#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 1.61 0.24 3.17 0.00 -1.26 -4.93 107.32 106.16 1ik0 s GLY 2 Ca 0.00 -0.21 -0.29 0.00 0.00 0.00 0.00 44.72 44.22 1ik0 s GLY 2 CO 0.00 0.26 0.93 -1.05 0.00 0.00 0.00 173.10 173.24 1ik0 n PRO 3 N -3.66 0.98 -2.70 2.90 -0.02 -1.26 -4.94 135.00 126.30 1ik0 n PRO 3 Ca 0.07 0.34 -0.33 0.00 -2.02 0.00 0.00 63.50 61.57 1ik0 n PRO 3 Cb 0.56 -1.65 -0.06 0.00 -0.02 0.00 0.00 33.50 32.33 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 -0.86 4.48 1.01 -1.45 -7.23 -1.26 -5.03 120.40 110.05 1ik0 s VAL 4 Ca 0.63 1.31 -0.11 0.00 -1.81 0.00 0.00 61.98 62.00 1ik0 s VAL 4 Cb -0.79 -3.65 0.20 0.00 0.56 0.00 0.00 36.38 32.70 1ik0 s VAL 4 CO 0.58 -0.45 1.10 -2.16 -0.31 0.00 0.00 175.10 173.86 1ik0 s PRO 5 N -3.50 0.30 0.08 4.82 0.04 -1.26 -4.77 135.00 130.70 1ik0 s PRO 5 Ca 0.60 1.26 -0.23 0.00 0.04 0.00 0.00 61.00 62.67 1ik0 s PRO 5 Cb -0.09 -1.66 -0.14 0.00 0.04 0.00 0.00 34.50 32.64 1ik0 s PRO 5 CO 0.20 -3.03 1.66 -1.00 0.04 0.00 0.00 177.00 174.88 1ik0 h PRO 6 N -2.14 0.07 -0.96 0.56 0.13 -1.99 -2.13 132.00 125.53 1ik0 h PRO 6 Ca -0.50 -0.01 0.01 0.00 -0.87 0.00 0.00 66.00 64.62 1ik0 h PRO 6 Cb 1.29 -0.01 -0.05 0.00 0.13 0.00 0.00 31.00 32.36 1ik0 h PRO 6 CO 0.45 0.14 0.62 0.66 -0.23 0.00 0.00 178.00 179.64 1ik0 h SER 7 N -0.02 1.11 -0.40 1.44 4.64 -1.95 -1.89 113.55 116.48 1ik0 h SER 7 Ca 0.02 -0.04 -0.14 0.00 -0.47 0.00 0.00 61.79 61.15 1ik0 h SER 7 Cb 0.09 -0.28 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1ik0 h SER 7 CO -0.00 0.82 -0.31 0.74 -0.87 0.00 0.00 176.83 177.21 1ik0 h THR 8 N 1.30 1.27 -0.75 2.95 2.02 -1.90 -2.94 112.91 114.87 1ik0 h THR 8 Ca 0.35 -1.48 -0.06 0.00 0.77 0.00 0.00 66.41 65.99 1ik0 h THR 8 Cb -0.13 1.33 -0.03 0.00 -1.74 0.00 0.00 68.15 67.58 1ik0 h THR 8 CO -0.07 0.50 0.23 0.00 0.37 0.00 0.00 175.52 176.55 1ik0 h ALA 9 N 0.79 0.98 -0.14 6.16 0.00 -1.01 -2.04 119.26 124.00 1ik0 h ALA 9 Ca 0.07 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1ik0 h ALA 9 Cb 0.90 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1ik0 h ALA 9 CO 0.08 0.67 0.09 1.25 0.00 0.00 0.00 179.25 181.34 1ik0 h LEU 10 N 1.12 0.16 -0.99 0.00 5.85 -1.29 0.36 115.31 120.52 1ik0 h LEU 10 Ca 0.24 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.97 1ik0 h LEU 10 Cb 0.31 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 1ik0 h LEU 10 CO -0.01 0.12 0.66 0.03 -0.34 0.00 0.00 178.44 178.90 1ik0 h ARG 11 N 0.19 1.31 -0.62 1.25 3.08 -1.35 0.41 114.38 118.65 1ik0 h ARG 11 Ca 0.05 -0.08 -0.07 0.00 0.07 0.00 0.00 59.98 59.96 1ik0 h ARG 11 Cb -0.02 -0.29 -0.02 0.00 0.08 0.00 0.00 29.97 29.71 1ik0 h ARG 11 CO -0.01 0.86 0.12 0.93 -1.07 0.00 0.00 179.97 180.81 1ik0 h GLU 12 N 1.34 1.00 -0.16 0.04 4.39 -0.67 -1.75 114.58 118.77 1ik0 h GLU 12 Ca 0.36 -0.26 -0.12 0.00 0.34 0.00 0.00 59.36 59.69 1ik0 h GLU 12 Cb -0.16 -0.12 0.00 0.00 -0.10 0.00 0.00 28.75 28.37 1ik0 h GLU 12 CO -0.08 0.93 -0.36 1.25 -1.16 0.00 0.00 179.01 179.59 1ik0 h LEU 13 N 0.92 0.60 -0.00 1.33 5.85 0.63 -2.61 115.31 122.03 1ik0 h LEU 13 Ca 0.19 -0.56 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 1ik0 h LEU 13 Cb 0.39 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 41.25 1ik0 h LEU 13 CO 0.01 1.05 0.00 0.40 -0.34 0.00 0.00 178.44 179.56 1ik0 h ILE 14 N 0.18 1.08 -1.01 4.05 2.04 -0.13 -0.36 117.51 123.35 1ik0 h ILE 14 Ca 0.00 -0.22 0.01 0.00 1.00 0.00 0.00 64.86 65.65 1ik0 h ILE 14 Cb 0.96 1.22 -0.05 0.00 -0.74 0.00 0.00 36.82 38.22 1ik0 h ILE 14 CO 0.08 0.06 0.67 -0.33 0.00 0.00 0.00 178.15 178.62 1ik0 h GLU 15 N -0.09 1.33 -0.14 2.37 3.07 -1.39 0.42 114.58 120.15 1ik0 h