#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 1.00 3.03 0.00 -1.26 -4.97 107.32 106.71 1ik0 s GLY 2 Ca 0.00 -0.42 -0.19 0.00 0.00 0.00 0.00 44.72 44.11 1ik0 s GLY 2 CO 0.00 0.12 -0.73 -1.05 0.00 0.00 0.00 173.10 171.43 1ik0 n PRO 3 N -3.77 -0.16 -2.73 2.90 -0.02 -1.26 -4.86 135.00 125.10 1ik0 n PRO 3 Ca 0.06 -0.04 -0.42 0.00 -2.02 0.00 0.00 63.50 61.09 1ik0 n PRO 3 Cb 0.58 -1.18 -0.03 0.00 -0.02 0.00 0.00 33.50 32.85 1ik0 n PRO 3 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1ik0 s VAL 4 N -2.08 4.87 1.04 -1.45 1.01 -1.26 -5.02 120.40 117.51 1ik0 s VAL 4 Ca 0.43 2.01 -0.13 0.00 0.00 0.00 0.00 61.98 64.29 1ik0 s VAL 4 Cb -0.12 -4.30 0.15 0.00 0.00 0.00 0.00 36.38 32.12 1ik0 s VAL 4 CO 0.76 0.15 0.69 -2.65 0.00 0.00 0.00 175.10 174.05 1ik0 n PRO 5 N 4.02 -1.24 0.15 2.72 -0.02 -1.26 -4.73 135.00 134.64 1ik0 n PRO 5 Ca 0.06 -0.32 -0.13 0.00 -2.02 0.00 0.00 63.50 61.09 1ik0 n PRO 5 Cb 0.51 -2.05 -0.08 0.00 -0.02 0.00 0.00 33.50 31.86 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 -2.08 -0.39 -0.99 0.52 0.13 -1.99 -1.12 132.00 126.08 1ik0 h PRO 6 Ca -0.51 0.03 0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1ik0 h PRO 6 Cb 1.31 0.09 -0.05 0.00 0.13 0.00 0.00 31.00 32.48 1ik0 h PRO 6 CO 0.41 -0.06 0.65 0.66 -0.23 0.00 0.00 178.00 179.43 1ik0 h SER 7 N -0.75 1.15 -0.47 1.44 4.64 -1.97 -1.37 113.55 116.22 1ik0 h SER 7 Ca -0.04 -0.03 -0.12 0.00 -0.47 0.00 0.00 61.79 61.12 1ik0 h SER 7 Cb 0.50 -0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 1ik0 h SER 7 CO 0.07 0.84 -0.18 0.74 -0.87 0.00 0.00 176.83 177.42 1ik0 h THR 8 N 1.35 1.27 -0.81 2.95 2.02 -1.92 -2.44 112.91 115.33 1ik0 h THR 8 Ca 0.36 -1.33 -0.02 0.00 0.77 0.00 0.00 66.41 66.19 1ik0 h THR 8 Cb -0.15 1.14 -0.04 0.00 -1.74 0.00 0.00 68.15 67.37 1ik0 h THR 8 CO -0.08 0.46 0.42 0.00 0.37 0.00 0.00 175.52 176.69 1ik0 h ALA 9 N 0.86 1.04 -0.02 6.16 0.00 -0.66 -0.65 119.26 125.99 1ik0 h ALA 9 Ca 0.11 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ik0 h ALA 9 Cb 0.75 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1ik0 h ALA 9 CO 0.06 0.57 0.01 1.25 0.00 0.00 0.00 179.25 181.15 1ik0 h LEU 10 N 1.13 0.02 -0.71 0.00 5.85 -1.08 0.11 115.31 120.64 1ik0 h LEU 10 Ca 0.28 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 59.00 1ik0 h LEU 10 Cb 0.07 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 1ik0 h LEU 10 CO -0.04 0.03 0.47 0.03 -0.34 0.00 0.00 178.44 178.59 1ik0 h ARG 11 N 0.02 0.94 -0.96 1.25 3.08 -1.08 0.57 114.38 118.20 1ik0 h ARG 11 Ca 0.01 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1ik0 h ARG 11 Cb 0.01 -0.21 -0.05 0.00 0.08 0.00 0.00 29.97 29.80 1ik0 h ARG 11 CO -0.00 