#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 1.58 0.73 3.17 0.00 -1.26 -4.95 107.32 106.59 1ik0 s GLY 2 Ca 0.00 -0.34 -0.17 0.00 0.00 0.00 0.00 44.72 44.21 1ik0 s GLY 2 CO 0.00 0.24 0.05 -1.05 0.00 0.00 0.00 173.10 172.34 1ik0 n PRO 3 N -4.05 0.12 -2.83 2.90 -0.02 -1.26 -4.92 135.00 124.95 1ik0 n PRO 3 Ca 0.06 0.06 -0.39 0.00 -2.02 0.00 0.00 63.50 61.21 1ik0 n PRO 3 Cb 0.57 -1.42 -0.06 0.00 -0.02 0.00 0.00 33.50 32.57 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 -1.98 4.19 1.12 -1.45 -7.23 -1.26 -5.03 120.40 108.76 1ik0 s VAL 4 Ca 0.57 1.90 -0.19 0.00 -1.81 0.00 0.00 61.98 62.45 1ik0 s VAL 4 Cb -0.35 -4.19 0.10 0.00 0.56 0.00 0.00 36.38 32.50 1ik0 s VAL 4 CO 0.66 0.40 -0.05 -2.65 -0.31 0.00 0.00 175.10 173.15 1ik0 n PRO 5 N 1.24 -1.64 0.00 4.82 -0.02 -1.26 -4.66 135.00 133.49 1ik0 n PRO 5 Ca -0.02 -0.47 -0.13 0.00 -2.02 0.00 0.00 63.50 60.87 1ik0 n PRO 5 Cb 0.48 -1.66 -0.09 0.00 -0.02 0.00 0.00 33.50 32.21 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 -2.09 -0.03 -0.68 0.52 0.13 -2.00 -2.11 132.00 125.75 1ik0 h PRO 6 Ca -0.52 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.57 1ik0 h PRO 6 Cb 1.33 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.44 1ik0 h PRO 6 CO 0.36 0.40 0.24 0.66 -0.23 0.00 0.00 178.00 179.43 1ik0 h SER 7 N -0.46 0.95 -0.50 1.44 4.64 -1.97 -2.40 113.55 115.25 1ik0 h SER 7 Ca -0.00 -0.15 -0.13 0.00 -0.47 0.00 0.00 61.79 61.03 1ik0 h SER 7 Cb 0.44 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 62.27 1ik0 h SER 7 CO 0.00 0.87 -0.19 0.74 -0.87 0.00 0.00 176.83 177.38 1ik0 h THR 8 N 0.99 1.27 -0.25 2.95 2.02 -1.90 -1.63 112.91 116.36 1ik0 h THR 8 Ca 0.23 -1.36 0.00 0.00 0.77 0.00 0.00 66.41 66.05 1ik0 h THR 8 Cb 0.24 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 1ik0 h THR 8 CO -0.01 0.47 0.17 0.00 0.37 0.00 0.00 175.52 176.52 1ik0 h ALA 9 N 0.88 0.32 -0.20 6.16 0.00 -1.10 0.22 119.26 125.54 1ik0 h ALA 9 Ca 0.12 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.01 1ik0 h ALA 9 Cb 0.77 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1ik0 h ALA 9 CO 0.06 -0.21 0.12 1.25 0.00 0.00 0.00 179.25 180.47 1ik0 h LEU 10 N 0.34 0.24 -0.41 0.00 5.85 -1.32 0.29 115.31 120.31 1ik0 h LEU 10 Ca 0.09 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.76 1ik0 h LEU 10 Cb -0.04 -0.06 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1ik0 h LEU 10 CO -0.02 0.23 0.27 0.03 -0.34 0.00 0.00 178.44 178.61 1ik0 h ARG 11 N 0.23 0.53 -0.61 1.25 3.08 -0.96 0.35 114.38 118.26 1ik0 h ARG 11 Ca 0.07 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 1ik0 h ARG 11 Cb 0.03 -0.12 -0.03 0.00 0.08 0.00 0.00 29.97 29.94 1ik0 h ARG 11 CO -0.01 0.35 0.22 0.93 -1.07 0.00 0.00 179.97 180.39 1ik0 h GLU 12 N 0.55 0.90 -0.27 0.04 5.08 -0.24 -1.14 114.58 119.50 1ik0 h GLU 12 Ca 0.15 -0.15 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 1ik0 h GLU 12 Cb -0.06 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.04 1ik0 h GLU 12 CO -0.04 0.75 -0.29 1.25 -1.00 0.00 0.00 179.01 179.68 1ik0 h LEU 13 N 0.88 0.71 -0.41 1.33 5.85 0.57 -2.68 115.31 121.55 1ik0 h LEU 13 Ca 0.20 -0.48 -0.04 0.00 0.84 0.00 0.00 57.88 58.41 1ik0 h LEU 13 Cb 0.20 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 41.01 1ik0 h LEU 13 CO -0.02 1.05 0.12 0.40 -0.34 0.00 0.00 178.44 179.65 1ik0 h ILE 14 N 0.39 1.22 -0.97 4.05 2.04 -0.05 -1.12 117.51 123.07 1ik0 h ILE 14 Ca 0.04 -0.74 0.01 0.00 1.00 0.00 0.00 64.86 65.17 1ik0 h ILE 14 Cb 0.86 0.93 -0.05 0.00 -0.74 0.00 0.00 36.82 37.82 1ik0 h ILE 14 CO 0.07 0.26 0.64 -0.33 0.00 0.00 0.00 