO 0.05 0.01 0.64 -0.33 0.00 0.00 0.00 178.15 178.53 1ik0 h GLU 15 N -0.02 1.31 -0.27 2.37 4.39 -1.02 -2.12 114.58 119.22 1ik0 h GLU 15 Ca -0.00 -0.09 -0.13 0.00 0.34 0.00 0.00 59.36 59.49 1ik0 h GLU 15 Cb 0.02 -0.29 -0.00 0.00 -0.10 0.00 0.00 28.75 28.38 1ik0 h GLU 15 CO 0.00 0.88 -0.32 1.49 -1.16 0.00 0.00 179.01 179.89 1ik0 h GLU 16 N 1.35 0.70 -0.74 2.33 4.81 -1.16 -2.07 114.58 119.80 1ik0 h GLU 16 Ca 0.36 -0.39 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1ik0 h GLU 16 Cb -0.14 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.23 1ik0 h GLU 16 CO -0.08 1.01 0.45 -0.07 -0.73 0.00 0.00 179.01 179.60 1ik0 h LEU 17 N 0.44 0.89 -0.56 1.64 3.38 -0.92 -2.48 115.31 117.69 1ik0 h LEU 17 Ca 0.04 -0.06 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 1ik0 h LEU 17 Cb 0.90 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1ik0 h LEU 17 CO 0.08 0.68 -0.10 0.58 0.09 0.00 0.00 178.44 179.77 1ik0 h VAL 18 N 1.01 1.27 -1.00 1.22 2.07 -1.35 -3.05 116.25 116.42 1ik0 h VAL 18 Ca 0.27 -1.26 0.01 0.00 0.82 0.00 0.00 66.70 66.54 1ik0 h VAL 18 Cb -0.05 0.94 -0.05 0.00 -1.52 0.00 0.00 31.29 30.61 1ik0 h VAL 18 CO -0.05 0.45 0.66 0.78 0.02 0.00 0.00 177.57 179.43 1ik0 h ASN 19 N 0.93 1.14 1.39 0.57 2.35 -0.94 -0.25 115.58 120.76 1ik0 h ASN 19 Ca 0.15 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.87 1ik0 h ASN 19 Cb 0.67 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.76 1ik0 h ASN 19 CO 0.05 0.81 0.00 0.16 -1.65 0.00 0.00 177.43 176.80 1ik0 h ILE 20 N 1.34 0.00 0.00 2.81 3.07 -1.40 -3.29 117.51 120.04 1ik0 h ILE 20 Ca 0.37 -0.53 -0.08 0.00 1.55 0.00 0.00 64.86 66.18 1ik0 h ILE 20 Cb -0.13 1.47 -0.01 0.00 -0.27 0.00 0.00 36.82 37.88 1ik0 h ILE 20 CO -0.09 0.00 -1.98 0.35 -1.05 0.00 0.00 178.15 175.39 1ik0 n THR 21 N -2.48 0.29 -0.02 0.16 -2.24 -0.87 -3.92 114.28 105.20 1ik0 n THR 21 Ca 0.04 -0.52 -0.16 0.00 -2.27 0.00 0.00 64.05 61.14 1ik0 n THR 21 Cb 0.40 -0.08 -0.05 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 0.77 -0.67 -0.78 1.08 -1.13 -3.21 115.11 111.18 1ik0 h GLN 22 Ca -0.11 -0.61 0.00 0.00 -1.45 0.00 0.00 58.65 56.48 1ik0 h GLN 22 Cb 1.18 0.12 0.00 0.00 -0.05 0.00 0.00 27.48 28.73 1ik0 h GLN 22 CO 0.01 1.22 0.00 0.09 -0.95 0.00 0.00 178.83 179.20 1ik0 n ASN 23 N -3.94 4.23 -4.71 1.46 3.02 -1.24 -4.94 115.26 109.14 1ik0 n ASN 23 Ca -0.07 -2.27 -0.42 0.00 -0.03 0.00 0.00 54.58 51.80 1ik0 n ASN 23 Cb 0.72 -0.53 -0.03 0.00 -0.61 0.00 0.00 39.78 39.33 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 -1.56 4.54 0.00 3.52 -2.07 -1.22 -4.98 119.66 117.90 1ik0 s GLN 24 Ca 0.48 1.33 0.00 0.00 -1.82 0.00 0.00 55.36 55.35 1ik0 s GLN 24 Cb 0.29 -3.45 0.00 0.00 -1.09 0.00 0.00 33.01 28.75 1ik0 s GLN 24 CO 0.26 -0.02 0.00 1.17 -1.32 0.00 0.00 175.29 175.38 1ik0 n LYS 25 N 3.83 0.00 -2.02 9.60 3.00 -1.26 -4.93 118.16 126.38 1ik0 n LYS 25 Ca 0.05 0.04 -0.30 0.00 -0.00 0.00 0.00 58.31 58.09 1ik0 n LYS 25 Cb 0.51 -0.40 0.01 0.00 0.00 0.00 0.00 35.03 35.15 1ik0 n LYS 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ik0 s ALA 26 N -4.17 3.13 1.01 3.14 0.00 -1.26 -5.00 121.76 118.61 1ik0 s ALA 26 Ca 0.00 -0.22 -0.21 0.00 0.00 0.00 0.00 51.96 51.53 