#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 0.83 -5.12 0.00 -1.26 -4.96 107.32 98.48 1ik0 s GLY 2 Ca 0.00 0.24 -0.15 0.00 0.00 0.00 0.00 44.72 44.80 1ik0 s GLY 2 CO 0.00 0.59 0.15 -1.05 0.00 0.00 0.00 173.10 172.79 1ik0 n PRO 3 N -3.50 0.04 -2.84 2.90 -0.02 -1.26 -4.92 135.00 125.40 1ik0 n PRO 3 Ca 0.09 0.04 -0.40 0.00 -2.02 0.00 0.00 63.50 61.21 1ik0 n PRO 3 Cb 0.53 -1.59 -0.05 0.00 -0.02 0.00 0.00 33.50 32.37 1ik0 n PRO 3 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1ik0 s VAL 4 N -2.08 4.35 0.97 -1.45 -7.23 -1.26 -5.04 120.40 108.66 1ik0 s VAL 4 Ca 0.57 1.92 -0.11 0.00 -1.81 0.00 0.00 61.98 62.55 1ik0 s VAL 4 Cb -0.29 -4.25 0.17 0.00 0.56 0.00 0.00 36.38 32.58 1ik0 s VAL 4 CO 0.67 0.44 1.09 -2.16 -0.31 0.00 0.00 175.10 174.83 1ik0 s PRO 5 N -0.71 0.61 0.11 4.82 0.04 -1.26 -4.76 135.00 133.86 1ik0 s PRO 5 Ca 0.41 1.12 -0.20 0.00 0.04 0.00 0.00 61.00 62.38 1ik0 s PRO 5 Cb -0.24 -1.71 -0.07 0.00 0.04 0.00 0.00 34.50 32.52 1ik0 s PRO 5 CO 0.29 -2.77 1.74 -1.00 0.04 0.00 0.00 177.00 175.29 1ik0 h PRO 6 N -1.95 0.27 -1.00 0.56 0.13 -1.99 -1.20 132.00 126.83 1ik0 h PRO 6 Ca -0.50 -0.02 0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1ik0 h PRO 6 Cb 1.29 -0.06 -0.05 0.00 0.13 0.00 0.00 31.00 32.31 1ik0 h PRO 6 CO 0.48 0.22 0.67 0.66 -0.23 0.00 0.00 178.00 179.80 1ik0 h SER 7 N 0.25 1.15 -0.49 1.44 4.64 -1.94 -0.47 113.55 118.13 1ik0 h SER 7 Ca 0.07 -0.03 -0.13 0.00 -0.47 0.00 0.00 61.79 61.23 1ik0 h SER 7 Cb 0.02 -0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 61.81 1ik0 h SER 7 CO -0.01 0.83 -0.21 0.74 -0.87 0.00 0.00 176.83 177.31 1ik0 h THR 8 N 1.36 1.27 -0.90 2.95 2.02 -1.88 -1.51 112.91 116.22 1ik0 h THR 8 Ca 0.37 -1.38 0.01 0.00 0.77 0.00 0.00 66.41 66.18 1ik0 h THR 8 Cb -0.16 1.11 -0.04 0.00 -1.74 0.00 0.00 68.15 67.32 1ik0 h THR 8 CO -0.08 0.48 0.59 0.00 0.37 0.00 0.00 175.52 176.88 1ik0 h ALA 9 N 0.87 1.14 -0.17 6.16 0.00 -0.43 0.10 119.26 126.94 1ik0 h ALA 9 Ca 0.11 -0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1ik0 h ALA 9 Cb 0.79 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 1ik0 h ALA 9 CO 0.07 0.55 0.04 1.25 0.00 0.00 0.00 179.25 181.16 1ik0 h LEU 10 N 1.22 0.26 -0.53 0.00 7.12 -0.82 -1.22 115.31 121.34 1ik0 h LEU 10 Ca 0.33 -0.23 0.01 0.00 0.13 0.00 0.00 57.88 58.12 1ik0 h LEU 10 Cb -0.13 -0.07 -0.03 0.00 -0.53 0.00 0.00 40.66 39.91 1ik0 h LEU 10 CO -0.07 0.42 0.35 0.03 -0.13 0.00 0.00 178.44 179.04 1ik0 h ARG 11 N 0.09 0.70 -0.70 1.25 3.08 -0.76 -1.53 114.38 116.52 1ik0 h ARG 11 Ca 0.05 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.04 1ik0 h ARG 11 Cb 0.26 -0.16 -0.03 0.00 0.08 0.00 0.00 29.97 30.12 1ik0 h ARG 11 CO 0.00 0.46 0.35 0.93 -1.07 0.00 0.00 179.97 180.64 1ik0 h GLU 12 N 0.72 0.98 -0.31 0.04 5.08 -0.66 -2.00 114.58 118.43 1ik0 h GLU 12 Ca 0.20 -0.13 -0.13 0.00 -1.00 0.00 0.00 59.36 58.30 1ik0 h GLU 12 Cb -0.08 -0.19 -0.00 0.00 0.50 0.00 0.00 28.75 28.97 1ik0 h GLU 12 CO -0.04 0.75 -0.32 1.25 -1.00 0.00 0.00 179.01 179.65 1ik0 h LEU 13 N 0.98 0.83 -0.44 1.33 5.85 -0.63 -2.47 115.31 120.76 1ik0 h LEU 13 Ca 0.24 -0.47 -0.03 0.00 0.84 0.00 0.00 57.88 58.46 1ik0 h LEU 13 Cb 0.08 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.86 1ik0 h LEU 13 CO -0.03 1.13 0.15 0.40 -0.34 0.00 0.00 178.44 179.74 1ik0 h ILE 14 N 0.54 1.22 -0.72 4.05 2.04 -1.05 -1.21 117.51 122.37 1ik0 h ILE 14 Ca 0.05 -0.71 0.01 0.00 1.00 0.00 0.00 64.86 65.21 1ik0 h ILE 14 Cb 0.90 0.85 -0.04 0.00 -0.74 0.00 0.00 36.82 37.79 1ik0 h ILE 14 CO 0.08 0.26 0.48 -0.33 0.00 0.00 0.00 178.15 178.63 1ik0 h GLU 15 N 0.57 0.94 -0.27 2.37 5.08 -1.34 -0.58 114.58 121.36 1ik0 h GLU 15 Ca 0.14 -0.06 -0.12 0.00 -1.00 0.00 0.00 59.36 58.33 1ik0 h GLU 15 Cb 0.25 -0.21 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 1ik0 h GLU 15 CO -0.01 0.62 -0.29 1.49 -1.00 0.00 0.00 179.01 179.82 1ik0 h GLU 16 N 0.97 0.67 -0.68 2.33 4.57 -1.26 -1.43 114.58 119.75 1ik0 h GLU 16 Ca 0.26 -0.37 -0.03 0.00 -1.18 0.00 0.00 59.36 58.05 1ik0 h GLU 16 Cb -0.11 0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 28.47 1ik0 h GLU 16 CO -0.06 0.98 0.33 -0.07 -1.18 0.00 0.00 179.01 179.00 1ik0 h LEU 17 N 0.40 0.89 -0.59 1.64 3.38 -0.99 -2.49 115.31 117.56 1ik0 h LEU 17 Ca 0.04 -0.13 -0.11 0.00 0.09 0.00 0.00 57.88 57.77 1ik0 h LEU 17 Cb 0.87 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.37 1ik0 h LEU 17 CO 0.07 0.77 -0.05 0.58 0.09 0.00 0.00 178.44 179.91 1ik0 h VAL 18 N 0.94 1.27 -0.83 1.22 2.07 -1.06 -2.68 116.25 117.18 1ik0 h VAL 18 Ca 0.23 -1.21 0.01 0.00 0.82 0.00 0.00 66.70 66.55 1ik0 h VAL 18 Cb 0.12 0.86 -0.04 0.00 -1.52 0.00 0.00 31.29 30.71 1ik0 h VAL 18 CO -0.03 0.44 0.55 0.78 0.02 0.00 0.00 177.57 179.33 1ik0 h ASN 19 N 0.96 0.95 1.75 0.57 -0.26 -0.89 -1.23 115.58 117.43 1ik0 h ASN 19 Ca 0.16 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 55.88 1ik0 h ASN 19 Cb 0.62 -0.24 0.00 0.00 -1.06 0.00 0.00 38.32 37.64 1ik0 h ASN 19 CO 0.04 0.69 -0.05 0.16 -1.06 0.00 0.00 177.43 177.20 1ik0 h ILE 20 N 1.12 0.00 0.00 2.81 3.07 -1.36 -3.34 117.51 119.80 1ik0 h ILE 20 Ca 0.31 -0.80 -0.02 0.00 1.55 0.00 0.00 64.86 65.89 1ik0 h ILE 20 Cb -0.12 1.77 -0.00 0.00 -0.27 0.00 0.00 36.82 38.19 1ik0 h ILE 20 CO -0.07 0.00 -1.98 0.35 -1.05 0.00 0.00 178.15 175.40 1ik0 n THR 21 N -2.76 0.08 0.02 0.16 -2.24 -1.02 -3.96 114.28 104.56 1ik0 n THR 21 Ca 0.04 -0.50 -0.15 0.00 -2.27 0.00 0.00 64.05 61.17 1ik0 n THR 21 Cb 0.49 -0.01 -0.05 0.00 -2.10 0.00 0.00 70.33 68.67 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 0.63 -0.27 -0.78 4.20 -1.36 -3.23 115.11 114.31 1ik0 h GLN 22 Ca -0.03 -0.56 0.00 0.00 0.06 0.00 0.00 58.65 58.12 1ik0 h GLN 22 Cb 1.04 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.95 1ik0 h GLN 22 CO 0.00 1.17 0.00 0.27 -0.67 0.00 0.00 178.83 179.61 1ik0 n ASN 23 N -3.87 2.54 -4.71 1.46 2.04 -1.26 -4.91 115.26 106.54 1ik0 n ASN 23 Ca -0.07 -1.86 -0.41 0.00 -0.44 0.00 0.00 54.58 51.80 1ik0 n ASN 23 Cb 0.77 -0.17 -0.04 0.00 -2.53 0.00 0.00 39.78 37.81 1ik0 n ASN 23 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ik0 s GLN 24 N -1.66 4.50 0.00 -3.83 -2.07 -1.22 -4.99 119.66 110.40 1ik0 s GLN 24 Ca 0.35 1.17 0.00 0.00 -1.82 0.00 0.00 55.36 55.06 1ik0 s GLN 24 Cb 0.20 -3.45 0.00 0.00 -1.09 0.00 0.00 33.01 28.66 1ik0 s GLN 24 CO 0.29 0.00 0.00 1.17 -1.32 0.00 0.00 175.29 175.43 1ik0 n LYS 25 N 3.84 0.00 -2.03 9.60 4.81 -1.26 -4.93 118.16 128.19 1ik0 n LYS 25 Ca 0.03 0.03 -0.30 0.00 -0.87 0.00 0.00 58.31 57.21 1ik0 n LYS 25 Cb 0.51 -0.40 0.03 0.00 0.02 0.00 0.00 35.03 35.19 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 -4.17 3.06 0.58 3.14 0.00 -1.26 -4.99 121.76 118.12 1ik0 s ALA 26 Ca 0.00 -0.35 -0.18 0.00 0.00 0.00 0.00 51.96 51.43 1ik0 s ALA 26 Cb 0.00 -2.93 -0.09 0.00 0.00 0.00 0.00 23.12 20.10 1ik0 s ALA 26 CO 0.00 -0.90 0.42 -2.30 0.00 0.00 0.00 175.76 172.98 1ik0 n PRO 27 N -2.81 0.41 0.04 0.00 -0.02 -1.26 -4.88 135.00 126.48 1ik0 n PRO 27 Ca 0.06 0.16 -0.12 0.00 -2.02 0.00 0.00 63.50 61.58 1ik0 n PRO 27 Cb 0.56 -1.62 -0.08 0.00 -0.02 0.00 0.00 33.50 32.35 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 0.12 -0.02-10.48 2.45 3.38 -1.96 -3.43 115.31 105.37 1ik0 h LEU 28 Ca -0.45 -0.11 -0.48 0.00 0.09 