GLU 15 Ca 0.00 -0.08 -0.06 0.00 -0.50 0.00 0.00 59.36 58.72 1ik0 h GLU 15 Cb 0.09 -0.30 -0.00 0.00 -0.84 0.00 0.00 28.75 27.70 1ik0 h GLU 15 CO -0.00 0.88 -0.14 1.49 -1.40 0.00 0.00 179.01 179.84 1ik0 h GLU 16 N 1.37 0.34 -0.74 2.33 4.81 -1.26 -1.39 114.58 120.03 1ik0 h GLU 16 Ca 0.37 -0.18 -0.05 0.00 -0.13 0.00 0.00 59.36 59.37 1ik0 h GLU 16 Cb -0.16 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1ik0 h GLU 16 CO -0.08 0.73 0.28 -0.07 -0.73 0.00 0.00 179.01 179.13 1ik0 h LEU 17 N -0.04 1.04 -0.39 1.64 3.38 -0.83 -2.55 115.31 117.55 1ik0 h LEU 17 Ca 0.02 -0.18 -0.05 0.00 0.09 0.00 0.00 57.88 57.75 1ik0 h LEU 17 Cb 0.66 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.13 1ik0 h LEU 17 CO 0.03 0.94 0.03 0.58 0.09 0.00 0.00 178.44 180.12 1ik0 h VAL 18 N 1.08 1.25 -0.66 1.22 2.07 -0.89 -2.35 116.25 117.97 1ik0 h VAL 18 Ca 0.24 -0.93 0.01 0.00 0.82 0.00 0.00 66.70 66.84 1ik0 h VAL 18 Cb 0.24 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.07 1ik0 h VAL 18 CO -0.02 0.32 0.44 -1.13 0.02 0.00 0.00 177.57 177.20 1ik0 h ASN 19 N 0.51 0.76 1.72 0.57 -0.73 -1.05 0.07 115.58 117.43 1ik0 h ASN 19 Ca 0.12 -0.02 -0.00 0.00 1.87 0.00 0.00 56.30 58.26 1ik0 h ASN 19 Cb 0.42 -0.19 -0.00 0.00 0.27 0.00 0.00 38.32 38.82 1ik0 h ASN 19 CO 0.01 0.55 -0.02 0.16 -0.37 0.00 0.00 177.43 177.76 1ik0 h ILE 20 N 0.90 0.04 0.00 2.57 3.07 -1.40 -3.17 117.51 119.52 1ik0 h ILE 20 Ca 0.24 -0.93 -0.21 0.00 1.55 0.00 0.00 64.86 65.52 1ik0 h ILE 20 Cb -0.10 1.89 -0.04 0.00 -0.27 0.00 0.00 36.82 38.30 1ik0 h ILE 20 CO -0.05 0.02 -1.96 0.35 -1.05 0.00 0.00 178.15 175.46 1ik0 n THR 21 N -3.11 0.98 0.09 0.16 -2.24 -0.89 -3.67 114.28 105.61 1ik0 n THR 21 Ca 0.03 -0.71 -0.08 0.00 -2.27 0.00 0.00 64.05 61.02 1ik0 n THR 21 Cb 0.48 -0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 68.24 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 0.14 -0.56 -0.78 1.08 -1.07 -3.23 115.11 110.70 1ik0 h GLN 22 Ca -0.28 -0.16 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 1ik0 h GLN 22 Cb 1.72 0.05 0.00 0.00 -0.05 0.00 0.00 27.48 29.20 1ik0 h GLN 22 CO 0.03 0.94 0.00 0.09 -0.95 0.00 0.00 178.83 178.94 1ik0 n ASN 23 N -3.60 5.31 -4.72 1.46 3.02 -1.20 -4.96 115.26 110.57 1ik0 n ASN 23 Ca -0.03 -2.82 -0.41 0.00 -0.03 0.00 0.00 54.58 51.29 1ik0 n ASN 23 Cb 0.83 -0.64 -0.04 0.00 -0.61 0.00 0.00 39.78 39.31 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 -2.55 4.53 0.00 3.52 -2.07 -1.22 -5.00 119.66 116.87 1ik0 s GLN 24 Ca 0.52 1.19 0.00 0.00 -1.82 0.00 0.00 55.36 55.26 1ik0 s GLN 24 Cb 0.39 -3.42 0.00 0.00 -1.09 0.00 0.00 33.01 28.89 1ik0 s GLN 24 CO 0.17 0.10 0.00 1.17 -1.32 0.00 0.00 175.29 175.41 1ik0 n LYS 25 N 3.43 0.00 -1.89 9.60 4.81 -1.26 -4.94 118.16 127.91 1ik0 n LYS 25 Ca 0.01 0.01 -0.31 0.00 -0.87 0.00 0.00 58.31 57.16 1ik0 n LYS 25 Cb 0.51 -0.33 0.02 0.00 0.02 0.00 0.00 35.03 35.24 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 -4.32 3.07 0.92 3.14 0.00 -1.26 -5.00 121.76 118.30 1ik0 s ALA 26 Ca 0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 51.96 51.67 1ik0 s ALA 26 Cb 0.00 -3.06 -0.01 0.00 0.00 0.00 0.00 23.12 20.05 1ik0 s ALA 26 CO 0.00 -0.77 0.19 -2.30 0.00 0.00 0.00 175.76 172.88 1ik0 n PRO 27 N -2.79 -0.14 0.18 0.00 -0.02 -1.26 -4.83 135.00 126.14 1ik0 n PRO 27 Ca 0.06 -0.01 0.14 0.00 -2.02 0.00 0.00 63.50 61.67 1ik0 n PRO 27 Cb 0.55 -1.68 0.56 0.00 -0.02 0.00 0.00 33.50 32.90 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 -1.25 0.00 -8.23 2.45 3.38 -1.98 -3.45 115.31 106.23 1ik0 h LEU 28 Ca -0.44 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.41 1ik0 h LEU 28 Cb 1.30 