178.15 178.79 1ik0 h GLU 15 N 0.52 1.27 -0.19 2.37 5.08 -1.21 -0.49 114.58 121.94 1ik0 h GLU 15 Ca 0.13 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.26 1ik0 h GLU 15 Cb 0.28 -0.29 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1ik0 h GLU 15 CO -0.00 0.84 -0.48 1.49 -1.00 0.00 0.00 179.01 179.86 1ik0 h GLU 16 N 1.31 0.66 -0.49 2.33 4.81 -1.29 -1.95 114.58 119.96 1ik0 h GLU 16 Ca 0.36 -0.45 -0.02 0.00 -0.13 0.00 0.00 59.36 59.12 1ik0 h GLU 16 Cb -0.14 0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.29 1ik0 h GLU 16 CO -0.08 1.07 0.23 -0.07 -0.73 0.00 0.00 179.01 179.44 1ik0 h LEU 17 N 0.34 0.65 -0.62 1.64 3.38 -0.87 -2.53 115.31 117.31 1ik0 h LEU 17 Ca -0.01 -0.13 -0.10 0.00 0.09 0.00 0.00 57.88 57.74 1ik0 h LEU 17 Cb 1.09 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 1ik0 h LEU 17 CO 0.10 0.60 0.01 0.58 0.09 0.00 0.00 178.44 179.83 1ik0 h VAL 18 N 0.65 1.27 -0.85 1.22 2.07 -1.11 -2.83 116.25 116.66 1ik0 h VAL 18 Ca 0.17 -1.15 0.01 0.00 0.82 0.00 0.00 66.70 66.55 1ik0 h VAL 18 Cb 0.12 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.63 1ik0 h VAL 18 CO -0.02 0.42 0.56 -1.13 0.02 0.00 0.00 177.57 177.42 1ik0 h ASN 19 N 0.99 0.97 1.57 0.57 -1.24 -1.08 -0.68 115.58 116.69 1ik0 h ASN 19 Ca 0.18 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.16 1ik0 h ASN 19 Cb 0.55 -0.24 0.00 0.00 0.73 0.00 0.00 38.32 39.36 1ik0 h ASN 19 CO 0.03 0.71 0.00 0.16 -1.29 0.00 0.00 177.43 177.03 1ik0 h ILE 20 N 1.15 0.00 0.00 2.57 3.07 -1.37 -3.26 117.51 119.67 1ik0 h ILE 20 Ca 0.31 -0.68 0.00 0.00 1.55 0.00 0.00 64.86 66.04 1ik0 h ILE 20 Cb -0.13 1.66 0.00 0.00 -0.27 0.00 0.00 36.82 38.07 1ik0 h ILE 20 CO -0.07 0.00 -0.94 0.35 -1.05 0.00 0.00 178.15 176.45 1ik0 n THR 21 N -2.73 0.00 -0.04 0.16 -2.24 -0.95 -4.08 114.28 104.40 1ik0 n THR 21 Ca 0.04 -0.09 -0.21 0.00 -2.27 0.00 0.00 64.05 61.52 1ik0 n THR 21 Cb 0.44 0.94 -0.13 0.00 -2.10 0.00 0.00 70.33 69.48 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 0.13 -0.87 -0.78 1.08 -1.18 -3.37 115.11 110.12 1ik0 h GLN 22 Ca 0.00 -0.22 -0.39 0.00 -1.45 0.00 0.00 58.65 56.59 1ik0 h GLN 22 Cb 0.46 0.08 -0.23 0.00 -0.05 0.00 0.00 27.48 27.74 1ik0 h GLN 22 CO 0.00 1.11 0.48 0.27 -0.95 0.00 0.00 178.83 179.73 1ik0 n ASN 23 N -4.12 4.04 -4.72 1.46 6.94 -1.24 -4.97 115.26 112.65 1ik0 n ASN 23 Ca -0.27 -3.49 -0.42 0.00 -0.02 0.00 0.00 54.58 50.38 1ik0 n ASN 23 Cb 0.80 -0.79 -0.03 0.00 -2.36 0.00 0.00 39.78 37.39 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 -3.19 4.58 0.00 -3.83 0.00 -1.26 -4.99 119.66 110.97 1ik0 s GLN 24 Ca 0.56 1.39 0.00 0.00 -0.00 0.00 0.00 55.36 57.30 1ik0 s GLN 24 Cb 0.46 -3.44 0.00 0.00 0.00 0.00 0.00 33.01 30.03 1ik0 s GLN 24 CO 0.11 0.03 0.00 1.17 0.00 0.00 0.00 175.29 176.60 1ik0 n LYS 25 N 3.60 0.00 -1.82 9.60 4.81 -1.26 -4.95 118.16 128.14 1ik0 n LYS 25 Ca 0.04 0.02 -0.31 0.00 -0.87 0.00 0.00 58.31 57.19 1ik0 n LYS 25 Cb 0.51 -0.30 0.02 0.00 0.02 0.00 0.00 35.03 35.28 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 -4.38 2.91 0.96 3.14 0.00 -1.26 -4.98 121.76 118.15 1ik0 s ALA 26 Ca 0.00 0.04 -0.15 0.00 0.00 0.00 0.00 51.96 51.84 1ik0 s ALA 26 Cb 0.00 -3.13 -0.07 0.00 0.00 0.00 0.00 23.12 19.92 1ik0 s ALA 26 CO 0.00 -0.86 -0.25 -2.30 0.00 0.00 0.00 175.76 172.35 1ik0 n PRO 27 N -2.73 -0.11 -0.17 0.00 -0.02 -1.26 -4.83 135.00 125.88 1ik0 n PRO 27 Ca 0.07 -0.01 -0.02 0.00 -2.02 0.00 0.00 63.50 61.51 1ik0 n PRO 27 Cb 0.54 -1.37 0.19 0.00 -0.02 0.00 0.00 33.50 32.84 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 -1.18 0.84 -8.57 2.45 3.38 -1.98 -3.45 115.31 