0.00 0.00 57.88 56.94 1ik0 h LEU 28 Cb 1.40 0.00 0.07 0.00 0.09 0.00 0.00 40.66 42.22 1ik0 h LEU 28 CO 0.45 0.09 0.27 0.00 0.09 0.00 0.00 178.44 179.35 1ik0 n ASN 30 N -2.81 2.84 -0.96 0.00 5.03 -1.26 -4.13 115.26 113.97 1ik0 n ASN 30 Ca 0.06 -2.05 -0.08 0.00 0.87 0.00 0.00 54.58 53.37 1ik0 n ASN 30 Cb 0.58 -0.75 -0.00 0.00 -1.02 0.00 0.00 39.78 38.59 1ik0 n ASN 30 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ik0 n GLY 31 N 3.25 0.04 3.77 7.41 0.00 -1.26 -4.97 105.19 113.42 1ik0 n GLY 31 Ca 0.25 -0.54 -0.40 0.00 0.00 0.00 0.00 46.02 45.33 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 -2.63 6.16 0.06 1.61 0.01 -1.26 -4.92 113.70 112.74 1ik0 s SER 32 Ca 0.00 2.81 0.04 0.00 1.31 0.00 0.00 55.95 60.11 1ik0 s SER 32 Cb 0.00 -2.65 -0.04 0.00 0.21 0.00 0.00 66.02 63.54 1ik0 s SER 32 CO 0.00 -0.97 0.00 -0.04 0.41 0.00 0.00 173.24 172.64 1ik0 s MET 33 N -2.29 2.65 0.16 12.44 -1.94 -1.26 -2.68 119.30 126.39 1ik0 s MET 33 Ca 0.58 -0.75 0.06 0.00 -1.71 0.00 0.00 55.69 53.86 1ik0 s MET 33 Cb -0.41 -2.60 -0.04 0.00 2.01 0.00 0.00 34.83 33.78 1ik0 s MET 33 CO 0.54 0.57 -0.12 0.14 -0.01 0.00 0.00 175.02 176.14 1ik0 s VAL 34 N -1.23 1.35 0.06 -6.03 -7.23 -0.01 -4.89 120.40 102.41 1ik0 s VAL 34 Ca 0.24 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 58.00 1ik0 s VAL 34 Cb -0.12 -1.91 -0.05 0.00 0.56 0.00 0.00 36.38 34.86 1ik0 s VAL 34 CO 0.16 -0.70 1.16 0.26 -0.31 0.00 0.00 175.10 175.67 1ik0 s TRP 35 N -3.20 3.48 0.61 2.82 0.52 -1.26 -0.15 118.94 121.75 1ik0 s TRP 35 Ca 0.18 1.37 -0.17 0.00 0.02 0.00 0.00 56.10 57.51 1ik0 s TRP 35 Cb 0.01 -3.37 -0.03 0.00 -1.15 0.00 0.00 33.47 28.94 1ik0 s TRP 35 CO 0.03 -1.06 1.11 -1.54 0.02 0.00 0.00 176.95 175.51 1ik0 s SER 36 N 1.01 5.43 0.15 2.95 1.04 -0.97 -4.86 113.70 118.45 1ik0 s SER 36 Ca 0.57 2.05 0.00 0.00 0.48 0.00 0.00 55.95 59.05 1ik0 s SER 36 Cb -0.28 -2.56 -0.04 0.00 0.10 0.00 0.00 66.02 63.23 1ik0 s SER 36 CO 0.29 -1.41 0.03 0.27 0.98 0.00 0.00 173.24 173.40 1ik0 s ILE 37 N -2.13 0.40 -0.28 -1.02 -4.36 -1.26 -4.85 121.20 107.69 1ik0 s ILE 37 Ca 0.69 -1.94 -0.23 0.00 -0.26 0.00 0.00 60.65 58.90 1ik0 s ILE 37 Cb -0.21 -2.08 -0.00 0.00 1.25 0.00 0.00 42.46 41.41 1ik0 s ILE 37 CO 0.35 -0.47 0.78 0.21 0.24 0.00 0.00 174.94 176.04 1ik0 s ASN 38 N -3.11 6.69 -0.25 4.36 3.04 -1.26 -5.00 114.94 119.41 1ik0 s ASN 38 Ca 0.24 0.77 -0.29 0.00 0.04 0.00 0.00 52.86 53.61 1ik0 s ASN 38 Cb 0.07 -2.40 0.01 0.00 -1.54 0.00 0.00 41.25 37.38 1ik0 s ASN 38 CO 0.03 -0.56 1.15 -0.76 -3.04 0.00 0.00 177.10 173.92 1ik0 s LEU 39 N 2.87 4.03 0.00 3.21 2.01 -1.26 -4.82 118.68 124.72 1ik0 s LEU 39 Ca 0.32 1.33 0.00 0.00 0.01 0.00 0.00 54.13 55.79 1ik0 s LEU 39 Cb -0.15 -3.54 0.00 0.00 0.01 0.00 0.00 46.19 42.51 1ik0 s LEU 39 CO 0.11 -0.82 0.00 0.35 1.01 0.00 0.00 176.35 177.00 1ik0 n THR 40 N 5.64 0.00 -0.01 5.49 -2.24 -1.26 -5.06 114.28 116.84 1ik0 n THR 40 Ca 0.13 0.00 -0.01 0.00 -2.27 0.00 0.00 64.05 61.90 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 1.59 -0.08 6.98 0.00 -1.26 -4.63 120.51 120.12 1ik0 n ALA 41 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1ik0 n ALA 41 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.48 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 2.48 1.08 0.27 0.00 0.00 -1.26 -4.20 105.19 103.57 1ik0 n GLY 42 Ca -0.02 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.94 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 2.69 0.90 -0.58 1.61 0.00 -1.90 0.12 114.93 117.78 1ik0 h MET 43 Ca 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 59.70 59.61 1ik0 h MET 43 Cb 0.34 -0.19 -0.03 0.00 