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 41.92 1ik0 h LEU 28 CO 0.33 0.00 -0.38 0.00 0.09 0.00 0.00 178.44 178.49 1ik0 n ASN 30 N -0.23 1.68 -0.34 0.00 6.94 -1.26 -4.17 115.26 117.88 1ik0 n ASN 30 Ca -0.05 -1.73 -0.02 0.00 -0.02 0.00 0.00 54.58 52.77 1ik0 n ASN 30 Cb 0.63 -0.43 0.00 0.00 -2.36 0.00 0.00 39.78 37.62 1ik0 n ASN 30 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1ik0 n GLY 31 N 2.60 0.39 3.78 4.83 0.00 -1.26 -4.98 105.19 110.54 1ik0 n GLY 31 Ca 0.10 -0.76 -0.41 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.93 6.34 0.01 1.61 0.01 -1.26 -4.92 113.70 112.56 1ik0 s SER 32 Ca 0.01 3.05 0.02 0.00 1.31 0.00 0.00 55.95 60.34 1ik0 s SER 32 Cb -0.00 -2.67 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 1ik0 s SER 32 CO 0.01 -0.88 -0.01 -0.04 0.41 0.00 0.00 173.24 172.73 1ik0 s MET 33 N -1.98 2.72 0.15 12.44 -1.94 -1.26 -2.59 119.30 126.84 1ik0 s MET 33 Ca 0.54 -0.65 0.05 0.00 -1.71 0.00 0.00 55.69 53.91 1ik0 s MET 33 Cb -0.47 -2.62 -0.04 0.00 2.01 0.00 0.00 34.83 33.71 1ik0 s MET 33 CO 0.62 0.61 -0.10 0.14 -0.01 0.00 0.00 175.02 176.28 1ik0 s VAL 34 N -1.08 1.20 0.10 -6.03 -7.23 -0.00 -4.90 120.40 102.46 1ik0 s VAL 34 Ca 0.19 -2.07 -0.30 0.00 -1.81 0.00 0.00 61.98 57.99 1ik0 s VAL 34 Cb -0.11 -1.86 -0.06 0.00 0.56 0.00 0.00 36.38 34.91 1ik0 s VAL 34 CO 0.10 -0.74 1.12 0.26 -0.31 0.00 0.00 175.10 175.53 1ik0 s TRP 35 N -3.31 3.55 0.66 2.82 0.52 -1.26 -0.19 118.94 121.73 1ik0 s TRP 35 Ca 0.17 1.50 -0.15 0.00 0.02 0.00 0.00 56.10 57.65 1ik0 s TRP 35 Cb 0.02 -3.30 0.00 0.00 -1.15 0.00 0.00 33.47 29.05 1ik0 s TRP 35 CO 0.01 -0.75 1.11 -1.54 0.02 0.00 0.00 176.95 175.80 1ik0 s SER 36 N 0.54 5.10 0.18 2.95 1.04 -1.15 -4.87 113.70 117.49 1ik0 s SER 36 Ca 0.53 1.98 0.01 0.00 0.48 0.00 0.00 55.95 58.96 1ik0 s SER 36 Cb -0.28 -2.55 -0.05 0.00 0.10 0.00 0.00 66.02 63.25 1ik0 s SER 36 CO 0.31 -1.63 0.03 0.27 0.98 0.00 0.00 173.24 173.20 1ik0 s ILE 37 N -2.38 0.52 -0.27 -1.02 -4.36 -1.26 -4.93 121.20 107.50 1ik0 s ILE 37 Ca 0.66 -1.97 -0.24 0.00 -0.26 0.00 0.00 60.65 58.85 1ik0 s ILE 37 Cb -0.20 -2.19 -0.00 0.00 1.25 0.00 0.00 42.46 41.31 1ik0 s ILE 37 CO 0.42 -0.39 0.79 0.54 0.24 0.00 0.00 174.94 176.55 1ik0 s ASN 38 N -3.17 6.73 -0.47 4.36 4.22 -1.26 -5.00 114.94 120.36 1ik0 s ASN 38 Ca 0.27 0.84 -0.29 0.00 -2.14 0.00 0.00 52.86 51.54 1ik0 s ASN 38 Cb 0.07 -2.41 0.03 0.00 1.28 0.00 0.00 41.25 40.21 1ik0 s ASN 38 CO 0.05 -0.55 1.18 -0.76 -2.04 0.00 0.00 177.10 174.98 1ik0 s LEU 39 N 2.87 3.63 0.00 3.54 2.01 -1.26 -4.81 118.68 124.66 1ik0 s LEU 39 Ca 0.33 0.53 0.00 0.00 0.01 0.00 0.00 54.13 55.00 1ik0 s LEU 39 Cb -0.15 -3.55 0.00 0.00 0.01 0.00 0.00 46.19 42.50 1ik0 s LEU 39 CO 0.10 -1.27 0.00 0.35 1.01 0.00 0.00 176.35 176.54 1ik0 n THR 40 N 6.86 0.00 -0.01 5.49 -2.24 -1.26 -5.06 114.28 118.05 1ik0 n THR 40 Ca 0.13 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.88 1ik0 n THR 40 Cb 0.49 0.00 -0.01 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 1.78 -0.20 6.98 0.00 -1.26 -4.61 120.51 120.20 1ik0 n ALA 41 Ca 0.00 -0.27 -0.00 0.00 0.00 0.00 0.00 53.44 53.16 1ik0 n ALA 41 Cb 0.00 0.08 -0.00 0.00 0.00 0.00 0.00 19.45 19.53 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 2.52 1.29 0.33 0.00 0.00 -1.26 -4.20 105.19 103.87 1ik0 n GLY 42 Ca -0.04 -0.02 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 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 2.94 1.15 -0.17 1.61 0.00 -1.88 -0.02 114.93 118.57 1ik0 h MET 43 Ca 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 59.70 59.56 1ik0 h MET 43 Cb 0.39 -0.22 -0.01 0.00 0.00 0.00 0.00 31.60 31.76 1ik0 h MET 