1ik0 s ALA 26 Cb 0.00 -2.97 -0.10 0.00 0.00 0.00 0.00 23.12 20.05 1ik0 s ALA 26 CO 0.00 -0.70 -0.77 -2.30 0.00 0.00 0.00 175.76 171.98 1ik0 n PRO 27 N -2.70 -0.31 0.21 0.00 -0.02 -1.26 -4.77 135.00 126.15 1ik0 n PRO 27 Ca 0.05 -0.08 0.15 0.00 -2.02 0.00 0.00 63.50 61.60 1ik0 n PRO 27 Cb 0.55 -1.24 0.66 0.00 -0.02 0.00 0.00 33.50 33.45 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 -1.26 0.00 -8.53 2.45 3.38 -1.97 -3.45 115.31 105.94 1ik0 h LEU 28 Ca -0.44 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.29 1ik0 h LEU 28 Cb 1.34 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.99 1ik0 h LEU 28 CO 0.26 0.00 -0.31 0.00 0.09 0.00 0.00 178.44 178.49 1ik0 n ASN 30 N -0.96 1.66 -0.52 0.00 2.04 -1.26 -4.13 115.26 112.10 1ik0 n ASN 30 Ca 0.01 -1.81 -0.02 0.00 -0.44 0.00 0.00 54.58 52.32 1ik0 n ASN 30 Cb 0.63 -0.45 0.00 0.00 -2.53 0.00 0.00 39.78 37.43 1ik0 n ASN 30 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1ik0 n GLY 31 N 2.86 0.51 3.73 4.83 0.00 -1.26 -5.00 105.19 110.85 1ik0 n GLY 31 Ca 0.14 -0.70 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.96 4.60 0.06 1.61 0.01 -1.26 -4.92 113.70 110.85 1ik0 s SER 32 Ca 0.03 2.48 0.06 0.00 1.31 0.00 0.00 55.95 59.82 1ik0 s SER 32 Cb -0.01 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.59 1ik0 s SER 32 CO 0.04 -2.00 -0.16 -0.04 0.41 0.00 0.00 173.24 171.49 1ik0 s MET 33 N -3.55 0.97 0.18 12.44 -1.94 -1.26 -2.62 119.30 123.52 1ik0 s MET 33 Ca 0.79 -0.90 0.05 0.00 -1.71 0.00 0.00 55.69 53.92 1ik0 s MET 33 Cb -0.33 -1.02 -0.05 0.00 2.01 0.00 0.00 34.83 35.44 1ik0 s MET 33 CO 0.40 0.24 -0.09 0.14 -0.01 0.00 0.00 175.02 175.70 1ik0 s VAL 34 N -1.03 1.30 0.13 -6.03 -7.23 -0.31 -4.88 120.40 102.34 1ik0 s VAL 34 Ca 0.02 -2.09 -0.30 0.00 -1.81 0.00 0.00 61.98 57.79 1ik0 s VAL 34 Cb -0.09 -2.03 -0.07 0.00 0.56 0.00 0.00 36.38 34.75 1ik0 s VAL 34 CO 0.02 -0.60 1.23 0.26 -0.31 0.00 0.00 175.10 175.70 1ik0 s TRP 35 N -3.25 3.39 0.42 2.82 0.52 -1.26 -0.44 118.94 121.15 1ik0 s TRP 35 Ca 0.21 1.29 -0.25 0.00 0.02 0.00 0.00 56.10 57.37 1ik0 s TRP 35 Cb 0.02 -3.48 -0.08 0.00 -1.15 0.00 0.00 33.47 28.79 1ik0 s TRP 35 CO 0.04 -1.46 1.18 0.45 0.02 0.00 0.00 176.95 177.18 1ik0 s SER 36 N 0.67 6.39 0.18 2.95 0.15 -1.15 -4.87 113.70 118.02 1ik0 s SER 36 Ca 0.57 2.36 0.05 0.00 0.70 0.00 0.00 55.95 59.63 1ik0 s SER 36 Cb -0.32 -2.61 -0.05 0.00 -1.71 0.00 0.00 66.02 61.33 1ik0 s SER 36 CO 0.33 -0.77 -0.09 0.27 1.20 0.00 0.00 173.24 174.18 1ik0 s ILE 37 N -1.44 1.30 -0.22 6.45 -4.36 -1.26 -4.89 121.20 116.77 1ik0 s ILE 37 Ca 0.59 -2.09 -0.24 0.00 -0.26 0.00 0.00 60.65 58.64 1ik0 s ILE 37 Cb -0.31 -2.02 -0.01 0.00 1.25 0.00 0.00 42.46 41.37 1ik0 s ILE 37 CO 0.38 -0.60 0.82 0.20 0.24 0.00 0.00 174.94 175.97 1ik0 s ASN 38 N -3.24 6.85 -0.48 4.36 0.02 -1.26 -4.99 114.94 116.19 1ik0 s ASN 38 Ca 0.21 1.05 -0.28 0.00 -1.02 0.00 0.00 52.86 52.82 1ik0 s ASN 38 Cb 0.02 -2.43 0.03 0.00 0.02 0.00 0.00 41.25 38.89 1ik0 s ASN 38 CO 0.04 -0.48 1.11 -0.76 0.02 0.00 0.00 177.10 177.03 1ik0 s LEU 39 N 2.64 3.69 0.00 0.60 2.01 -1.26 -4.84 118.68 121.52 1ik0 s LEU 39 Ca 0.35 0.39 0.00 0.00 0.01 0.00 0.00 54.13 54.88 1ik0 s LEU 39 Cb -0.16 -3.48 0.00 0.00 0.01 0.00 0.00 46.19 42.57 1ik0 s LEU 39 CO 0.09 -1.23 0.00 0.35 1.01 0.00 0.00 176.35 176.56 1ik0 n THR 40 N 6.78 0.00 0.00 5.49 -2.24 -1.26 -5.05 114.28 118.00 1ik0 n THR 40 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1ik0 n THR 40 Cb 0.49 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 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 -0.17 6.98 0.00 -1.26 -4.47 120.51 118.59 1ik0 n ALA 41 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 53.44 53.42 1ik0 n ALA 41 Cb 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 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 2.46 1.21 0.37 0.00 0.00 -1.26 -4.29 105.19 103.67 1ik0 n GLY 42 Ca 0.00 -0.14 -0.03 0.00 0.00 0.00 0.00 46.02 45.85 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 4.32 1.29 -0.33 1.61 0.00 -1.90 -0.61 114.93 119.31 1ik0 h MET 43 Ca 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 59.70 59.61 1ik0 h MET 43 Cb 0.29 -0.27 -0.02 0.00 0.00 0.00 0.00 31.60 31.60 1ik0 h MET 43 CO 0.22 0.89 0.18 1.88 0.00 0.00 0.00 176.91 180.08 1ik0 h TYR 44 N 1.31 0.46 -0.11 -0.22 -1.99 -1.95 0.74 116.97 115.21 1ik0 h TYR 44 Ca 0.34 -0.01 -0.02 0.00 2.00 0.00 0.00 58.73 61.04 1ik0 h TYR 44 Cb -0.08 -0.15 -0.00 0.00 2.00 0.00 0.00 36.73 38.50 1ik0 h TYR 44 CO 0.00 0.37 -0.02 0.00 -0.00 0.00 0.00 178.16 178.51 1ik0 h ALA 46 N 0.69 0.62 -0.72 0.00 0.00 -1.04 -1.78 119.26 117.04 1ik0 h ALA 46 Ca 0.03 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.88 1ik0 h ALA 46 Cb 0.43 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1ik0 h ALA 46 CO 0.01 0.06 0.34 0.00 0.00 0.00 0.00 179.25 179.67 1ik0 h ALA 47 N 1.18 1.26 -0.01 0.00 0.00 -0.79 -2.81 119.26 118.09 1ik0 h ALA 47 Ca 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1ik0 h ALA 47 Cb -0.08 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.43 1ik0 h ALA 47 CO -0.04 0.57 0.01 1.25 0.00 0.00 0.00 179.25 181.04 1ik0 h LEU 48 N 1.01 0.01 -1.08 0.00 5.85 -0.23 -1.77 115.31 119.09 1ik0 h LEU 48 Ca 0.25 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.96 1ik0 h LEU 48 Cb 0.10 -0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.09 1ik0 h LEU 48 CO -0.03 0.02 0.62 1.05 -0.34 0.00 0.00 178.44 179.76 1ik0 h GLU 49 N -0.00 1.23 -0.89 1.25 4.11 -1.29 -0.18 114.58 118.81 1ik0 h GLU 49 Ca 0.00 -0.07 -0.00 0.00 0.07 0.00 0.00 59.36 59.35 1ik0 h GLU 49 Cb 0.01 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 28.94 1ik0 h GLU 49 CO -0.00 0.81 0.54 0.77 0.07 0.00 0.00 179.01 181.20 1ik0 h SER 50 N 1.27 1.07 -0.06 3.06 0.02 -1.22 -2.44 113.55 115.25 1ik0 h SER 50 Ca 0.34 -0.07 -0.15 0.00 -0.84 0.00 0.00 61.79 61.08 1ik0 h SER 50 Cb -0.15 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.12 1ik0 h SER 50 CO -0.07 0.82 -0.46 -0.07 -1.14 0.00 0.00 176.83 175.90 1ik0 h LEU 51 N 1.22 0.66 -2.07 5.07 3.38 -0.41 -2.81 115.31 120.35 1ik0 h LEU 51 Ca 0.32 -0.32 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ik0 h LEU 51 Cb -0.05 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.51 1ik0 h LEU 51 CO -0.06 1.02 0.28 0.40 0.09 0.00 0.00 178.44 180.17 1ik0 h ILE 52 N 0.49 0.00 0.00 1.22 1.08 -0.56 0.86 