106.79 1ik0 h LEU 28 Ca -0.44 -0.11 -0.27 0.00 0.09 0.00 0.00 57.88 57.15 1ik0 h LEU 28 Cb 1.30 -0.22 -0.11 0.00 0.09 0.00 0.00 40.66 41.72 1ik0 h LEU 28 CO 0.29 0.74 -0.34 0.00 0.09 0.00 0.00 178.44 179.21 1ik0 n ASN 30 N -1.00 2.52 -1.06 0.00 5.15 -1.26 -4.12 115.26 115.49 1ik0 n ASN 30 Ca 0.02 -2.03 -0.10 0.00 -0.60 0.00 0.00 54.58 51.87 1ik0 n ASN 30 Cb 0.63 -0.70 -0.01 0.00 -0.53 0.00 0.00 39.78 39.17 1ik0 n ASN 30 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1ik0 n GLY 31 N 3.37 0.07 3.74 8.20 0.00 -1.26 -4.97 105.19 114.35 1ik0 n GLY 31 Ca 0.22 -0.50 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.60 5.02 0.11 1.61 0.01 -1.26 -4.90 113.70 111.70 1ik0 s SER 32 Ca 0.00 2.73 0.06 0.00 1.31 0.00 0.00 55.95 60.05 1ik0 s SER 32 Cb 0.00 -2.63 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 1ik0 s SER 32 CO 0.00 -1.73 -0.15 -0.04 0.41 0.00 0.00 173.24 171.73 1ik0 s MET 33 N -3.07 1.01 0.20 12.44 -1.94 -1.26 -2.44 119.30 124.23 1ik0 s MET 33 Ca 0.76 -1.18 0.05 0.00 -1.71 0.00 0.00 55.69 53.61 1ik0 s MET 33 Cb -0.40 -0.98 -0.05 0.00 2.01 0.00 0.00 34.83 35.42 1ik0 s MET 33 CO 0.45 0.20 -0.07 0.14 -0.01 0.00 0.00 175.02 175.73 1ik0 s VAL 34 N -1.82 1.28 0.12 -6.03 -7.23 0.03 -4.86 120.40 101.88 1ik0 s VAL 34 Ca 0.07 -2.09 -0.30 0.00 -1.81 0.00 0.00 61.98 57.85 1ik0 s VAL 34 Cb -0.07 -2.11 -0.07 0.00 0.56 0.00 0.00 36.38 34.70 1ik0 s VAL 34 CO 0.03 -0.54 1.20 0.26 -0.31 0.00 0.00 175.10 175.75 1ik0 s TRP 35 N -3.26 3.44 0.39 2.82 0.52 -1.26 -0.49 118.94 121.09 1ik0 s TRP 35 Ca 0.23 1.36 -0.26 0.00 0.02 0.00 0.00 56.10 57.45 1ik0 s TRP 35 Cb 0.03 -3.42 -0.09 0.00 -1.15 0.00 0.00 33.47 28.84 1ik0 s TRP 35 CO 0.05 -1.25 1.19 0.45 0.02 0.00 0.00 176.95 177.41 1ik0 s SER 36 N 0.59 6.57 0.28 2.95 0.15 -1.04 -4.88 113.70 118.31 1ik0 s SER 36 Ca 0.56 2.39 0.03 0.00 0.70 0.00 0.00 55.95 59.64 1ik0 s SER 36 Cb -0.31 -2.62 -0.06 0.00 -1.71 0.00 0.00 66.02 61.32 1ik0 s SER 36 CO 0.33 -0.65 0.04 0.27 1.20 0.00 0.00 173.24 174.43 1ik0 s ILE 37 N -1.36 1.07 -0.16 6.45 -4.36 -1.26 -4.85 121.20 116.73 1ik0 s ILE 37 Ca 0.56 -2.02 -0.22 0.00 -0.26 0.00 0.00 60.65 58.70 1ik0 s ILE 37 Cb -0.32 -2.60 -0.03 0.00 1.25 0.00 0.00 42.46 40.76 1ik0 s ILE 37 CO 0.41 -0.12 0.69 0.20 0.24 0.00 0.00 174.94 176.35 1ik0 s ASN 38 N -3.40 6.81 -0.44 4.36 0.01 -1.26 -5.00 114.94 116.02 1ik0 s ASN 38 Ca 0.34 0.99 -0.29 0.00 -0.71 0.00 0.00 52.86 53.19 1ik0 s ASN 38 Cb 0.07 -2.38 0.03 0.00 0.41 0.00 0.00 41.25 39.38 1ik0 s ASN 38 CO 0.13 -0.26 1.12 -0.76 -1.51 0.00 0.00 177.10 175.82 1ik0 s LEU 39 N 1.67 3.72 0.00 0.60 2.01 -1.26 -4.88 118.68 120.55 1ik0 s LEU 39 Ca 0.33 0.61 0.00 0.00 0.01 0.00 0.00 54.13 55.08 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 0.12 -1.15 0.00 0.35 1.01 0.00 0.00 176.35 176.68 1ik0 n THR 40 N 6.58 0.00 0.00 5.49 -2.24 -1.26 -5.08 114.28 117.77 1ik0 n THR 40 Ca 0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.90 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 -0.16 6.98 0.00 -1.26 -4.40 120.51 118.67 1ik0 n ALA 41 Ca 0.00 -0.05 -0.01 0.00 0.00 0.00 0.00 53.44 53.38 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 2.21 1.18 0.33 0.00 0.00 -1.26 -4.26 105.19 103.38 1ik0 n GLY 42 Ca 0.00 -0.13 -0.05 0.00 0.00 0.00 0.00 46.02 45.84 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 4.28 1.09 -0.21 1.61 0.00 -1.91 -1.55 114.93 118.24 1ik0 h MET 43 Ca 0.02 -0.22 0.03 0.00 0.00 0.00 0.00 59.70 59.53 1ik0 h MET 43 Cb 0.27 -0.16 -0.03 0.00 0.00 0.00 0.00 31.60 31.68 1ik0 h MET 43 CO 0.21 0.93 0.00 1.88 0.00 0.00 0.00 176.91 179.93 