43 CO 0.02 0.87 0.11 1.88 0.00 0.00 0.00 176.91 179.78 1ik0 h TYR 44 N 1.14 0.21 -0.06 -0.22 -1.99 -1.92 0.30 116.97 114.44 1ik0 h TYR 44 Ca 0.29 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 61.00 1ik0 h TYR 44 Cb 0.06 -0.07 -0.00 0.00 2.00 0.00 0.00 36.73 38.72 1ik0 h TYR 44 CO 0.01 0.14 -0.03 0.00 -0.00 0.00 0.00 178.16 178.28 1ik0 h ALA 46 N 0.60 0.95 -0.59 0.00 0.00 -0.92 -2.13 119.26 117.16 1ik0 h ALA 46 Ca 0.01 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 1ik0 h ALA 46 Cb 0.48 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1ik0 h ALA 46 CO 0.01 0.37 -0.01 0.00 0.00 0.00 0.00 179.25 179.62 1ik0 h ALA 47 N 1.27 0.86 0.00 0.00 0.00 -0.36 -2.86 119.26 118.18 1ik0 h ALA 47 Ca 0.27 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1ik0 h ALA 47 Cb -0.12 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.45 1ik0 h ALA 47 CO -0.06 0.66 -0.00 1.25 0.00 0.00 0.00 179.25 181.10 1ik0 h LEU 48 N 0.95 -0.01 -1.00 0.00 5.85 -0.43 -0.11 115.31 120.57 1ik0 h LEU 48 Ca 0.17 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.93 1ik0 h LEU 48 Cb 0.56 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.53 1ik0 h LEU 48 CO 0.03 -0.00 0.66 1.05 -0.34 0.00 0.00 178.44 179.83 1ik0 h GLU 49 N -0.01 1.22 -0.60 1.25 4.11 -1.38 0.27 114.58 119.44 1ik0 h GLU 49 Ca -0.00 -0.07 -0.06 0.00 0.07 0.00 0.00 59.36 59.30 1ik0 h GLU 49 Cb 0.01 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 28.96 1ik0 h GLU 49 CO 0.00 0.81 0.16 0.77 0.07 0.00 0.00 179.01 180.82 1ik0 h SER 50 N 1.26 0.90 0.47 3.06 0.02 -1.21 -2.55 113.55 115.50 1ik0 h SER 50 Ca 0.40 -0.23 -0.11 0.00 -0.84 0.00 0.00 61.79 61.02 1ik0 h SER 50 Cb 0.02 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 1ik0 h SER 50 CO -0.13 0.89 -0.50 -0.07 -1.14 0.00 0.00 176.83 175.88 1ik0 h LEU 51 N 0.86 0.04 -1.98 5.07 3.38 -0.01 -2.73 115.31 119.93 1ik0 h LEU 51 Ca 0.19 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1ik0 h LEU 51 Cb 0.33 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1ik0 h LEU 51 CO -0.00 0.53 0.18 0.40 0.09 0.00 0.00 178.44 179.64 1ik0 h ILE 52 N 0.03 0.00 0.00 1.22 1.08 -0.07 0.76 117.51 120.53 1ik0 h ILE 52 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1ik0 h ILE 52 Cb 0.89 0.66 0.00 0.00 -3.07 0.00 0.00 36.82 35.30 1ik0 h ILE 52 CO 0.07 0.00 -0.31 0.59 -0.69 0.00 0.00 178.15 177.80 1ik0 n ASN 53 N -2.68 0.38 -4.62 1.72 5.03 -1.03 -4.75 115.26 109.30 1ik0 n ASN 53 Ca -0.02 0.11 -0.40 0.00 0.87 0.00 0.00 54.58 55.14 1ik0 n ASN 53 Cb 0.22 -0.09 -0.07 0.00 -1.02 0.00 0.00 39.78 38.83 1ik0 n ASN 53 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1ik0 s VAL 54 N -3.03 5.01 0.05 2.41 1.01 0.27 -5.05 120.40 121.06 1ik0 s VAL 54 Ca 0.11 1.05 0.05 0.00 0.00 0.00 0.00 61.98 63.20 1ik0 s VAL 54 Cb 0.17 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.63 1ik0 s VAL 54 CO 0.64 0.05 -0.15 -0.44 0.00 0.00 0.00 175.10 175.19 1ik0 s SER 55 N 1.49 1.79 0.00 3.32 0.01 -1.26 -4.74 113.70 114.31 1ik0 s SER 55 Ca 0.25 -0.50 0.00 0.00 1.31 0.00 0.00 55.95 57.01 1ik0 s SER 55 Cb -0.16 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 65.97 1ik0 s SER 55 CO 0.09 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.38 1ik0 n GLY 56 N 1.75 1.23 3.39 3.44 0.00 -1.26 -4.99 105.19 108.75 1ik0 n GLY 56 Ca -0.18 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.38 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 8.11 0.05 0.00 0.00 0.87 -1.94 -2.90 113.55 117.75 1ik0 h SER 58 Ca 0.15 -0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.68 1ik0 h SER 58 Cb 1.01 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.96 