117.51 120.59 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 1.00 0.69 0.00 0.00 -3.07 0.00 0.00 36.82 35.43 1ik0 h ILE 52 CO 0.09 0.00 -0.39 0.59 -0.69 0.00 0.00 178.15 177.75 1ik0 n ASN 53 N -2.85 0.74 -4.63 1.72 3.02 -1.06 -4.74 115.26 107.46 1ik0 n ASN 53 Ca -0.02 0.29 -0.40 0.00 -0.03 0.00 0.00 54.58 54.41 1ik0 n ASN 53 Cb 0.32 -0.19 -0.06 0.00 -0.61 0.00 0.00 39.78 39.24 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 -3.14 4.99 0.09 2.41 1.01 0.30 -5.05 120.40 121.01 1ik0 s VAL 54 Ca 0.08 1.11 0.07 0.00 0.00 0.00 0.00 61.98 63.23 1ik0 s VAL 54 Cb 0.13 -3.92 -0.03 0.00 0.00 0.00 0.00 36.38 32.56 1ik0 s VAL 54 CO 0.67 0.04 -0.18 -0.44 0.00 0.00 0.00 175.10 175.19 1ik0 s SER 55 N 1.47 2.13 0.00 3.32 0.01 -1.26 -4.79 113.70 114.58 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 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 65.98 1ik0 s SER 55 CO 0.09 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.34 1ik0 n GLY 56 N 1.19 1.02 2.61 3.44 0.00 -1.26 -5.05 105.19 107.13 1ik0 n GLY 56 Ca -0.20 -0.50 -0.25 0.00 0.00 0.00 0.00 46.02 45.07 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 8.19 0.24 -0.63 0.00 0.87 -1.97 -2.90 113.55 117.35 1ik0 h SER 58 Ca -0.15 -0.10 0.18 0.00 -1.23 0.00 0.00 61.79 60.50 1ik0 h SER 58 Cb 1.03 -0.07 -0.03 0.00 -0.44 0.00 0.00 62.40 62.90 1ik0 h SER 58 CO 0.38 0.63 0.60 0.00 -0.53 0.00 0.00 176.83 177.91 1ik0 h ALA 59 N 1.38 2.43 -0.00 6.23 0.00 -1.94 0.60 119.26 127.97 1ik0 h ALA 59 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ik0 h ALA 59 Cb 0.81 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.65 1ik0 h ALA 59 CO 0.06 -0.92 -0.65 0.44 0.00 0.00 0.00 179.25 178.18 1ik0 n ILE 60 N -3.81 0.00 -0.26 0.00 -5.35 -1.10 -4.49 119.36 104.35 1ik0 n ILE 60 Ca 0.13 -0.18 -0.05 0.00 -0.27 0.00 0.00 62.75 62.38 1ik0 n ILE 60 Cb 0.83 1.02 0.06 0.00 -1.74 0.00 0.00 39.64 39.81 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 0.15 0.94 -0.74 6.28 4.39 -0.78 -0.81 114.58 124.02 1ik0 h GLU 61 Ca 0.00 -0.06 -0.07 0.00 0.34 0.00 0.00 59.36 59.58 1ik0 h GLU 61 Cb 0.36 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 28.76 1ik0 h GLU 61 CO 0.00 0.62 0.20 0.87 -1.16 0.00 0.00 179.01 179.55 1ik0 h LYS 62 N 0.97 1.16 -1.00 2.33 1.57 -1.79 -2.50 116.57 117.31 1ik0 h LYS 62 Ca 0.26 -0.27 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1ik0 h LYS 62 Cb -0.11 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 31.99 1ik0 h LYS 62 CO -0.06 1.00 0.66 1.15 -0.57 0.00 0.00 179.45 181.64 1ik0 h THR 63 N 1.11 1.26 -0.77 -0.16 2.02 -1.55 -1.92 112.91 112.89 1ik0 h THR 63 Ca 0.23 -0.47 0.01 0.00 0.77 0.00 0.00 66.41 66.95 1ik0 h THR 63 Cb 0.35 -0.21 -0.04 0.00 -1.74 0.00 0.00 68.15 66.50 1ik0 h THR 63 CO -0.00 0.25 0.51 1.56 0.37 0.00 0.00 175.52 178.21 1ik0 h GLN 64 N 1.36 1.01 0.01 6.66 4.20 -0.74 0.43 115.11 128.04 1ik0 h GLN 64 Ca 0.37 -0.06 -0.00 0.00 0.06 0.00 0.00 58.65 59.01 1ik0 h GLN 64 Cb -0.15 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.40 1ik0 h GLN 64 CO -0.08 0.67 -0.00 -0.09 -0.67 0.00 0.00 178.83 178.66 1ik0 h ARG 65 N 1.05 -0.01 -0.98 1.46 2.43 -1.16 0.06 114.38 117.22 1ik0 h