1ik0 h TYR 44 N 1.05 -0.01 -0.09 -0.22 -1.99 -1.95 1.21 116.97 114.99 1ik0 h TYR 44 Ca 0.23 0.02 -0.02 0.00 2.00 0.00 0.00 58.73 60.96 1ik0 h TYR 44 Cb 0.28 0.03 -0.00 0.00 2.00 0.00 0.00 36.73 39.04 1ik0 h TYR 44 CO 0.02 -0.03 -0.03 0.00 -0.00 0.00 0.00 178.16 178.13 1ik0 h ALA 46 N 0.66 0.26 -0.53 0.00 0.00 -0.99 -2.06 119.26 116.60 1ik0 h ALA 46 Ca 0.02 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ik0 h ALA 46 Cb 0.45 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1ik0 h ALA 46 CO 0.01 -0.24 0.18 0.00 0.00 0.00 0.00 179.25 179.20 1ik0 h ALA 47 N 1.04 1.32 0.01 0.00 0.00 0.15 -2.88 119.26 118.91 1ik0 h ALA 47 Ca 0.07 -0.16 -0.00 0.00 0.00 0.00 0.00 54.91 54.82 1ik0 h ALA 47 Cb 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ik0 h ALA 47 CO -0.01 0.50 -0.01 1.25 0.00 0.00 0.00 179.25 180.97 1ik0 h LEU 48 N 0.77 -0.02 -1.04 0.00 5.85 -0.25 -2.01 115.31 118.61 1ik0 h LEU 48 Ca 0.18 -0.00 0.02 0.00 0.84 0.00 0.00 57.88 58.92 1ik0 h LEU 48 Cb 0.20 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.18 1ik0 h LEU 48 CO -0.01 -0.01 0.65 1.05 -0.34 0.00 0.00 178.44 179.77 1ik0 h GLU 49 N -0.02 1.25 -0.99 1.25 4.11 -1.23 -0.57 114.58 118.38 1ik0 h GLU 49 Ca -0.00 -0.07 0.01 0.00 0.07 0.00 0.00 59.36 59.36 1ik0 h GLU 49 Cb 0.02 -0.28 -0.05 0.00 0.50 0.00 0.00 28.75 28.94 1ik0 h GLU 49 CO 0.00 0.82 0.65 0.77 0.07 0.00 0.00 179.01 181.33 1ik0 h SER 50 N 1.28 1.14 -0.35 3.06 0.02 -1.27 -2.25 113.55 115.18 1ik0 h SER 50 Ca 0.37 -0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 61.14 1ik0 h SER 50 Cb -0.08 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.17 1ik0 h SER 50 CO -0.10 0.83 -0.36 -0.07 -1.14 0.00 0.00 176.83 175.99 1ik0 h LEU 51 N 1.34 0.95 -0.99 5.07 3.38 -0.52 -2.72 115.31 121.82 1ik0 h LEU 51 Ca 0.36 -0.42 0.00 0.00 0.09 0.00 0.00 57.88 57.91 1ik0 h LEU 51 Cb -0.15 -0.27 0.00 0.00 0.09 0.00 0.00 40.66 40.33 1ik0 h LEU 51 CO -0.08 1.20 0.27 0.40 0.09 0.00 0.00 178.44 180.32 1ik0 h ILE 52 N 0.74 0.00 0.00 1.22 1.08 -0.52 1.10 117.51 121.12 1ik0 h ILE 52 Ca 0.07 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.54 1ik0 h ILE 52 Cb 0.94 0.33 0.00 0.00 -3.07 0.00 0.00 36.82 35.02 1ik0 h ILE 52 CO 0.09 0.00 -0.41 0.78 -0.69 0.00 0.00 178.15 177.92 1ik0 h ASN 53 N 0.00 0.00 -3.55 1.72 2.35 -1.47 -3.44 115.58 111.18 1ik0 h ASN 53 Ca 0.00 -0.10 -0.61 0.00 -0.55 0.00 0.00 56.30 55.04 1ik0 h ASN 53 Cb 0.54 0.00 -0.12 0.00 0.05 0.00 0.00 38.32 38.79 1ik0 h ASN 53 CO 0.00 0.05 -0.02 -0.69 -1.65 0.00 0.00 177.43 175.12 1ik0 s VAL 54 N -3.17 5.08 0.08 2.81 1.01 0.38 -5.06 120.40 121.52 1ik0 s VAL 54 Ca 0.07 0.90 0.06 0.00 0.00 0.00 0.00 61.98 63.01 1ik0 s VAL 54 Cb 0.12 -3.83 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 1ik0 s VAL 54 CO 0.69 0.11 -0.17 -0.44 0.00 0.00 0.00 175.10 175.29 1ik0 s SER 55 N 1.45 1.99 0.00 3.32 0.01 -1.26 -4.73 113.70 114.48 1ik0 s SER 55 Ca 0.22 -0.61 0.00 0.00 1.31 0.00 0.00 55.95 56.87 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 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.34 1ik0 n GLY 56 N 1.33 1.41 3.35 3.44 0.00 -1.26 -5.01 105.19 108.45 1ik0 n GLY 56 Ca -0.20 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.37 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 8.98 0.95 -1.29 0.00 0.87 -1.95 -3.08 113.55 118.03 1ik0 h SER 58 Ca -0.27 -0.42 0.37 0.00 -1.23 0.00 0.00 61.79 60.24 1ik0 h SER 58 Cb 1.09 -0.27 -0.06 0.00 -0.44 0.00 0.00 62.40 62.73 1ik0 h SER 58 CO 1.06 1.21 0.92 0.00 -0.53 0.00 0.00 176.83 179.49 1ik0 h ALA 59 N 0.84 3.17 -0.01 6.23 0.00 -1.93 0.19 