1ik0 h SER 58 CO 0.94 0.54 0.38 0.00 -0.53 0.00 0.00 176.83 178.16 1ik0 n ALA 59 N -2.45 0.48 -0.35 6.23 0.00 -1.26 -0.23 120.51 122.93 1ik0 n ALA 59 Ca -0.02 0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1ik0 n ALA 59 Cb 0.52 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.37 1ik0 n ALA 59 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1ik0 n ILE 60 N -1.90 0.50 -0.35 0.00 -5.35 -1.10 -4.75 119.36 106.41 1ik0 n ILE 60 Ca -0.01 -0.57 -0.03 0.00 -0.27 0.00 0.00 62.75 61.88 1ik0 n ILE 60 Cb 0.40 0.83 0.10 0.00 -1.74 0.00 0.00 39.64 39.23 1ik0 n ILE 60 CO 0.00 0.00 0.00 1.05 -1.76 0.00 0.00 176.55 175.84 1ik0 h GLU 61 N 0.00 1.24 -0.87 6.28 4.11 -0.63 -0.97 114.58 123.73 1ik0 h GLU 61 Ca 0.00 -0.07 -0.03 0.00 0.07 0.00 0.00 59.36 59.33 1ik0 h GLU 61 Cb 0.56 -0.28 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1ik0 h GLU 61 CO 0.00 0.82 0.43 0.87 0.07 0.00 0.00 179.01 181.19 1ik0 h LYS 62 N 1.28 1.24 -0.96 1.06 1.57 -1.86 -2.15 116.57 116.74 1ik0 h LYS 62 Ca 0.34 -0.18 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 1ik0 h LYS 62 Cb -0.15 -0.23 -0.05 0.00 0.08 0.00 0.00 32.23 31.89 1ik0 h LYS 62 CO -0.07 0.94 0.60 1.15 -0.57 0.00 0.00 179.45 181.50 1ik0 h THR 63 N 1.23 1.26 -0.18 -0.16 2.02 -1.53 -1.93 112.91 113.62 1ik0 h THR 63 Ca 0.30 -0.54 0.00 0.00 0.77 0.00 0.00 66.41 66.94 1ik0 h THR 63 Cb 0.10 -0.12 -0.01 0.00 -1.74 0.00 0.00 68.15 66.39 1ik0 h THR 63 CO -0.04 0.27 0.12 1.56 0.37 0.00 0.00 175.52 177.80 1ik0 h GLN 64 N 1.32 0.24 -0.58 6.66 4.20 -0.63 0.21 115.11 126.54 1ik0 h GLN 64 Ca 0.35 -0.01 -0.11 0.00 0.06 0.00 0.00 58.65 58.93 1ik0 h GLN 64 Cb -0.08 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.63 1ik0 h GLN 64 CO -0.07 0.16 -0.06 0.07 -0.67 0.00 0.00 178.83 178.25 1ik0 h ARG 65 N 0.24 1.06 -0.81 1.46 0.11 -1.33 -2.44 114.38 112.67 1ik0 h ARG 65 Ca 0.07 -0.37 -0.04 0.00 0.10 0.00 0.00 59.98 59.73 1ik0 h ARG 65 Cb -0.03 -0.08 -0.04 0.00 1.11 0.00 0.00 29.97 30.94 1ik0 h ARG 65 CO -0.01 1.07 0.34 0.52 0.10 0.00 0.00 179.97 181.99 1ik0 h MET 66 N 0.95 1.20 -0.94 0.08 2.86 -1.06 -2.23 114.93 115.80 1ik0 h MET 66 Ca 0.16 -0.21 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 1ik0 h MET 66 Cb 0.64 -0.20 -0.05 0.00 0.06 0.00 0.00 31.60 32.05 1ik0 h MET 66 CO 0.04 0.96 0.55 -0.07 1.06 0.00 0.00 176.91 179.46 1ik0 h LEU 67 N 1.18 1.14 -1.41 1.22 3.38 -0.73 -1.56 115.31 118.52 1ik0 h LEU 67 Ca 0.27 -0.08 0.09 0.00 0.09 0.00 0.00 57.88 58.25 1ik0 h LEU 67 Cb 0.20 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.61 1ik0 h LEU 67 CO -0.03 0.88 0.48 0.28 0.09 0.00 0.00 178.44 180.15 1ik0 h SER 68 N 1.30 0.60 -1.05 -0.43 0.02 -0.93 0.86 113.55 113.93 1ik0 h SER 68 Ca 0.34 0.01 0.30 0.00 -0.84 0.00 0.00 61.79 61.60 1ik0 h SER 68 Cb -0.04 -0.12 -0.04 0.00 0.14 0.00 0.00 62.40 62.35 1ik0 h SER 68 CO -0.06 0.37 0.75 1.23 -1.14 0.00 0.00 176.83 177.98 1ik0 h GLY 69 N 0.67 0.00 -0.32 -3.77 0.00 -1.05 1.60 103.07 100.20 1ik0 h GLY 69 Ca 0.33 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1ik0 h GLY 69 CO -0.12 -0.00 -0.55 0.69 0.00 0.00 0.00 176.54 176.56 1ik0 n PHE 70 N -4.22 0.00 -3.50 5.60 3.72 0.26 -4.58 117.46 114.74 1ik0 n PHE 70 Ca 0.22 0.00 -0.27 0.00 -0.05 0.00 0.00 57.45 57.35 1ik0 n PHE 70 Cb 1.11 -0.05 -0.10 0.00 -0.94 0.00 0.00 39.48 39.50 1ik0 n PHE 70 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ik0 h PRO 72 N 5.32 0.00 -5.23 0.00 0.11 -1.76 -3.39 132.00 127.06 1ik0 h PRO 72 Ca 0.22 0.00 -0.66 0.00 0.11 0.00 0.00 66.00 65.66 1ik0 h PRO 72 Cb 0.86 0.00 -0.16 0.00 0.11 0.00 0.00 31.00 31.81 1ik0 h PRO 72 CO 0.49 