0.00 0.00 0.00 31.60 31.72 1ik0 h MET 43 CO 0.00 0.65 0.35 1.88 0.00 0.00 0.00 176.91 179.79 1ik0 h TYR 44 N 0.90 0.76 0.34 -0.22 0.05 -1.93 0.97 116.97 117.84 1ik0 h TYR 44 Ca 0.24 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 59.00 1ik0 h TYR 44 Cb -0.01 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 37.48 1ik0 h TYR 44 CO -0.01 0.51 -0.16 0.00 -1.05 0.00 0.00 178.16 177.45 1ik0 h ALA 46 N -0.37 0.54 -0.79 0.00 0.00 -0.67 -2.32 119.26 115.65 1ik0 h ALA 46 Ca -0.05 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1ik0 h ALA 46 Cb 0.53 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 1ik0 h ALA 46 CO 0.08 0.01 0.50 0.00 0.00 0.00 0.00 179.25 179.84 1ik0 h ALA 47 N 1.13 1.39 0.04 0.00 0.00 0.97 -2.84 119.26 119.96 1ik0 h ALA 47 Ca 0.15 -0.07 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 1ik0 h ALA 47 Cb -0.03 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1ik0 h ALA 47 CO -0.03 0.54 -0.02 1.25 0.00 0.00 0.00 179.25 180.99 1ik0 h LEU 48 N 1.08 -0.05 -1.01 0.00 5.85 -0.64 -2.43 115.31 118.11 1ik0 h LEU 48 Ca 0.29 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.02 1ik0 h LEU 48 Cb -0.09 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 40.91 1ik0 h LEU 48 CO -0.06 -0.03 0.66 1.05 -0.34 0.00 0.00 178.44 179.72 1ik0 h GLU 49 N -0.06 1.32 -0.99 1.25 4.11 -1.28 -1.37 114.58 117.56 1ik0 h GLU 49 Ca -0.01 -0.08 0.01 0.00 0.07 0.00 0.00 59.36 59.35 1ik0 h GLU 49 Cb 0.05 -0.30 -0.05 0.00 0.50 0.00 0.00 28.75 28.95 1ik0 h GLU 49 CO 0.01 0.88 0.64 0.77 0.07 0.00 0.00 179.01 181.38 1ik0 h SER 50 N 1.36 1.15 0.33 3.06 0.02 -1.29 -1.88 113.55 116.31 1ik0 h SER 50 Ca 0.37 -0.04 -0.12 0.00 -0.84 0.00 0.00 61.79 61.16 1ik0 h SER 50 Cb -0.16 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.08 1ik0 h SER 50 CO -0.08 0.85 -0.48 -0.07 -1.14 0.00 0.00 176.83 175.91 1ik0 h LEU 51 N 1.35 0.19 -1.90 5.07 3.38 -0.87 -2.49 115.31 120.05 1ik0 h LEU 51 Ca 0.36 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 58.24 1ik0 h LEU 51 Cb -0.13 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.56 1ik0 h LEU 51 CO -0.08 0.64 0.07 0.40 0.09 0.00 0.00 178.44 179.57 1ik0 h ILE 52 N 0.14 0.00 0.00 1.22 1.08 -0.42 0.45 117.51 119.98 1ik0 h ILE 52 Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.48 1ik0 h ILE 52 Cb 0.90 0.63 0.00 0.00 -3.07 0.00 0.00 36.82 35.28 1ik0 h ILE 52 CO 0.07 0.00 -0.18 0.59 -0.69 0.00 0.00 178.15 177.94 1ik0 n ASN 53 N -2.54 0.74 -4.66 1.72 4.13 -0.94 -4.73 115.26 108.98 1ik0 n ASN 53 Ca -0.02 0.44 -0.40 0.00 1.68 0.00 0.00 54.58 56.28 1ik0 n ASN 53 Cb 0.11 -0.51 -0.06 0.00 -1.54 0.00 0.00 39.78 37.78 1ik0 n ASN 53 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1ik0 s VAL 54 N -3.11 5.06 0.09 2.41 1.01 0.16 -5.05 120.40 120.97 1ik0 s VAL 54 Ca 0.10 1.10 0.07 0.00 0.00 0.00 0.00 61.98 63.24 1ik0 s VAL 54 Cb 0.13 -3.90 -0.03 0.00 0.00 0.00 0.00 36.38 32.57 1ik0 s VAL 54 CO 0.63 0.15 -0.18 -0.44 0.00 0.00 0.00 175.10 175.26 1ik0 s SER 55 N 1.15 2.14 0.00 3.32 0.01 -1.26 -4.77 113.70 114.29 1ik0 s SER 55 Ca 0.27 -0.67 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 0.10 -0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.35 1ik0 n GLY 56 N 1.13 0.72 2.55 3.44 0.00 -1.26 -4.98 105.19 106.79 1ik0 n GLY 56 Ca -0.20 -0.70 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 1ik0 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ik0 h SER 58 N 7.54 0.43 -0.23 0.00 0.87 -1.97 -2.99 113.55 117.20 1ik0 h SER 58 Ca -0.03 -0.20 0.07 0.00 -1.23 0.00 0.00 61.79 60.39 1ik0 h SER 58 Cb 1.00 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.83 