ARG 65 Ca 0.28 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.46 1ik0 h ARG 65 Cb -0.12 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.38 1ik0 h ARG 65 CO -0.06 0.04 0.63 0.52 -1.51 0.00 0.00 179.97 179.58 1ik0 h MET 66 N -0.06 1.31 -0.80 0.20 2.86 -1.02 -1.58 114.93 115.85 1ik0 h MET 66 Ca -0.00 -0.10 -0.05 0.00 -2.06 0.00 0.00 59.70 57.49 1ik0 h MET 66 Cb 0.05 -0.29 -0.04 0.00 0.06 0.00 0.00 31.60 31.39 1ik0 h MET 66 CO 0.00 0.89 0.32 -0.07 1.06 0.00 0.00 176.91 179.11 1ik0 h LEU 67 N 1.34 1.11 -1.03 1.22 3.38 -0.51 -2.14 115.31 118.68 1ik0 h LEU 67 Ca 0.36 -0.18 0.02 0.00 0.09 0.00 0.00 57.88 58.17 1ik0 h LEU 67 Cb -0.11 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.30 1ik0 h LEU 67 CO -0.07 0.98 0.65 0.28 0.09 0.00 0.00 178.44 180.37 1ik0 h SER 68 N 1.17 1.11 -1.02 -0.43 0.02 -0.06 -0.71 113.55 113.63 1ik0 h SER 68 Ca 0.27 -0.02 0.28 0.00 -0.84 0.00 0.00 61.79 61.48 1ik0 h SER 68 Cb 0.22 -0.27 -0.06 0.00 0.14 0.00 0.00 62.40 62.44 1ik0 h SER 68 CO -0.02 0.79 0.71 1.23 -1.14 0.00 0.00 176.83 178.40 1ik0 h GLY 69 N 1.31 0.39 0.89 -3.77 0.00 -0.66 1.68 103.07 102.91 1ik0 h GLY 69 Ca 0.38 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.64 1ik0 h GLY 69 CO -0.10 -0.03 -0.57 0.69 0.00 0.00 0.00 176.54 176.53 1ik0 n PHE 70 N -4.35 0.03 -3.57 5.60 3.72 -0.33 -4.44 117.46 114.12 1ik0 n PHE 70 Ca 0.22 0.01 -0.27 0.00 -0.05 0.00 0.00 57.45 57.36 1ik0 n PHE 70 Cb 1.00 -0.25 -0.10 0.00 -0.94 0.00 0.00 39.48 39.19 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 2.14 0.00 -3.50 0.00 -0.02 -1.02 -4.45 135.00 128.15 1ik0 n PRO 72 Ca 0.25 0.04 -0.39 0.00 -2.02 0.00 0.00 63.50 61.38 1ik0 n PRO 72 Cb 0.43 -1.52 -0.10 0.00 -0.02 0.00 0.00 33.50 32.29 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 -1.77 3.23 0.25 6.00 -3.43 -1.26 -5.06 115.29 113.24 1ik0 s HIS 73 Ca 0.00 0.19 -0.30 0.00 -0.80 0.00 0.00 55.06 54.15 1ik0 s HIS 73 Cb 0.00 -2.48 -0.09 0.00 -1.43 0.00 0.00 32.58 28.58 1ik0 s HIS 73 CO 0.00 -0.22 1.09 0.15 -2.00 0.00 0.00 174.74 173.75 1ik0 s LYS 74 N 1.89 4.65 -0.14 -0.38 1.02 -1.26 -5.03 119.74 120.49 1ik0 s LYS 74 Ca 0.10 1.75 -0.01 0.00 0.02 0.00 0.00 55.97 57.83 1ik0 s LYS 74 Cb -0.16 -3.22 -0.02 0.00 -0.52 0.00 0.00 37.83 33.91 1ik0 s LYS 74 CO 0.11 0.20 -0.10 0.08 -0.92 0.00 0.00 175.35 174.71 1ik0 s VAL 75 N -0.90 3.29 0.37 3.17 1.01 -1.26 -5.09 120.40 120.99 1ik0 s VAL 75 Ca 0.46 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.88 1ik0 s VAL 75 Cb -0.31 -2.40 -0.02 0.00 0.00 0.00 0.00 36.38 33.65 1ik0 s VAL 75 CO 0.38 0.51 0.56 -0.94 0.00 0.00 0.00 175.10 175.62 1ik0 s SER 76 N 0.36 6.13 0.00 3.32 1.04 -1.26 -4.93 113.70 118.35 1ik0 s SER 76 Ca -0.09 0.30 0.00 0.00 0.48 0.00 0.00 55.95 56.64 1ik0 s SER 76 Cb -0.15 -1.78 0.00 0.00 0.10 0.00 0.00 66.02 64.19 1ik0 s SER 76 CO 0.05 -0.41 0.72 0.00 0.98 0.00 0.00 173.24 174.58 1ik0 n ALA 77 N -1.82 1.29 -0.04 5.32 0.00 -1.26 -1.24 120.51 122.76 1ik0 n ALA 77 Ca -0.03 -0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.40 1ik0 n ALA 77 Cb 0.57 -1.00 -0.11 0.00 0.00 0.00 0.00 19.45 18.91 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 -1.21 -0.64 3.62 0.00 0.00 -1.26 -4.93 105.19 100.77 1ik0 n GLY 78 Ca 0.00 -0.27 -0.40 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.59 4.10 0.03 1.61 -0.21 -0.37 -5.05 119.66 117.17 1ik0 s GLN 79 Ca -0.06 0.46 0.05 0.00 0.02 0.00 0.00 55.36 55.82 1ik0 s GLN 79 Cb 0.06 -3.65 -0.02 0.00 1.00 0.00 0.00 33.01 30.40 1ik0 s GLN 79 CO 0.56 -0.38 -0.14 -0.06 -2.12 0.00 0.00 175.29 173.15 1ik0 s PHE 80 N 2.40 1.20 0.00 0.91 0.08 -1.26 -4.35 117.98 116.97 1ik0 s PHE 80 Ca 0.24 -0.32 0.00 0.00 0.12 0.00 0.00 56.93 56.97 1ik0 s PHE 80 Cb -0.16 -0.73 0.00 0.00 -0.57 0.00 0.00 43.02 41.56 1ik0 s PHE 80 CO 0.09 0.02 0.00 0.43 -0.10 0.00 0.00 175.22 175.66 1ik0 n SER 81 N 2.12 4.12 -0.50 1.36 7.64 -1.26 -4.81 113.62 122.30 1ik0 n SER 81 Ca -0.17 0.00 0.06 0.00 1.01 0.00 0.00 58.87 59.77 1ik0 n SER 81 Cb 0.55 0.40 0.06 0.00 -1.01 0.00 0.00 64.21 64.20 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 -1.77 2.06 -0.79 6.43 2.88 -1.26 -4.51 113.62 116.66 1ik0 n SER 82 Ca 0.00 -1.53 0.03 0.00 -1.33 0.00 0.00 58.87 56.04 1ik0 n SER 82 Cb 0.42 -0.01 0.14 0.00 -0.75 0.00 0.00 64.21 64.00 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 0.68 2.18 0.20 2.46 4.77 -1.26 -3.91 117.00 122.11 1ik0 n LEU 83 Ca 0.07 -1.10 0.08 0.00 -0.03 0.00 0.00 56.01 55.03 1ik0 n LEU 83 Cb 0.31 -0.40 0.26 0.00 -2.33 0.00 0.00 43.42 41.25 1ik0 n LEU 83 CO 0.08 0.38 0.70 0.45 -1.33 0.00 0.00 177.39 177.66 1ik0 h HIS 84 N 1.51 0.00 -3.89 -1.77 3.86 -1.94 -3.44 115.15 109.47 1ik0 h HIS 84 Ca 0.00 0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.73 1ik0 h HIS 84 Cb 0.75 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.23 1ik0 h HIS 84 CO 0.31 0.26 0.40 0.08 0.86 0.00 0.00 177.93 179.84 1ik0 s VAL 85 N -3.31 3.85 -1.04 2.45 1.01 -1.25 -4.93 120.40 117.18 1ik0 s VAL 85 Ca 0.03 1.57 -0.05 0.00 0.00 0.00 0.00 61.98 63.53 1ik0 s VAL 85 Cb 0.08 -3.88 0.08 0.00 0.00 0.00 0.00 36.38 32.66 1ik0 s VAL 85 CO 0.68 0.15 2.56 0.54 0.00 0.00 0.00 175.10 179.03 1ik0 n ARG 86 N 0.49 3.84 -2.22 2.72 1.74 -1.26 -4.95 116.66 117.02 1ik0 n ARG 86 Ca 0.02 -3.01 -0.27 0.00 -0.77 0.00 0.00 57.85 53.82 1ik0 n ARG 86 Cb 0.49 -2.48 0.05 0.00 -1.02 0.00 0.00 32.46 29.50 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 0.49 5.24 0.39 0.55 1.01 -1.26 -5.07 116.67 118.02 1ik0 s ASP 87 Ca 0.57 0.70 -0.01 0.00 0.71 0.00 0.00 52.55 54.51 1ik0 s ASP 87 Cb 0.25 -1.52 -0.03 0.00 1.01 0.00 0.00 42.92 42.63 1ik0 s ASP 87 CO -0.13 -1.34 0.63 0.42 0.21 0.00 0.00 175.17 174.96 1ik0 s THR 88 N -3.17 5.01 0.51 -1.27 -4.23 -1.26 -4.85 115.64 106.38 1ik0 s THR 88 Ca 0.57 -0.25 -0.09 0.00 -1.18 0.00 0.00 61.69 60.74 1ik0 s THR 88 Cb -0.11 -3.85 -0.05 0.00 1.34 0.00 0.00 72.50 69.83 1ik0 s THR 88 CO 0.46 -0.65 0.87 -0.54 -0.54 0.00 0.00 174.62 174.22 1ik0 s LYS 89 N -4.46 3.64 0.15 3.99 1.02 -1.26 -2.94 119.74 119.88 1ik0 s LYS 89 Ca 0.43 0.47 0.04 0.00 0.02 0.00 0.00 55.97 56.93 1ik0 s LYS 89 Cb -0.10 -2.27 -0.04 0.00 -0.52 0.00 0.00 37.83 34.89 1ik0 s LYS 89 CO 0.39 -0.28 -0.08 0.96 -0.92 0.00 0.00 175.35 175.41 1ik0 s ILE 90 N -2.79 1.06 0.54 2.17 -4.36 0.42 -4.87 121.20 113.38 1ik0 s ILE 90 Ca 0.51 -2.04 -0.21 0.00 -0.26 0.00 0.00 60.65 58.66 1ik0 