0.00 -0.01 -3.38 -0.21 0.00 0.00 178.00 174.89 1ik0 s HIS 73 N -3.86 3.13 0.25 0.65 -3.43 -1.26 -5.04 115.29 105.73 1ik0 s HIS 73 Ca -0.03 -0.06 -0.30 0.00 -0.80 0.00 0.00 55.06 53.88 1ik0 s HIS 73 Cb 0.07 -3.11 -0.09 0.00 -1.43 0.00 0.00 32.58 28.02 1ik0 s HIS 73 CO 0.21 -0.73 1.04 0.15 -2.00 0.00 0.00 174.74 173.41 1ik0 s LYS 74 N 2.52 4.72 -0.12 -0.38 1.02 -1.26 -5.04 119.74 121.21 1ik0 s LYS 74 Ca 0.19 1.67 -0.05 0.00 0.02 0.00 0.00 55.97 57.80 1ik0 s LYS 74 Cb -0.15 -3.24 -0.04 0.00 -0.52 0.00 0.00 37.83 33.89 1ik0 s LYS 74 CO 0.16 0.32 0.07 0.08 -0.92 0.00 0.00 175.35 175.05 1ik0 s VAL 75 N -1.06 4.89 0.33 3.17 1.01 -1.26 -5.10 120.40 122.37 1ik0 s VAL 75 Ca 0.44 -0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.38 1ik0 s VAL 75 Cb -0.29 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.93 1ik0 s VAL 75 CO 0.37 0.59 0.56 -0.44 0.00 0.00 0.00 175.10 176.17 1ik0 s SER 76 N -0.74 6.35 0.00 3.32 0.01 -1.26 -4.93 113.70 116.44 1ik0 s SER 76 Ca 0.12 0.57 0.04 0.00 1.31 0.00 0.00 55.95 57.99 1ik0 s SER 76 Cb -0.12 -2.08 0.17 0.00 0.21 0.00 0.00 66.02 64.20 1ik0 s SER 76 CO 0.03 -0.27 0.96 0.00 0.41 0.00 0.00 173.24 174.37 1ik0 n ALA 77 N -1.46 1.33 -0.12 1.44 0.00 -1.26 -1.78 120.51 118.66 1ik0 n ALA 77 Ca -0.03 -0.02 -0.14 0.00 0.00 0.00 0.00 53.44 53.25 1ik0 n ALA 77 Cb 0.55 -1.06 -0.13 0.00 0.00 0.00 0.00 19.45 18.81 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 -1.01 -0.59 3.64 0.00 0.00 -1.26 -4.88 105.19 101.08 1ik0 n GLY 78 Ca 0.02 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 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 -2.49 4.17 0.00 1.61 -1.52 -0.74 -5.05 119.66 115.64 1ik0 s GLN 79 Ca -0.25 0.64 0.08 0.00 -1.95 0.00 0.00 55.36 53.89 1ik0 s GLN 79 Cb 0.08 -3.62 -0.02 0.00 -0.22 0.00 0.00 33.01 29.23 1ik0 s GLN 79 CO 0.67 -0.35 -0.26 -0.06 -0.25 0.00 0.00 175.29 175.04 1ik0 s PHE 80 N 2.30 2.32 0.00 0.91 0.08 -1.26 -4.17 117.98 118.16 1ik0 s PHE 80 Ca 0.29 -0.43 0.00 0.00 0.12 0.00 0.00 56.93 56.91 1ik0 s PHE 80 Cb -0.16 -1.46 0.00 0.00 -0.57 0.00 0.00 43.02 40.83 1ik0 s PHE 80 CO 0.09 0.01 0.00 0.43 -0.10 0.00 0.00 175.22 175.66 1ik0 n SER 81 N 2.23 3.90 -0.22 1.36 7.64 -1.26 -4.81 113.62 122.46 1ik0 n SER 81 Ca -0.16 0.00 0.10 0.00 1.01 0.00 0.00 58.87 59.82 1ik0 n SER 81 Cb 0.51 0.04 -0.07 0.00 -1.01 0.00 0.00 64.21 63.68 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 -2.42 1.45 -1.25 6.43 2.88 -1.26 -4.39 113.62 115.06 1ik0 n SER 82 Ca 0.00 -1.22 -0.05 0.00 -1.33 0.00 0.00 58.87 56.27 1ik0 n SER 82 Cb 0.48 0.76 0.06 0.00 -0.75 0.00 0.00 64.21 64.77 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 -0.83 3.70 0.04 2.46 4.32 -1.26 -4.12 117.00 121.30 1ik0 n LEU 83 Ca 0.06 -1.90 -0.16 0.00 -0.02 0.00 0.00 56.01 53.99 1ik0 n LEU 83 Cb 0.39 -0.59 -0.05 0.00 -1.62 0.00 0.00 43.42 41.55 1ik0 n LEU 83 CO 0.36 0.59 0.20 0.45 -1.22 0.00 0.00 177.39 177.77 1ik0 h HIS 84 N 0.46 0.83 -4.08 -1.77 3.86 -1.93 -3.45 115.15 109.06 1ik0 h HIS 84 Ca 0.14 -0.42 -0.46 0.00 -1.16 0.00 0.00 60.37 58.48 1ik0 h HIS 84 Cb 1.40 -0.11 0.00 0.00 1.06 0.00 0.00 27.41 29.77 1ik0 h HIS 84 CO 0.42 1.23 0.36 0.08 0.86 0.00 0.00 177.93 180.89 1ik0 s VAL 85 N -3.45 4.15 -1.27 2.45 1.01 -1.26 -4.95 120.40 117.08 1ik0 s VAL 85 Ca -0.08 1.30 -0.09 0.00 0.00 0.00 0.00 61.98 63.11 1ik0 s VAL 85 Cb 0.08 -3.54 0.18 0.00 0.00 0.00 0.00 36.38 33.10 1ik0 s VAL 85 CO 0.89 -0.33 1.86 0.54 0.00 0.00 0.00 175.10 178.06 1ik0 n ARG 86 N -0.90 3.67 -2.10 2.72 1.74 -1.26 -4.98 116.66 115.56 1ik0 n ARG 86 Ca 0.08 -3.58 -0.27 0.00 -0.77 0.00 0.00 57.85 53.30 1ik0 n ARG 86 Cb 0.53 -2.90 0.10 