1ik0 h SER 58 CO 0.31 0.83 0.46 0.00 -0.53 0.00 0.00 176.83 177.91 1ik0 h ALA 59 N 1.18 1.80 -0.00 6.23 0.00 -1.97 0.58 119.26 127.08 1ik0 h ALA 59 Ca 0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ik0 h ALA 59 Cb 0.94 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1ik0 h ALA 59 CO 0.08 -0.58 -0.59 0.44 0.00 0.00 0.00 179.25 178.60 1ik0 n ILE 60 N -3.25 0.00 -0.30 0.00 -5.35 -1.13 -4.45 119.36 104.88 1ik0 n ILE 60 Ca 0.03 -0.21 -0.04 0.00 -0.27 0.00 0.00 62.75 62.27 1ik0 n ILE 60 Cb 0.58 1.03 0.08 0.00 -1.74 0.00 0.00 39.64 39.59 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 0.32 1.06 -0.74 6.28 5.08 -0.86 0.70 114.58 126.42 1ik0 h GLU 61 Ca 0.00 -0.06 -0.06 0.00 -1.00 0.00 0.00 59.36 58.23 1ik0 h GLU 61 Cb 0.36 -0.24 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 1ik0 h GLU 61 CO 0.00 0.70 0.22 0.87 -1.00 0.00 0.00 179.01 179.80 1ik0 h LYS 62 N 1.09 1.16 -0.82 2.33 1.57 -1.78 -2.52 116.57 117.60 1ik0 h LYS 62 Ca 0.30 -0.26 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1ik0 h LYS 62 Cb -0.12 -0.16 -0.04 0.00 0.08 0.00 0.00 32.23 31.99 1ik0 h LYS 62 CO -0.07 1.00 0.54 1.15 -0.57 0.00 0.00 179.45 181.50 1ik0 h THR 63 N 1.11 1.21 -0.67 -0.16 2.02 -1.39 -2.26 112.91 112.78 1ik0 h THR 63 Ca 0.24 -0.39 0.01 0.00 0.77 0.00 0.00 66.41 67.03 1ik0 h THR 63 Cb 0.33 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.72 1ik0 h THR 63 CO -0.00 0.21 0.44 1.56 0.37 0.00 0.00 175.52 178.09 1ik0 h GLN 64 N 1.11 0.88 -0.30 6.66 4.20 -0.50 -0.64 115.11 126.52 1ik0 h GLN 64 Ca 0.30 -0.05 -0.01 0.00 0.06 0.00 0.00 58.65 58.94 1ik0 h GLN 64 Cb -0.12 -0.20 -0.01 0.00 0.30 0.00 0.00 27.48 27.45 1ik0 h GLN 64 CO -0.06 0.58 0.13 0.00 -0.67 0.00 0.00 178.83 178.81 1ik0 h ARG 65 N 0.91 0.44 -0.86 1.46 3.08 -1.18 -1.44 114.38 116.79 1ik0 h ARG 65 Ca 0.24 -0.07 -0.03 0.00 0.07 0.00 0.00 59.98 60.19 1ik0 h ARG 65 Cb -0.10 -0.08 -0.04 0.00 0.08 0.00 0.00 29.97 29.83 1ik0 h ARG 65 CO -0.05 0.43 0.41 0.52 -1.07 0.00 0.00 179.97 180.21 1ik0 h MET 66 N 0.34 1.23 -0.85 0.04 2.86 -1.10 -2.04 114.93 115.41 1ik0 h MET 66 Ca 0.10 -0.18 -0.03 0.00 -2.06 0.00 0.00 59.70 57.53 1ik0 h MET 66 Cb 0.15 -0.22 -0.04 0.00 0.06 0.00 0.00 31.60 31.54 1ik0 h MET 66 CO -0.01 0.95 0.42 -0.07 1.06 0.00 0.00 176.91 179.25 1ik0 h LEU 67 N 1.22 1.10 -1.01 1.22 3.38 -0.81 -1.95 115.31 118.45 1ik0 h LEU 67 Ca 0.29 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.14 1ik0 h LEU 67 Cb 0.12 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.54 1ik0 h LEU 67 CO -0.04 0.92 0.67 0.28 0.09 0.00 0.00 178.44 180.36 1ik0 h SER 68 N 1.20 1.16 -0.78 -0.43 0.02 -0.63 -0.54 113.55 113.55 1ik0 h SER 68 Ca 0.29 -0.03 0.23 0.00 -0.84 0.00 0.00 61.79 61.44 1ik0 h SER 68 Cb 0.10 -0.29 -0.03 0.00 0.14 0.00 0.00 62.40 62.32 1ik0 h SER 68 CO -0.04 0.84 0.67 1.23 -1.14 0.00 0.00 176.83 178.39 1ik0 h GLY 69 N 1.37 0.00 0.63 -3.77 0.00 -0.68 0.87 103.07 101.48 1ik0 h GLY 69 Ca 0.37 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1ik0 h GLY 69 CO -0.08 0.00 -1.10 0.69 0.00 0.00 0.00 176.54 176.05 1ik0 n PHE 70 N -3.92 0.38 -3.52 5.60 3.72 -0.25 -4.75 117.46 114.72 1ik0 n PHE 70 Ca 0.16 0.11 -0.27 0.00 -0.05 0.00 0.00 57.45 57.40 1ik0 n PHE 70 Cb 0.95 -0.54 -0.14 0.00 -0.94 0.00 0.00 39.48 38.80 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 5.26 0.00 -3.01 0.00 -0.02 -1.19 -4.53 135.00 131.51 1ik0 n PRO 72 Ca -0.05 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.00 1ik0 n PRO 72 Cb 0.43 -1.42 -0.06 0.00 -0.02 0.00 0.00 33.50 32.43 1ik0 n PRO 72 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1ik0 