s ILE 90 Cb -0.10 -1.88 -0.05 0.00 1.25 0.00 0.00 42.46 41.68 1ik0 s ILE 90 CO 0.44 -0.72 1.20 -1.61 0.24 0.00 0.00 174.94 174.49 1ik0 s GLU 91 N -3.78 3.29 0.26 0.37 2.02 -1.26 -1.16 118.70 118.45 1ik0 s GLU 91 Ca 0.17 1.83 -0.04 0.00 0.02 0.00 0.00 54.97 56.96 1ik0 s GLU 91 Cb 0.03 -2.13 0.37 0.00 0.10 0.00 0.00 34.13 32.50 1ik0 s GLU 91 CO 0.01 -0.95 1.89 0.28 0.02 0.00 0.00 175.26 176.50 1ik0 h VAL 92 N 1.31 1.11 -0.99 2.63 2.07 -1.86 -1.40 116.25 119.12 1ik0 h VAL 92 Ca -0.50 -0.40 0.15 0.00 0.82 0.00 0.00 66.70 66.76 1ik0 h VAL 92 Cb 1.28 -0.17 -0.09 0.00 -1.52 0.00 0.00 31.29 30.78 1ik0 h VAL 92 CO 0.57 0.22 0.61 0.00 0.02 0.00 0.00 177.57 178.99 1ik0 h ALA 93 N 1.43 1.56 -0.04 1.67 0.00 -1.90 0.14 119.26 122.11 1ik0 h ALA 93 Ca 0.41 0.05 -0.24 0.00 0.00 0.00 0.00 54.91 55.13 1ik0 h ALA 93 Cb 0.11 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ik0 h ALA 93 CO -0.16 0.09 -0.95 1.96 0.00 0.00 0.00 179.25 180.20 1ik0 h GLN 94 N 0.87 0.65 -0.06 0.00 4.20 -1.66 -2.85 115.11 116.27 1ik0 h GLN 94 Ca 0.53 -0.64 0.00 0.00 0.06 0.00 0.00 58.65 58.59 1ik0 h GLN 94 Cb 0.67 0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.61 1ik0 h GLN 94 CO -0.32 1.25 0.04 0.35 -0.67 0.00 0.00 178.83 179.47 1ik0 h PHE 95 N 0.39 0.07 -0.01 2.96 3.57 -0.19 0.14 116.94 123.87 1ik0 h PHE 95 Ca -0.10 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.40 1ik0 h PHE 95 Cb 1.59 -0.02 -0.00 0.00 2.79 0.00 0.00 35.95 40.30 1ik0 h PHE 95 CO 0.09 0.05 0.00 0.28 -2.23 0.00 0.00 178.31 176.50 1ik0 h VAL 96 N 0.07 1.03 -0.76 1.41 2.07 -0.86 -2.10 116.25 117.12 1ik0 h VAL 96 Ca 0.02 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.40 1ik0 h VAL 96 Cb -0.00 1.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.81 1ik0 h VAL 96 CO -0.00 0.02 0.26 0.11 0.02 0.00 0.00 177.57 177.98 1ik0 h LYS 97 N -0.03 1.17 -0.59 1.57 1.57 -1.36 -1.49 116.57 117.41 1ik0 h LYS 97 Ca 0.00 -0.24 0.01 0.00 -1.87 0.00 0.00 60.65 58.55 1ik0 h LYS 97 Cb 0.04 -0.18 -0.03 0.00 0.08 0.00 0.00 32.23 32.14 1ik0 h LYS 97 CO -0.00 0.98 0.39 -0.44 -0.57 0.00 0.00 179.45 179.81 1ik0 h ASP 98 N 1.13 0.68 -0.43 0.86 3.32 -0.55 -1.35 116.42 120.08 1ik0 h ASP 98 Ca 0.25 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 57.24 1ik0 h ASP 98 Cb 0.28 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.64 1ik0 h ASP 98 CO -0.01 0.49 0.15 0.25 -1.72 0.00 0.00 179.24 178.40 1ik0 h LEU 99 N 0.80 0.66 -0.77 1.55 5.85 -1.09 -2.83 115.31 119.48 1ik0 h LEU 99 Ca 0.22 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.89 1ik0 h LEU 99 Cb -0.09 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.72 1ik0 h LEU 99 CO -0.05 0.63 0.47 0.25 -0.34 0.00 0.00 178.44 179.40 1ik0 h LEU 100 N 0.70 0.74 -0.34 2.25 5.85 -0.18 -0.44 115.31 123.89 1ik0 h LEU 100 Ca 0.16 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.90 1ik0 h LEU 100 Cb 0.21 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 1ik0 h LEU 100 CO -0.01 0.48 0.23 -0.07 -0.34 0.00 0.00 178.44 178.73 1ik0 h LEU 101 N 0.87 0.40 -0.54 2.25 -0.00 -1.29 -2.84 115.31 114.16 1ik0 h LEU 101 Ca 0.33 -0.01 -0.12 0.00 -0.00 0.00 0.00 57.88 58.08 1ik0 h LEU 101 Cb 0.13 -0.10 -0.02 0.00 -0.00 0.00 0.00 40.66 40.68 1ik0 h LEU 101 CO -0.16 0.29 -0.13 0.45 -0.00 0.00 0.00 178.44 178.89 1ik0 h HIS 102 N 0.46 1.16 0.19 1.13 3.86 -1.48 -2.08 115.15 118.40 1ik0 h HIS 102 Ca 0.13 -0.25 0.01 0.00 -1.16 0.00 0.00 60.37 59.09 1ik0 h HIS 102 Cb -0.05 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.11 1ik0 h HIS 102 CO -0.05 1.08 -0.25 -0.07 0.86 0.00 0.00 177.93 179.50 1ik0 h LEU 103 N 0.91 -0.70 -1.53 2.43 3.38 -0.87 -1.29 115.31 117.64 1ik0 h LEU 103 Ca 0.14 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.17 1ik0 h LEU 103 Cb 0.71 0.25 -0.00 0.00 0.09 0.00 0.00 40.66 41.71 1ik0 h LEU 103 CO 0.05 -0.36 -0.05 0.07 0.09 0.00 0.00 178.44 178.25 1ik0 h LYS 104 N -0.51 0.00 -0.10 1.13 2.10 -1.54 -3.17 116.57 114.49 1ik0 h LYS 104 Ca 0.01 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.65 1ik0 h LYS 104 Cb 0.49 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.82 1ik0 h LYS 104 CO -0.10 0.05 0.02 -0.22 -2.00 0.00 0.00 179.45 177.20 1ik0 h LYS 105 N 0.00 0.17 0.00 0.07 3.64 -0.51 -2.59 116.57 117.35 1ik0 h LYS 105 Ca -0.00 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 1ik0 h LYS 105 Cb 0.51 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1ik0 h LYS 105 CO 0.01 0.37 -0.02 -0.07 -2.27 0.00 0.00 179.45 177.47 1ik0 h LEU 106 N -0.06 0.00 -0.94 5.20 -0.00 -1.42 -2.30 115.31 115.78 1ik0 h LEU 106 Ca 0.03 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.92 1ik0 h LEU 106 Cb 0.28 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.90 1ik0 h LEU 106 CO 0.00 0.02 0.62 0.15 -0.00 0.00 0.00 178.44 179.23 1ik0 h PHE 107 N 0.00 1.18 0.00 1.13 3.57 -1.53 -0.21 116.94 121.08 1ik0 h PHE 107 Ca -0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1ik0 h PHE 107 Cb 0.04 -0.40 -0.00 0.00 2.79 0.00 0.00 35.95 38.38 1ik0 h PHE 107 CO 0.00 0.75 -0.06 0.00 -2.23 0.00 0.00 178.31 176.76 1ik0 h ARG 108 N 1.27 0.00 0.00 1.11 3.08 -1.47 -0.90 114.38 117.47 1ik0 h ARG 108 Ca 0.34 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.39 1ik0 h ARG 108 Cb -0.15 0.00 0.00 0.00 0.08 0.00 0.00 29.97 29.90 1ik0 h ARG 108 CO -0.07 0.06 -0.57 0.39 -1.07 0.00 0.00 179.97 178.71 1ik0 n GLU 109 N -3.80 0.26 -0.49 0.04 1.02 -0.18 -4.90 120.64 112.59 1ik0 n GLU 109 Ca -0.02 0.08 0.00 0.00 -0.02 0.00 0.00 57.16 57.20 1ik0 n GLU 109 Cb 0.16 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 29.91 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 1.35 0.29 3.39 0.62 0.00 -0.34 -4.88 105.19 105.61 1ik0 n GLY 110 Ca 0.04 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.61 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 -0.64 3.13 -0.01 1.61 0.52 -1.25 -5.00 118.95 117.32 1ik0 s ARG 111 Ca 0.00 -1.37 -0.16 0.00 -0.52 0.00 0.00 55.73 53.68 1ik0 s ARG 111 Cb 0.00 -4.33 -0.06 0.00 0.52 0.00 0.00 34.95 31.09 1ik0 s ARG 111 CO 0.00 -1.58 0.45 -0.06 0.02 0.00 0.00 175.30 174.13 1ik0 s PHE 112 N 2.70 3.71 0.00 -0.53 0.08 -1.26 -4.89 117.98 117.78 1ik0 s PHE 112 Ca 0.15 1.03 0.00 0.00 0.12 0.00 0.00 56.93 58.23 1ik0 s PHE 112 Cb -0.21 -2.37 0.00 0.00 -0.57 0.00 0.00 43.02 39.87 1ik0 s PHE 112 CO 0.04 0.55 0.00 -1.71 -0.10 0.00 0.00 175.22 174.01