0.00 -1.02 0.00 0.00 32.46 29.17 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 0.70 4.38 0.25 0.55 1.01 -1.26 -5.07 116.67 117.23 1ik0 s ASP 87 Ca 0.39 0.44 -0.05 0.00 0.71 0.00 0.00 52.55 54.04 1ik0 s ASP 87 Cb 0.09 -0.92 -0.06 0.00 1.01 0.00 0.00 42.92 43.05 1ik0 s ASP 87 CO 0.01 -1.91 0.51 -0.89 0.21 0.00 0.00 175.17 173.10 1ik0 s THR 88 N -3.45 5.05 0.34 -1.27 2.01 -1.26 -4.88 115.64 112.17 1ik0 s THR 88 Ca 0.64 0.09 -0.15 0.00 0.31 0.00 0.00 61.69 62.57 1ik0 s THR 88 Cb -0.09 -3.69 -0.09 0.00 0.01 0.00 0.00 72.50 68.63 1ik0 s THR 88 CO 0.47 -0.20 0.76 -0.54 -0.69 0.00 0.00 174.62 174.42 1ik0 s LYS 89 N -3.25 4.02 0.15 4.92 1.02 -1.26 -2.96 119.74 122.38 1ik0 s LYS 89 Ca 0.44 0.71 0.05 0.00 0.02 0.00 0.00 55.97 57.18 1ik0 s LYS 89 Cb -0.11 -2.40 -0.04 0.00 -0.52 0.00 0.00 37.83 34.76 1ik0 s LYS 89 CO 0.27 0.13 -0.10 0.96 -0.92 0.00 0.00 175.35 175.69 1ik0 s ILE 90 N -2.02 1.20 0.54 2.17 -4.36 0.73 -4.86 121.20 114.60 1ik0 s ILE 90 Ca 0.55 -2.07 -0.21 0.00 -0.26 0.00 0.00 60.65 58.66 1ik0 s ILE 90 Cb -0.10 -1.86 -0.05 0.00 1.25 0.00 0.00 42.46 41.70 1ik0 s ILE 90 CO 0.17 -0.74 1.26 -1.61 0.24 0.00 0.00 174.94 174.27 1ik0 s GLU 91 N -3.74 3.25 0.24 0.37 2.02 -1.26 -0.82 118.70 118.76 1ik0 s GLU 91 Ca 0.17 2.00 -0.07 0.00 0.02 0.00 0.00 54.97 57.09 1ik0 s GLU 91 Cb 0.02 -2.20 0.25 0.00 0.10 0.00 0.00 34.13 32.30 1ik0 s GLU 91 CO 0.01 -1.03 1.92 0.28 0.02 0.00 0.00 175.26 176.46 1ik0 h VAL 92 N 1.39 1.25 -0.77 2.63 2.07 -1.85 -2.10 116.25 118.87 1ik0 h VAL 92 Ca -0.50 -0.45 0.15 0.00 0.82 0.00 0.00 66.70 66.71 1ik0 h VAL 92 Cb 1.29 -0.18 -0.10 0.00 -1.52 0.00 0.00 31.29 30.77 1ik0 h VAL 92 CO 0.57 0.24 0.29 0.00 0.02 0.00 0.00 177.57 178.70 1ik0 h ALA 93 N 1.36 1.08 0.00 1.67 0.00 -1.91 0.76 119.26 122.23 1ik0 h ALA 93 Ca 0.36 0.13 -0.18 0.00 0.00 0.00 0.00 54.91 55.21 1ik0 h ALA 93 Cb -0.15 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1ik0 h ALA 93 CO -0.08 -0.23 -0.84 1.96 0.00 0.00 0.00 179.25 180.06 1ik0 h GLN 94 N 0.42 0.10 0.00 0.00 1.08 -1.84 -2.89 115.11 111.99 1ik0 h GLN 94 Ca 0.43 -0.11 -0.00 0.00 -1.45 0.00 0.00 58.65 57.52 1ik0 h GLN 94 Cb 0.67 0.03 0.00 0.00 -0.05 0.00 0.00 27.48 28.13 1ik0 h GLN 94 CO -0.43 0.88 -0.00 0.35 -0.95 0.00 0.00 178.83 178.68 1ik0 h PHE 95 N 0.05 -0.00 -0.53 2.96 3.04 -0.24 0.11 116.94 122.32 1ik0 h PHE 95 Ca -0.03 -0.00 -0.04 0.00 3.98 0.00 0.00 57.97 61.89 1ik0 h PHE 95 Cb 1.47 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.96 1ik0 h PHE 95 CO 0.01 -0.00 0.19 0.28 -2.02 0.00 0.00 178.31 176.77 1ik0 h VAL 96 N -0.00 1.23 -0.27 1.41 2.07 -1.20 -1.74 116.25 117.74 1ik0 h VAL 96 Ca -0.00 -0.73 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 1ik0 h VAL 96 Cb 0.00 0.71 -0.01 0.00 -1.52 0.00 0.00 31.29 30.47 1ik0 h VAL 96 CO 0.00 0.27 0.14 0.11 0.02 0.00 0.00 177.57 178.12 1ik0 h LYS 97 N 0.72 0.38 -0.99 1.57 1.57 -1.27 0.41 116.57 118.96 1ik0 h LYS 97 Ca 0.17 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1ik0 h LYS 97 Cb 0.24 -0.07 -0.05 0.00 0.08 0.00 0.00 32.23 32.43 1ik0 h LYS 97 CO -0.01 0.35 0.66 -0.44 -0.57 0.00 0.00 179.45 179.43 1ik0 h ASP 98 N 0.31 1.14 -0.58 0.86 3.32 -0.83 -1.54 116.42 119.11 1ik0 h ASP 98 Ca 0.09 -0.03 -0.06 0.00 0.02 0.00 0.00 57.03 57.05 1ik0 h ASP 98 Cb 0.08 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 39.32 1ik0 h ASP 98 CO -0.01 0.83 0.13 0.25 -1.72 0.00 0.00 179.24 178.72 1ik0 h LEU 99 N 1.35 0.92 -0.75 1.55 5.85 -0.83 -2.87 115.31 120.52 1ik0 h LEU 99 Ca 0.36 -0.19 0.08 0.00 0.84 0.00 0.00 57.88 58.97 1ik0 h LEU 99 Cb -0.15 -0.24 -0.06 0.00 0.37 0.00 0.00 40.66 40.57 1ik0 h LEU 