s HIS 73 N 1.68 2.99 -0.91 6.00 2.46 -1.26 -4.98 115.29 121.27 1ik0 s HIS 73 Ca 0.00 0.01 -0.24 0.00 0.47 0.00 0.00 55.06 55.29 1ik0 s HIS 73 Cb 0.00 -3.61 0.04 0.00 -0.13 0.00 0.00 32.58 28.89 1ik0 s HIS 73 CO 0.00 -1.00 1.38 0.15 -2.47 0.00 0.00 174.74 172.80 1ik0 s LYS 74 N 3.17 3.44 -0.15 2.88 1.02 -1.26 -4.97 119.74 123.87 1ik0 s LYS 74 Ca 0.26 -0.80 -0.16 0.00 0.02 0.00 0.00 55.97 55.30 1ik0 s LYS 74 Cb -0.13 -4.90 -0.04 0.00 -0.52 0.00 0.00 37.83 32.23 1ik0 s LYS 74 CO 0.20 -2.18 0.38 0.08 -0.92 0.00 0.00 175.35 172.91 1ik0 s VAL 75 N 5.22 5.25 0.07 3.17 1.01 -1.26 -5.05 120.40 128.81 1ik0 s VAL 75 Ca 0.42 0.73 0.02 0.00 0.00 0.00 0.00 61.98 63.14 1ik0 s VAL 75 Cb -0.03 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 1ik0 s VAL 75 CO -0.01 0.34 0.11 -0.55 0.00 0.00 0.00 175.10 174.99 1ik0 s SER 76 N 0.62 5.71 0.00 3.32 0.15 -1.26 -4.95 113.70 117.29 1ik0 s SER 76 Ca 0.20 0.06 0.00 0.00 0.70 0.00 0.00 55.95 56.92 1ik0 s SER 76 Cb -0.14 -1.59 0.00 0.00 -1.71 0.00 0.00 66.02 62.58 1ik0 s SER 76 CO 0.07 0.18 0.80 0.00 1.20 0.00 0.00 173.24 175.49 1ik0 n ALA 77 N 0.50 0.93 -0.05 5.45 0.00 -1.26 -0.19 120.51 125.90 1ik0 n ALA 77 Ca -0.08 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.36 1ik0 n ALA 77 Cb 0.52 -0.83 -0.14 0.00 0.00 0.00 0.00 19.45 19.00 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 -1.30 -0.83 3.66 0.00 0.00 -1.26 -4.91 105.19 100.55 1ik0 n GLY 78 Ca 0.00 -0.36 -0.38 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.84 4.15 0.06 1.61 -1.52 0.74 -5.07 119.66 116.78 1ik0 s GLN 79 Ca -0.07 0.19 0.05 0.00 -1.95 0.00 0.00 55.36 53.58 1ik0 s GLN 79 Cb 0.08 -3.56 -0.03 0.00 -0.22 0.00 0.00 33.01 29.29 1ik0 s GLN 79 CO 0.73 -0.09 -0.15 -0.06 -0.25 0.00 0.00 175.29 175.47 1ik0 s PHE 80 N 1.47 1.29 0.00 0.91 0.08 -1.26 -4.19 117.98 116.27 1ik0 s PHE 80 Ca 0.19 -0.40 0.00 0.00 0.12 0.00 0.00 56.93 56.84 1ik0 s PHE 80 Cb -0.15 -0.75 0.00 0.00 -0.57 0.00 0.00 43.02 41.56 1ik0 s PHE 80 CO 0.08 0.06 0.00 0.43 -0.10 0.00 0.00 175.22 175.69 1ik0 n SER 81 N 1.60 0.25 -0.66 1.36 7.64 -1.26 -4.82 113.62 117.73 1ik0 n SER 81 Ca -0.19 0.00 0.13 0.00 1.01 0.00 0.00 58.87 59.82 1ik0 n SER 81 Cb 0.54 0.00 0.37 0.00 -1.01 0.00 0.00 64.21 64.11 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 -2.90 2.06 -0.82 6.43 2.88 -1.26 -4.14 113.62 115.89 1ik0 n SER 82 Ca 0.00 -1.69 0.02 0.00 -1.33 0.00 0.00 58.87 55.87 1ik0 n SER 82 Cb 0.44 -0.01 0.12 0.00 -0.75 0.00 0.00 64.21 64.01 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 0.61 2.17 0.02 2.46 4.32 -1.26 -3.97 117.00 121.35 1ik0 n LEU 83 Ca 0.17 -1.09 -0.17 0.00 -0.02 0.00 0.00 56.01 54.90 1ik0 n LEU 83 Cb 0.44 -0.48 -0.07 0.00 -1.62 0.00 0.00 43.42 41.70 1ik0 n LEU 83 CO 0.16 0.35 0.20 0.45 -1.22 0.00 0.00 177.39 177.33 1ik0 h HIS 84 N 1.21 0.95 -4.14 -1.77 3.86 -1.94 -3.45 115.15 109.87 1ik0 h HIS 84 Ca 0.00 -0.46 -0.48 0.00 -1.16 0.00 0.00 60.37 58.26 1ik0 h HIS 84 Cb 0.81 -0.13 0.04 0.00 1.06 0.00 0.00 27.41 29.20 1ik0 h HIS 84 CO 0.29 1.29 0.38 0.08 0.86 0.00 0.00 177.93 180.83 1ik0 s VAL 85 N -3.53 3.84 -1.30 2.45 1.01 -1.25 -4.94 120.40 116.68 1ik0 s VAL 85 Ca -0.09 0.99 -0.10 0.00 0.00 0.00 0.00 61.98 62.79 1ik0 s VAL 85 Cb 0.08 -3.43 0.16 0.00 0.00 0.00 0.00 36.38 33.19 1ik0 s VAL 85 CO 0.90 -0.40 1.91 0.54 0.00 0.00 0.00 175.10 178.06 1ik0 n ARG 86 N -1.52 3.56 -2.09 2.72 1.74 -1.26 -4.98 116.66 114.83 1ik0 n ARG 86 Ca 0.09 -3.44 -0.27 0.00 -0.77 0.00 0.00 57.85 53.46 1ik0 n ARG 86 Cb 0.53 -2.96 0.07 0.00 -1.02 0.00 0.00 32.46 29.08 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 