119.26 127.76 1ik0 h ALA 59 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ik0 h ALA 59 Cb 0.95 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.83 1ik0 h ALA 59 CO 0.09 -1.55 -0.79 0.44 0.00 0.00 0.00 179.25 177.44 1ik0 n ILE 60 N -4.18 0.00 -0.29 0.00 -5.35 -1.17 -4.39 119.36 103.98 1ik0 n ILE 60 Ca 0.28 -0.10 -0.04 0.00 -0.27 0.00 0.00 62.75 62.62 1ik0 n ILE 60 Cb 1.34 1.09 0.07 0.00 -1.74 0.00 0.00 39.64 40.41 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 0.89 1.03 -0.87 6.28 5.08 -0.60 -1.02 114.58 125.38 1ik0 h GLU 61 Ca 0.00 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.27 1ik0 h GLU 61 Cb 0.58 -0.23 -0.04 0.00 0.50 0.00 0.00 28.75 29.56 1ik0 h GLU 61 CO 0.00 0.68 0.44 0.87 -1.00 0.00 0.00 179.01 180.00 1ik0 h LYS 62 N 1.06 1.23 -1.00 2.33 1.57 -1.77 -2.28 116.57 117.72 1ik0 h LYS 62 Ca 0.29 -0.17 0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1ik0 h LYS 62 Cb -0.11 -0.23 -0.05 0.00 0.08 0.00 0.00 32.23 31.92 1ik0 h LYS 62 CO -0.07 0.93 0.66 1.15 -0.57 0.00 0.00 179.45 181.55 1ik0 h THR 63 N 1.23 1.26 -0.91 -0.16 2.02 -1.45 -2.21 112.91 112.68 1ik0 h THR 63 Ca 0.30 -0.46 0.00 0.00 0.77 0.00 0.00 66.41 67.02 1ik0 h THR 63 Cb 0.08 -0.22 -0.04 0.00 -1.74 0.00 0.00 68.15 66.23 1ik0 h THR 63 CO -0.04 0.25 0.57 1.56 0.37 0.00 0.00 175.52 178.23 1ik0 h GLN 64 N 1.35 1.21 -0.56 6.66 4.20 -0.70 -1.59 115.11 125.69 1ik0 h GLN 64 Ca 0.37 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.96 1ik0 h GLN 64 Cb -0.16 -0.26 -0.03 0.00 0.30 0.00 0.00 27.48 27.34 1ik0 h GLN 64 CO -0.08 0.83 0.24 0.00 -0.67 0.00 0.00 178.83 179.15 1ik0 h ARG 65 N 1.24 0.82 -0.73 1.46 3.08 -1.23 -1.82 114.38 117.20 1ik0 h ARG 65 Ca 0.33 -0.14 -0.07 0.00 0.07 0.00 0.00 59.98 60.18 1ik0 h ARG 65 Cb -0.10 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.78 1ik0 h ARG 65 CO -0.07 0.69 0.20 0.52 -1.07 0.00 0.00 179.97 180.25 1ik0 h MET 66 N 0.76 1.15 -0.80 0.04 2.86 -1.12 -2.46 114.93 115.37 1ik0 h MET 66 Ca 0.19 -0.27 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1ik0 h MET 66 Cb 0.16 -0.16 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 1ik0 h MET 66 CO -0.02 1.00 0.45 -0.07 1.06 0.00 0.00 176.91 179.33 1ik0 h LEU 67 N 1.10 0.98 -1.07 1.22 3.38 -0.96 -1.98 115.31 117.96 1ik0 h LEU 67 Ca 0.23 -0.07 0.06 0.00 0.09 0.00 0.00 57.88 58.19 1ik0 h LEU 67 Cb 0.35 -0.25 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 1ik0 h LEU 67 CO -0.00 0.78 0.62 0.28 0.09 0.00 0.00 178.44 180.21 1ik0 h SER 68 N 1.11 0.99 -1.00 -0.43 0.02 -0.85 0.49 113.55 113.87 1ik0 h SER 68 Ca 0.28 0.01 0.29 0.00 -0.84 0.00 0.00 61.79 61.53 1ik0 h SER 68 Cb 0.01 -0.21 -0.04 0.00 0.14 0.00 0.00 62.40 62.30 1ik0 h SER 68 CO -0.05 0.64 0.71 1.23 -1.14 0.00 0.00 176.83 178.22 1ik0 h GLY 69 N 1.12 0.07 0.67 -3.77 0.00 -1.23 1.65 103.07 101.59 1ik0 h GLY 69 Ca 0.41 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.73 1ik0 h GLY 69 CO -0.16 -0.01 -0.80 0.69 0.00 0.00 0.00 176.54 176.27 1ik0 n PHE 70 N -4.26 0.14 -3.42 5.60 3.72 0.09 -4.47 117.46 114.87 1ik0 n PHE 70 Ca 0.21 0.04 -0.26 0.00 -0.05 0.00 0.00 57.45 57.39 1ik0 n PHE 70 Cb 1.05 -0.30 -0.09 0.00 -0.94 0.00 0.00 39.48 39.20 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 1.93 0.00 -3.58 0.00 -0.02 -0.68 -4.39 135.00 128.26 1ik0 n PRO 72 Ca 0.25 0.05 -0.38 0.00 -2.02 0.00 0.00 63.50 61.40 1ik0 n PRO 72 Cb 0.46 -1.54 -0.11 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 -1.72 3.22 0.26 6.00 -3.43 -1.26 -5.06 115.29 113.30 1ik0 s HIS 73 Ca 0.00 0.09 -0.30 0.00 -0.80 0.00 0.00 55.06 54.06 1ik0 s HIS 