99 CO -0.08 0.90 0.42 0.25 -0.34 0.00 0.00 178.44 179.59 1ik0 h LEU 100 N 0.92 0.61 -0.43 2.25 5.85 0.12 -0.20 115.31 124.43 1ik0 h LEU 100 Ca 0.19 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.96 1ik0 h LEU 100 Cb 0.36 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.29 1ik0 h LEU 100 CO 0.00 0.37 0.28 -0.07 -0.34 0.00 0.00 178.44 178.69 1ik0 h LEU 101 N 0.74 0.49 -0.42 2.25 -0.00 -1.28 -2.81 115.31 114.29 1ik0 h LEU 101 Ca 0.35 -0.01 -0.15 0.00 -0.00 0.00 0.00 57.88 58.06 1ik0 h LEU 101 Cb 0.27 -0.12 -0.01 0.00 -0.00 0.00 0.00 40.66 40.80 1ik0 h LEU 101 CO -0.22 0.36 -0.34 0.45 -0.00 0.00 0.00 178.44 178.69 1ik0 h HIS 102 N 0.58 1.14 0.19 1.13 3.86 -1.40 -2.57 115.15 118.09 1ik0 h HIS 102 Ca 0.16 -0.32 0.01 0.00 -1.16 0.00 0.00 60.37 59.05 1ik0 h HIS 102 Cb -0.07 -0.25 -0.03 0.00 1.06 0.00 0.00 27.41 28.13 1ik0 h HIS 102 CO -0.05 1.16 -0.30 -0.07 0.86 0.00 0.00 177.93 179.53 1ik0 h LEU 103 N 0.80 -0.85 -1.84 2.43 3.38 -0.81 -1.11 115.31 117.32 1ik0 h LEU 103 Ca 0.08 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.13 1ik0 h LEU 103 Cb 0.93 0.31 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 1ik0 h LEU 103 CO 0.09 -0.41 -0.00 0.07 0.09 0.00 0.00 178.44 178.28 1ik0 h LYS 104 N -0.57 0.00 -0.39 1.13 2.10 -1.57 -3.00 116.57 114.27 1ik0 h LYS 104 Ca 0.01 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.56 1ik0 h LYS 104 Cb 0.56 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.88 1ik0 h LYS 104 CO -0.13 0.00 -0.16 -0.22 -2.00 0.00 0.00 179.45 176.95 1ik0 h LYS 105 N 0.00 0.79 0.00 0.07 3.64 -0.78 -2.76 116.57 117.53 1ik0 h LYS 105 Ca -0.00 -0.33 -0.03 0.00 -1.27 0.00 0.00 60.65 59.02 1ik0 h LYS 105 Cb 0.39 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.17 1ik0 h LYS 105 CO 0.00 0.95 -0.14 -0.07 -2.27 0.00 0.00 179.45 177.92 1ik0 h LEU 106 N 0.60 0.00 -1.10 5.20 -0.00 -1.31 -2.42 115.31 116.28 1ik0 h LEU 106 Ca 0.09 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.98 1ik0 h LEU 106 Cb 0.70 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 41.31 1ik0 h LEU 106 CO 0.05 0.14 0.60 0.15 -0.00 0.00 0.00 178.44 179.38 1ik0 h PHE 107 N 0.00 1.15 -1.01 1.13 3.57 -1.55 0.72 116.94 120.95 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 0.29 -0.39 -0.05 0.00 2.79 0.00 0.00 35.95 38.59 1ik0 h PHE 107 CO 0.00 0.73 0.67 0.00 -2.23 0.00 0.00 178.31 177.48 1ik0 h ARG 108 N 1.24 1.33 0.00 1.11 2.47 -1.48 -1.97 114.38 117.08 1ik0 h ARG 108 Ca 0.33 -0.08 0.00 0.00 -1.26 0.00 0.00 59.98 58.97 1ik0 h ARG 108 Cb -0.14 -0.30 0.00 0.00 -1.65 0.00 0.00 29.97 27.88 1ik0 h ARG 108 CO -0.07 0.88 -0.49 0.39 0.56 0.00 0.00 179.97 181.23 1ik0 n GLU 109 N -4.38 0.17 -0.92 0.04 -0.58 -0.87 -4.91 120.64 109.20 1ik0 n GLU 109 Ca 0.12 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.92 1ik0 n GLU 109 Cb 0.01 -1.62 0.00 0.00 -0.57 0.00 0.00 31.44 29.26 1ik0 n GLU 109 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ik0 n GLY 110 N 1.40 0.37 3.43 0.62 0.00 0.19 -4.93 105.19 106.26 1ik0 n GLY 110 Ca 0.04 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 -0.76 3.11 -0.26 1.61 0.52 -1.18 -5.00 118.95 116.99 1ik0 s ARG 111 Ca 0.00 -0.99 -0.17 0.00 -0.52 0.00 0.00 55.73 54.05 1ik0 s ARG 111 Cb 0.00 -4.19 -0.03 0.00 0.52 0.00 0.00 34.95 31.25 1ik0 s ARG 111 CO 0.00 -1.51 0.49 -0.06 0.02 0.00 0.00 175.30 174.23 1ik0 s PHE 112 N 3.11 3.26 0.00 -0.53 0.08 -1.26 -4.78 117.98 117.87 1ik0 s PHE 112 Ca 0.17 0.59 0.00 0.00 0.12 0.00 0.00 56.93 57.81 1ik0 s PHE 112 Cb -0.20 -2.69 0.00 0.00 -0.57 0.00 0.00 43.02 39.56 1ik0 s PHE 112 CO 0.10 -0.27 0.00 0.09 -0.10 0.00 0.00 175.22 175.04