1.06 4.83 0.27 0.55 1.01 -1.26 -5.07 116.67 118.06 1ik0 s ASP 87 Ca 0.40 0.65 -0.02 0.00 0.71 0.00 0.00 52.55 54.29 1ik0 s ASP 87 Cb 0.10 -1.29 -0.04 0.00 1.01 0.00 0.00 42.92 42.70 1ik0 s ASP 87 CO -0.00 -1.63 0.50 0.42 0.21 0.00 0.00 175.17 174.66 1ik0 s THR 88 N -3.35 5.11 0.31 -1.27 -4.23 -1.26 -4.87 115.64 106.07 1ik0 s THR 88 Ca 0.60 -0.22 -0.10 0.00 -1.18 0.00 0.00 61.69 60.79 1ik0 s THR 88 Cb -0.11 -3.77 -0.07 0.00 1.34 0.00 0.00 72.50 69.89 1ik0 s THR 88 CO 0.47 -0.33 0.65 -0.54 -0.54 0.00 0.00 174.62 174.33 1ik0 s LYS 89 N -3.67 3.82 0.15 3.99 1.02 -1.26 -2.29 119.74 121.50 1ik0 s LYS 89 Ca 0.41 0.38 0.05 0.00 0.02 0.00 0.00 55.97 56.83 1ik0 s LYS 89 Cb -0.10 -2.53 -0.04 0.00 -0.52 0.00 0.00 37.83 34.63 1ik0 s LYS 89 CO 0.31 0.17 -0.10 0.96 -0.92 0.00 0.00 175.35 175.77 1ik0 s ILE 90 N -2.04 1.20 0.45 2.17 -4.36 0.79 -4.87 121.20 114.54 1ik0 s ILE 90 Ca 0.50 -2.07 -0.24 0.00 -0.26 0.00 0.00 60.65 58.57 1ik0 s ILE 90 Cb -0.11 -1.86 -0.07 0.00 1.25 0.00 0.00 42.46 41.67 1ik0 s ILE 90 CO 0.24 -0.74 1.26 -1.61 0.24 0.00 0.00 174.94 174.33 1ik0 s GLU 91 N -3.74 3.75 0.28 0.37 2.02 -1.26 -0.83 118.70 119.28 1ik0 s GLU 91 Ca 0.17 2.04 0.00 0.00 0.02 0.00 0.00 54.97 57.20 1ik0 s GLU 91 Cb 0.02 -2.55 0.50 0.00 0.10 0.00 0.00 34.13 32.21 1ik0 s GLU 91 CO 0.01 -0.64 1.85 0.28 0.02 0.00 0.00 175.26 176.78 1ik0 h VAL 92 N 2.08 0.98 -0.94 2.63 2.07 -1.86 -0.25 116.25 120.96 1ik0 h VAL 92 Ca -0.50 -0.36 0.15 0.00 0.82 0.00 0.00 66.70 66.80 1ik0 h VAL 92 Cb 1.26 -0.18 -0.09 0.00 -1.52 0.00 0.00 31.29 30.76 1ik0 h VAL 92 CO 0.61 0.19 0.55 0.00 0.02 0.00 0.00 177.57 178.94 1ik0 h ALA 93 N 1.51 1.45 -0.07 1.67 0.00 -1.90 0.77 119.26 122.69 1ik0 h ALA 93 Ca 0.48 0.06 -0.23 0.00 0.00 0.00 0.00 54.91 55.22 1ik0 h ALA 93 Cb 0.38 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.07 1ik0 h ALA 93 CO -0.23 0.04 -0.87 1.96 0.00 0.00 0.00 179.25 180.14 1ik0 h GLN 94 N 0.79 0.64 -0.16 0.00 4.20 -1.45 -2.83 115.11 116.31 1ik0 h GLN 94 Ca 0.50 -0.59 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1ik0 h GLN 94 Cb 0.64 0.15 -0.01 0.00 0.30 0.00 0.00 27.48 28.56 1ik0 h GLN 94 CO -0.33 1.21 0.11 0.35 -0.67 0.00 0.00 178.83 179.49 1ik0 h PHE 95 N 0.41 0.20 -0.13 2.96 3.04 -0.01 0.67 116.94 124.08 1ik0 h PHE 95 Ca -0.08 0.00 -0.00 0.00 3.98 0.00 0.00 57.97 61.88 1ik0 h PHE 95 Cb 1.50 -0.07 -0.01 0.00 2.56 0.00 0.00 35.95 39.94 1ik0 h PHE 95 CO 0.08 0.13 0.07 0.28 -2.02 0.00 0.00 178.31 176.84 1ik0 h VAL 96 N 0.22 1.10 -0.72 1.41 2.07 -0.96 -1.68 116.25 117.69 1ik0 h VAL 96 Ca 0.06 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 67.29 1ik0 h VAL 96 Cb -0.02 1.05 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1ik0 h VAL 96 CO -0.02 0.09 0.40 0.11 0.02 0.00 0.00 177.57 178.18 1ik0 h LYS 97 N 0.10 1.00 -0.88 1.57 1.57 -1.30 -0.68 116.57 117.94 1ik0 h LYS 97 Ca 0.04 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 58.72 1ik0 h LYS 97 Cb 0.08 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 1ik0 h LYS 97 CO -0.01 0.74 0.58 -0.44 -0.57 0.00 0.00 179.45 179.75 1ik0 h ASP 98 N 0.99 1.02 -0.76 0.86 3.32 -0.65 -1.69 116.42 119.52 1ik0 h ASP 98 Ca 0.25 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.22 1ik0 h ASP 98 Cb 0.02 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1ik0 h ASP 98 CO -0.04 0.75 0.26 0.25 -1.72 0.00 0.00 179.24 178.73 1ik0 h LEU 99 N 1.20 1.10 -0.67 1.55 5.85 -0.67 -2.95 115.31 120.72 1ik0 h LEU 99 Ca 0.32 -0.20 0.09 0.00 0.84 0.00 0.00 57.88 58.93 1ik0 h LEU 99 Cb -0.13 -0.29 -0.07 0.00 0.37 0.00 0.00 40.66 40.55 1ik0 h LEU 99 CO -0.07 1.00 0.31 0.25 -0.34 0.00 0.00 178.44 179.60 1ik0 h LEU 100 N 1.13 0.39 -0.48 2.25 5.85 -0.19 0.15 115.31 124.41 1ik0 h LEU 100 Ca 0.25 0.06 0.00 0.00 0.84 0.00 0.00 57.88 59.03 1ik0 h LEU 100 Cb 0.29 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1ik0 h LEU 100 CO -0.01 0.23 0.31 -0.07 -0.34 0.00 0.00 178.44 178.55 1ik0 h LEU 101 N 0.54 0.57 -0.52 2.25 -0.00 -1.33 -2.79 115.31 114.03 1ik0 h LEU 101 Ca 0.33 -0.04 -0.14 0.00 -0.00 0.00 0.00 57.88 58.03 1ik0 h LEU 101 Cb 0.35 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 40.86 1ik0 h LEU 101 CO -0.27 0.43 -0.30 0.45 -0.00 0.00 0.00 178.44 178.76 1ik0 h HIS 102 N 0.65 1.03 0.13 1.13 3.86 -1.37 -2.48 115.15 118.11 1ik0 h HIS 102 Ca 0.18 -0.27 0.01 0.00 -1.16 0.00 0.00 60.37 59.12 1ik0 h HIS 102 Cb -0.04 -0.23 -0.02 0.00 1.06 0.00 0.00 27.41 28.18 1ik0 h HIS 102 CO -0.04 1.07 -0.17 -0.07 0.86 0.00 0.00 177.93 179.58 1ik0 h LEU 103 N 0.75 -0.46 -1.52 2.43 3.38 -0.73 -1.30 115.31 117.85 1ik0 h LEU 103 Ca 0.08 0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ik0 h LEU 103 Cb 0.86 0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.78 1ik0 h LEU 103 CO 0.08 -0.25 -0.01 0.07 0.09 0.00 0.00 178.44 178.42 1ik0 h LYS 104 N -0.35 0.00 0.02 1.13 2.10 -1.56 -3.15 116.57 114.76 1ik0 h LYS 104 Ca 0.01 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.66 1ik0 h LYS 104 Cb 0.35 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.68 1ik0 h LYS 104 CO -0.07 0.01 -0.01 -0.22 -2.00 0.00 0.00 179.45 177.16 1ik0 h LYS 105 N 0.00 -0.02 0.00 0.07 3.64 -0.75 -2.64 116.57 116.86 1ik0 h LYS 105 Ca -0.00 0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 1ik0 h LYS 105 Cb 0.50 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.32 1ik0 h LYS 105 CO 0.00 0.19 -0.09 -0.07 -2.27 0.00 0.00 179.45 177.22 1ik0 h LEU 106 N -0.23 0.00 -1.01 5.20 -0.00 -1.43 -2.70 115.31 115.13 1ik0 h LEU 106 Ca -0.00 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.89 1ik0 h LEU 106 Cb 0.22 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.83 1ik0 h LEU 106 CO 0.00 0.09 0.67 0.15 -0.00 0.00 0.00 178.44 179.35 1ik0 h PHE 107 N 0.00 1.27 -0.91 1.13 3.57 -1.49 -0.86 116.94 119.65 1ik0 h PHE 107 Ca -0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.52 1ik0 h PHE 107 Cb 0.25 -0.43 -0.04 0.00 2.79 0.00 0.00 35.95 38.52 1ik0 h PHE 107 CO 0.00 0.80 0.55 0.00 -2.23 0.00 0.00 178.31 177.42 1ik0 h ARG 108 N 1.37 1.23 0.00 1.11 3.08 -1.50 -1.77 114.38 117.90 1ik0 h ARG 108 Ca 0.37 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.31 1ik0 h ARG 108 Cb -0.16 -0.26 0.00 0.00 0.08 0.00 0.00 29.97 29.63 1ik0 h ARG 108 CO -0.08 0.86 -0.21 0.39 -1.07 0.00 0.00 179.97 179.87 1ik0 n GLU 109 N -4.36 0.05 -0.92 0.04 1.02 -0.91 -4.89 120.64 110.68 1ik0 n GLU 109 Ca 0.10 0.03 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 1ik0 n GLU 109 Cb 0.06 -1.55 0.00 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 1.47 0.39 3.37 0.62 0.00 -0.38 -4.94 105.19 105.72 1ik0 n GLY 110 Ca 0.06 0.00 -0.45 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 -0.70 3.04 -0.26 1.61 0.52 -1.17 -5.00 118.95 116.99 1ik0 s ARG 111 Ca 0.00 -1.35 -0.16 0.00 -0.52 0.00 0.00 55.73 53.70 1ik0 s ARG 111 Cb 0.00 -4.25 -0.03 0.00 0.52 0.00 0.00 34.95 31.18 1ik0 s ARG 111 CO 0.00 -1.46 0.42 -0.06 0.02 0.00 0.00 175.30 174.22 1ik0 s PHE 112 N 2.46 3.27 -2.32 -0.53 0.08 -1.26 -4.75 117.98 114.93 1ik0 s PHE 112 Ca 0.10 0.50 0.29 0.00 0.12 0.00 0.00 56.93 57.95 1ik0 s PHE 112 Cb -0.25 -2.61 1.35 0.00 -0.57 0.00 0.00 43.02 40.94 1ik0 s PHE 112 CO 0.06 -0.22 1.92 0.09 -0.10 0.00 0.00 175.22 176.96