73 Cb 0.00 -2.39 -0.09 0.00 -1.43 0.00 0.00 32.58 28.66 1ik0 s HIS 73 CO 0.00 -0.18 1.06 0.15 -2.00 0.00 0.00 174.74 173.77 1ik0 s LYS 74 N 1.76 4.69 -0.15 -0.38 1.02 -1.26 -5.03 119.74 120.39 1ik0 s LYS 74 Ca 0.07 1.72 -0.03 0.00 0.02 0.00 0.00 55.97 57.75 1ik0 s LYS 74 Cb -0.16 -3.22 -0.03 0.00 -0.52 0.00 0.00 37.83 33.90 1ik0 s LYS 74 CO 0.11 0.27 -0.05 0.08 -0.92 0.00 0.00 175.35 174.84 1ik0 s VAL 75 N -1.05 3.75 0.45 3.17 1.01 -1.26 -5.10 120.40 121.36 1ik0 s VAL 75 Ca 0.44 -0.41 -0.01 0.00 0.00 0.00 0.00 61.98 62.00 1ik0 s VAL 75 Cb -0.30 -2.63 -0.02 0.00 0.00 0.00 0.00 36.38 33.43 1ik0 s VAL 75 CO 0.38 0.50 0.69 -0.94 0.00 0.00 0.00 175.10 175.73 1ik0 s SER 76 N 0.35 5.99 0.00 3.32 1.04 -1.26 -4.93 113.70 118.21 1ik0 s SER 76 Ca -0.05 0.49 0.02 0.00 0.48 0.00 0.00 55.95 56.89 1ik0 s SER 76 Cb -0.14 -1.80 0.11 0.00 0.10 0.00 0.00 66.02 64.29 1ik0 s SER 76 CO 0.03 -0.62 0.93 0.00 0.98 0.00 0.00 173.24 174.56 1ik0 n ALA 77 N -2.10 1.26 -0.05 5.32 0.00 -1.26 -1.26 120.51 122.42 1ik0 n ALA 77 Ca 0.00 -0.01 0.01 0.00 0.00 0.00 0.00 53.44 53.44 1ik0 n ALA 77 Cb 0.57 -1.04 -0.14 0.00 0.00 0.00 0.00 19.45 18.84 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 -1.13 -0.85 3.64 0.00 0.00 -1.26 -4.91 105.19 100.67 1ik0 n GLY 78 Ca 0.01 -0.37 -0.40 0.00 0.00 0.00 0.00 46.02 45.27 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 -2.87 4.12 0.00 1.61 -0.21 -0.39 -5.06 119.66 116.86 1ik0 s GLN 79 Ca -0.08 0.36 0.04 0.00 0.02 0.00 0.00 55.36 55.70 1ik0 s GLN 79 Cb 0.09 -3.61 -0.01 0.00 1.00 0.00 0.00 33.01 30.47 1ik0 s GLN 79 CO 0.74 -0.26 -0.13 -0.06 -2.12 0.00 0.00 175.29 173.47 1ik0 s PHE 80 N 2.00 1.15 0.00 0.91 0.08 -1.26 -4.40 117.98 116.46 1ik0 s PHE 80 Ca 0.22 -0.25 0.00 0.00 0.12 0.00 0.00 56.93 57.02 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 0.09 -0.01 0.00 0.43 -0.10 0.00 0.00 175.22 175.64 1ik0 n SER 81 N 2.52 4.35 -0.44 1.36 7.64 -1.26 -4.80 113.62 122.99 1ik0 n SER 81 Ca -0.15 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.80 1ik0 n SER 81 Cb 0.55 0.43 0.03 0.00 -1.01 0.00 0.00 64.21 64.22 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 -1.81 1.83 -1.13 6.43 2.88 -1.26 -4.47 113.62 116.09 1ik0 n SER 82 Ca 0.00 -1.41 -0.02 0.00 -1.33 0.00 0.00 58.87 56.11 1ik0 n SER 82 Cb 0.43 0.21 0.10 0.00 -0.75 0.00 0.00 64.21 64.21 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 0.34 3.20 0.05 2.46 4.32 -1.26 -4.02 117.00 122.09 1ik0 n LEU 83 Ca 0.07 -1.64 -0.15 0.00 -0.02 0.00 0.00 56.01 54.26 1ik0 n LEU 83 Cb 0.32 -0.58 -0.06 0.00 -1.62 0.00 0.00 43.42 41.48 1ik0 n LEU 83 CO 0.12 0.50 0.18 0.45 -1.22 0.00 0.00 177.39 177.41 1ik0 h HIS 84 N 0.86 0.77 -4.05 -1.77 3.86 -1.94 -3.44 115.15 109.44 1ik0 h HIS 84 Ca 0.08 -0.40 -0.46 0.00 -1.16 0.00 0.00 60.37 58.43 1ik0 h HIS 84 Cb 1.23 -0.09 0.01 0.00 1.06 0.00 0.00 27.41 29.62 1ik0 h HIS 84 CO 0.41 1.22 0.38 0.08 0.86 0.00 0.00 177.93 180.88 1ik0 s VAL 85 N -3.36 3.93 -1.31 2.45 1.01 -1.26 -4.94 120.40 116.94 1ik0 s VAL 85 Ca -0.07 1.25 -0.07 0.00 0.00 0.00 0.00 61.98 63.08 1ik0 s VAL 85 Cb 0.08 -3.53 0.14 0.00 0.00 0.00 0.00 36.38 33.08 1ik0 s VAL 85 CO 0.88 -0.22 2.17 0.54 0.00 0.00 0.00 175.10 178.48 1ik0 n ARG 86 N -0.74 4.19 -2.06 2.72 1.74 -1.26 -4.97 116.66 116.29 1ik0 n ARG 86 Ca 0.08 -3.49 -0.27 0.00 -0.77 0.00 0.00 57.85 53.39 1ik0 n ARG 86 Cb 0.52 -2.75 0.08 0.00 -1.02 0.00 0.00 32.46 29.29 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 0.54 4.69 0.44 0.55 1.01 -1.26 -5.07 116.67 117.56 1ik0 s ASP 87 Ca 0.48 0.62 0.01 0.00 0.71 0.00 0.00 52.55 54.36 1ik0 s ASP 87 Cb 0.15 -1.20 -0.01 0.00 1.01 0.00 0.00 42.92 42.87 1ik0 s ASP 87 CO -0.05 -1.73 0.65 0.42 0.21 0.00 0.00 175.17 174.67 1ik0 s THR 88 N -3.40 4.09 0.32 -1.27 -4.23 -1.26 -4.84 115.64 105.05 1ik0 s THR 88 Ca 0.61 -0.51 -0.10 0.00 -1.18 0.00 0.00 61.69 60.51 1ik0 s THR 88 Cb -0.11 -3.51 -0.07 0.00 1.34 0.00 0.00 72.50 70.16 1ik0 s THR 88 CO 0.47 -0.35 0.67 -0.54 -0.54 0.00 0.00 174.62 174.33 1ik0 s LYS 89 N -4.52 3.80 0.20 3.99 1.02 -1.26 -2.51 119.74 120.45 1ik0 s LYS 89 Ca 0.48 0.36 0.04 0.00 0.02 0.00 0.00 55.97 56.86 1ik0 s LYS 89 Cb -0.10 -2.51 -0.05 0.00 -0.52 0.00 0.00 37.83 34.65 1ik0 s LYS 89 CO 0.37 0.14 -0.03 0.96 -0.92 0.00 0.00 175.35 175.87 1ik0 s ILE 90 N -2.11 1.05 0.52 2.17 -4.36 0.35 -4.88 121.20 113.95 1ik0 s ILE 90 Ca 0.49 -2.04 -0.21 0.00 -0.26 0.00 0.00 60.65 58.63 1ik0 s ILE 90 Cb -0.11 -2.17 -0.06 0.00 1.25 0.00 0.00 42.46 41.38 1ik0 s ILE 90 CO 0.26 -0.47 1.21 -1.61 0.24 0.00 0.00 174.94 174.57 1ik0 s GLU 91 N -3.83 3.40 0.24 0.37 2.02 -1.26 -0.79 118.70 118.85 1ik0 s GLU 91 Ca 0.24 1.87 -0.07 0.00 0.02 0.00 0.00 54.97 57.03 1ik0 s GLU 91 Cb 0.05 -2.22 0.23 0.00 0.10 0.00 0.00 34.13 32.28 1ik0 s GLU 91 CO 0.06 -0.87 1.91 0.28 0.02 0.00 0.00 175.26 176.65 1ik0 h VAL 92 N 1.49 1.22 -0.97 2.63 2.07 -1.83 -1.39 116.25 119.48 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 1.27 -0.11 -0.10 0.00 -1.52 0.00 0.00 31.29 30.83 1ik0 h VAL 92 CO 0.58 0.22 0.58 0.00 0.02 0.00 0.00 177.57 178.97 1ik0 h ALA 93 N 1.34 1.54 0.01 1.67 0.00 -1.91 0.53 119.26 122.44 1ik0 h ALA 93 Ca 0.34 0.07 -0.23 0.00 0.00 0.00 0.00 54.91 55.08 1ik0 h ALA 93 Cb -0.12 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1ik0 h ALA 93 CO -0.08 0.01 -0.98 1.96 0.00 0.00 0.00 179.25 180.16 1ik0 h GLN 94 N 0.79 0.41 -0.05 0.00 4.20 -1.73 -2.93 115.11 115.81 1ik0 h GLN 94 Ca 0.53 -0.46 0.00 0.00 0.06 0.00 0.00 58.65 58.78 1ik0 h GLN 94 Cb 0.74 0.14 -0.00 0.00 0.30 0.00 0.00 27.48 28.65 1ik0 h GLN 94 CO -0.35 1.13 0.03 0.35 -0.67 0.00 0.00 178.83 179.31 1ik0 h PHE 95 N 0.22 0.05 -0.33 2.96 3.04 0.08 -1.35 116.94 121.61 1ik0 h PHE 95 Ca -0.09 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.85 1ik0 h PHE 95 Cb 1.62 -0.02 -0.02 0.00 2.56 0.00 0.00 35.95 40.10 1ik0 h PHE 95 CO 0.06 0.03 0.16 0.28 -2.02 0.00 0.00 178.31 176.82 1ik0 h VAL 96 N 0.06 1.16 -0.05 1.41 2.07 -1.15 -1.72 116.25 118.03 1ik0 h VAL 96 Ca 0.02 -0.46 0.00 0.00 0.82 0.00 0.00 66.70 67.08 1ik0 h VAL 96 Cb -0.00 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 30.62 1ik0 h VAL 96 CO -0.01 0.17 0.03 0.11 0.02 0.00 0.00 177.57 177.89 1ik0 h LYS 97 N 0.39 0.07 -1.00 1.57 1.57 -1.35 0.18 116.57 118.00 1ik0 h LYS 97 Ca 0.11 -0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.90 1ik0 h LYS 97 Cb 0.12 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 32.37 1ik0 h LYS 97 CO -0.01 0.06 0.66 -0.44 -0.57 0.00 0.00 179.45 179.15 1ik0 h ASP 98 N 0.06 1.15 -0.25 0.86 3.32 -1.18 -1.46 116.42 118.93 1ik0 h ASP 98 Ca 0.02 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 56.95 1ik0 h ASP 98 Cb 0.00 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.25 1ik0 h ASP 98 CO -0.00 0.83 -0.13 0.25 -1.72 0.00 0.00 179.24 178.47 1ik0 h LEU 99 N 1.36 0.65 -0.86 1.55 5.85 -0.85 -3.01 115.31 120.00 1ik0 h LEU 99 Ca 0.37 -0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.95 1ik0 h LEU 99 Cb -0.15 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 40.64 1ik0 h LEU 99 CO -0.08 0.80 0.54 0.25 -0.34 0.00 0.00 178.44 179.61 1ik0 h LEU 100 N 0.60 0.86 -0.48 2.25 5.85 0.45 -0.93 115.31 123.90 1ik0 h LEU 100 Ca 0.10 0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.84 1ik0 h LEU 100 Cb 0.57 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.40 1ik0 h LEU 100 CO 0.04 0.56 0.32 -0.07 -0.34 0.00 0.00 178.44 178.95 1ik0 h LEU 101 N 1.00 0.55 -0.48 2.25 -0.00 -1.37 -2.78 115.31 114.49 1ik0 h LEU 101 Ca 0.37 -0.01 -0.14 0.00 -0.00 0.00 0.00 57.88 58.09 1ik0 h LEU 101 Cb 0.12 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 40.63 1ik0 h LEU 101 CO -0.16 0.40 -0.26 0.45 -0.00 0.00 0.00 178.44 178.88 1ik0 h HIS 102 N 0.65 1.13 0.29 1.13 3.86 -1.47 -1.94 115.15 118.80 1ik0 h HIS 102 Ca 0.18 -0.29 0.00 0.00 -1.16 0.00 0.00 60.37 59.10 1ik0 h HIS 102 Cb -0.08 -0.26 -0.02 0.00 1.06 0.00 0.00 27.41 28.12 1ik0 h HIS 102 CO -0.04 1.11 -0.29 -0.07 0.86 0.00 0.00 177.93 179.50 1ik0 h LEU 103 N 0.83 -0.79 -1.50 2.43 3.38 -0.92 -1.60 115.31 117.13 1ik0 h LEU 103 Ca 0.10 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1ik0 h LEU 103 Cb 0.84 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.86 1ik0 h LEU 103 CO 0.07 -0.42 0.00 0.07 0.09 0.00 0.00 178.44 178.25 1ik0 h LYS 104 N -0.62 0.00 -0.22 1.13 2.10 -1.55 -3.14 116.57 114.27 1ik0 h LYS 104 Ca -0.01 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.63 1ik0 h LYS 104 Cb 0.57 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.89 1ik0 h LYS 104 CO -0.06 0.00 0.09 -0.22 -2.00 0.00 0.00 179.45 177.26 1ik0 h LYS 105 N 0.00 0.32 0.00 0.07 3.64 -0.47 -2.23 116.57 117.91 1ik0 h LYS 105 Ca 0.00 -0.05 -0.02 0.00 -1.27 0.00 0.00 60.65 59.31 1ik0 h LYS 105 Cb 0.49 -0.05 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1ik0 h LYS 105 CO 0.00 0.36 -0.08 -0.07 -2.27 0.00 0.00 179.45 177.39 1ik0 h LEU 106 N 0.21 0.00 -1.10 5.20 -0.00 -1.45 -2.01 115.31 116.17 1ik0 h LEU 106 Ca 0.07 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.97 1ik0 h LEU 106 Cb 0.15 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.76 1ik0 h LEU 106 CO -0.01 0.08 0.61 0.15 -0.00 0.00 0.00 178.44 179.28 1ik0 h PHE 107 N 0.00 1.15 -0.88 1.13 3.57 -1.47 0.44 116.94 120.89 1ik0 h PHE 107 Ca -0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.53 1ik0 h PHE 107 Cb 0.15 -0.39 -0.04 0.00 2.79 0.00 0.00 35.95 38.46 1ik0 h PHE 107 CO 0.00 0.71 0.58 0.00 -2.23 0.00 0.00 178.31 177.37 1ik0 h ARG 108 N 1.23 1.16 -0.00 1.11 3.08 -1.25 -1.11 114.38 118.59 1ik0 h ARG 108 Ca 0.35 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.32 1ik0 h ARG 108 Cb -0.11 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.68 1ik0 h ARG 108 CO -0.08 0.77 -0.24 0.39 -1.07 0.00 0.00 179.97 179.75 1ik0 n GLU 109 N -4.40 0.43 -1.05 0.04 1.02 -0.62 -4.90 120.64 111.16 1ik0 n GLU 109 Ca 0.10 -0.19 -0.02 0.00 -0.02 0.00 0.00 57.16 57.03 1ik0 n GLU 109 Cb 0.02 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 29.94 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 1.39 0.25 3.40 0.62 0.00 0.05 -4.91 105.19 105.99 1ik0 n GLY 110 Ca 0.10 -0.02 -0.44 0.00 0.00 0.00 0.00 46.02 45.66 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 -1.85 3.10 -0.12 1.61 0.52 -1.16 -5.01 118.95 116.04 1ik0 s ARG 111 Ca 0.00 -1.26 -0.14 0.00 -0.52 0.00 0.00 55.73 53.81 1ik0 s ARG 111 Cb 0.00 -4.30 -0.05 0.00 0.52 0.00 0.00 34.95 31.13 1ik0 s ARG 111 CO 0.00 -1.62 0.34 -0.06 0.02 0.00 0.00 175.30 173.98 1ik0 s PHE 112 N 2.95 3.53 0.00 -0.53 0.08 -1.26 -4.80 117.98 117.95 1ik0 s PHE 112 Ca 0.15 0.71 0.00 0.00 0.12 0.00 0.00 56.93 57.92 1ik0 s PHE 112 Cb -0.21 -2.34 0.00 0.00 -0.57 0.00 0.00 43.02 39.90 1ik0 s PHE 112 CO 0.06 0.33 0.00 0.09 -0.10 0.00 0.00 175.22 175.60