0.62 0.62 0.93 -1.07 0.00 0.00 179.97 181.07 1ik0 h GLU 12 N 0.97 1.27 -0.12 0.04 4.39 -0.72 0.56 114.58 120.98 1ik0 h GLU 12 Ca 0.26 -0.09 -0.07 0.00 0.34 0.00 0.00 59.36 59.80 1ik0 h GLU 12 Cb -0.11 -0.28 -0.00 0.00 -0.10 0.00 0.00 28.75 28.26 1ik0 h GLU 12 CO -0.06 0.86 -0.19 1.25 -1.16 0.00 0.00 179.01 179.71 1ik0 h LEU 13 N 1.30 0.37 -0.02 1.33 5.85 0.43 -2.46 115.31 122.12 1ik0 h LEU 13 Ca 0.35 -0.54 0.00 0.00 0.84 0.00 0.00 57.88 58.53 1ik0 h LEU 13 Cb -0.12 -0.11 -0.00 0.00 0.37 0.00 0.00 40.66 40.80 1ik0 h LEU 13 CO -0.07 0.84 0.01 0.40 -0.34 0.00 0.00 178.44 179.28 1ik0 h ILE 14 N -0.08 1.01 -0.86 4.05 2.04 0.48 -0.94 117.51 123.21 1ik0 h ILE 14 Ca 0.01 -0.03 0.01 0.00 1.00 0.00 0.00 64.86 65.84 1ik0 h ILE 14 Cb 0.77 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.81 1ik0 h ILE 14 CO 0.04 0.01 0.56 -0.33 0.00 0.00 0.00 178.15 178.44 1ik0 h GLU 15 N 0.01 1.14 -0.25 2.37 4.39 -0.95 -1.96 114.58 119.32 1ik0 h GLU 15 Ca 0.01 -0.07 -0.14 0.00 0.34 0.00 0.00 59.36 59.49 1ik0 h GLU 15 Cb 0.01 -0.25 -0.00 0.00 -0.10 0.00 0.00 28.75 28.40 1ik0 h GLU 15 CO -0.00 0.76 -0.39 1.49 -1.16 0.00 0.00 179.01 179.71 1ik0 h GLU 16 N 1.17 0.71 -0.73 2.33 4.81 -1.25 -2.00 114.58 119.63 1ik0 h GLU 16 Ca 0.31 -0.43 0.00 0.00 -0.13 0.00 0.00 59.36 59.12 1ik0 h GLU 16 Cb -0.12 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.26 1ik0 h GLU 16 CO -0.07 1.05 0.46 -0.07 -0.73 0.00 0.00 179.01 179.66 1ik0 h LEU 17 N 0.44 0.86 -0.46 1.64 3.38 -0.97 -2.38 115.31 117.82 1ik0 h LEU 17 Ca 0.02 -0.04 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 1ik0 h LEU 17 Cb 0.99 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 1ik0 h LEU 17 CO 0.09 0.65 -0.13 0.58 0.09 0.00 0.00 178.44 179.71 1ik0 h VAL 18 N 1.00 1.27 -1.00 1.22 2.07 -1.33 -2.92 116.25 116.56 1ik0 h VAL 18 Ca 0.27 -1.26 0.01 0.00 0.82 0.00 0.00 66.70 66.53 1ik0 h VAL 18 Cb -0.08 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 30.77 1ik0 h VAL 18 CO -0.05 0.43 0.66 -1.13 0.02 0.00 0.00 177.57 177.50 1ik0 h ASN 19 N 0.74 1.15 1.68 0.57 -1.24 -0.99 -0.39 115.58 117.11 1ik0 h ASN 19 Ca 0.11 -0.03 0.00 0.00 0.71 0.00 0.00 56.30 57.09 1ik0 h ASN 19 Cb 0.69 -0.29 0.00 0.00 0.73 0.00 0.00 38.32 39.45 1ik0 h ASN 19 CO 0.05 0.84 0.00 0.16 -1.29 0.00 0.00 177.43 177.19 1ik0 h ILE 20 N 1.36 0.00 0.00 2.57 3.07 -1.38 -3.22 117.51 119.91 1ik0 h ILE 20 Ca 0.37 -0.82 -0.08 0.00 1.55 0.00 0.00 64.86 65.87 1ik0 h ILE 20 Cb -0.15 1.82 -0.02 0.00 -0.27 0.00 0.00 36.82 38.20 1ik0 h ILE 20 CO -0.08 0.00 -1.88 0.35 -1.05 0.00 0.00 178.15 175.49 1ik0 n THR 21 N -3.03 0.45 0.06 0.16 -2.24 -0.93 -3.82 114.28 104.93 1ik0 n THR 21 Ca 0.03 -0.59 -0.21 0.00 -2.27 0.00 0.00 64.05 61.01 1ik0 n THR 21 Cb 0.46 -0.20 -0.12 0.00 -2.10 0.00 0.00 70.33 68.37 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 0.65 -0.59 -0.78 1.08 -1.14 -3.24 115.11 111.09 1ik0 h GLN 22 Ca -0.12 -0.77 0.00 0.00 -1.45 0.00 0.00 58.65 56.32 1ik0 h GLN 22 Cb 1.28 0.23 0.00 0.00 -0.05 0.00 0.00 27.48 28.95 1ik0 h GLN 22 CO 0.01 1.34 0.00 0.09 -0.95 0.00 0.00 178.83 179.32 1ik0 n ASN 23 N -3.86 3.31 -4.72 1.46 3.02 -1.22 -4.90 115.26 108.35 1ik0 n ASN 23 Ca -0.12 -2.23 -0.41 0.00 -0.03 0.00 0.00 54.58 51.79 1ik0 n ASN 23 Cb 0.91 -0.45 -0.04 0.00 -0.61 0.00 0.00 39.78 39.59 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 -1.64 4.50 0.00 3.52 -2.07 -1.23 -4.99 119.66 117.76 1ik0 s GLN 24 Ca 0.36 1.13 0.00 0.00 -1.82 0.00 0.00 55.36 55.03 1ik0 s GLN 24 Cb 0.22 -3.44 0.00 0.00 -1.09 0.00 0.00 33.01 28.70 1ik0 s GLN 24 CO 0.19 0.06 0.00 1.17 -1.32 0.00 0.00 175.29 175.39 1ik0 n LYS 25 N 3.65 0.00 -2.36 9.60 4.81 -1.26 -4.95 118.16 127.64 1ik0 n LYS 25 Ca 0.01 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.17 1ik0 n LYS 25 Cb 0.51 -0.27 0.00 0.00 0.02 0.00 0.00 35.03 35.29 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 -4.44 3.29 0.26 3.14 0.00 -1.26 -4.98 121.76 117.77 1ik0 s ALA 26 Ca 0.00 -0.37 -0.28 0.00 0.00 0.00 0.00 51.96 51.31 1ik0 s ALA 26 Cb 0.00 -2.76 -0.15 0.00 0.00 0.00 0.00 23.12 20.21 1ik0 s ALA 26 CO 0.00 -0.49 0.86 -2.30 0.00 0.00 0.00 175.76 173.82 1ik0 n PRO 27 N -2.45 0.93 0.05 0.00 -0.02 -1.26 -4.86 135.00 127.39 1ik0 n PRO 27 Ca 0.03 0.33 -0.12 0.00 -2.02 0.00 0.00 63.50 61.71 1ik0 n PRO 27 Cb 0.55 -1.58 -0.07 0.00 -0.02 0.00 0.00 33.50 32.37 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 1.67 -0.02-10.47 2.45 3.38 -1.97 -3.43 115.31 106.92 1ik0 h LEU 28 Ca -0.36 -0.04 -0.47 0.00 0.09 0.00 0.00 57.88 57.10 1ik0 h LEU 28 Cb 1.37 0.01 0.06 0.00 0.09 0.00 0.00 40.66 42.19 1ik0 h LEU 28 CO 0.59 0.02 0.20 0.00 0.09 0.00 0.00 178.44 179.34 1ik0 n ASN 30 N -2.69 2.21 0.00 0.00 3.02 -1.26 -4.32 115.26 112.22 1ik0 n ASN 30 Ca 0.06 -1.57 0.00 0.00 -0.03 0.00 0.00 54.58 53.03 1ik0 n ASN 30 Cb 0.58 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.29 1ik0 n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ik0 n GLY 31 N 1.77 0.41 3.76 7.41 0.00 -1.26 -5.01 105.19 112.27 1ik0 n GLY 31 Ca 0.00 -0.96 -0.38 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.97 5.88 0.21 1.61 0.01 -1.26 -4.91 113.70 112.27 1ik0 s SER 32 Ca 0.00 2.62 0.09 0.00 1.31 0.00 0.00 55.95 59.97 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 -1.14 -0.03 -0.04 0.41 0.00 0.00 173.24 172.44 1ik0 s MET 33 N -2.61 2.25 0.17 12.44 -1.94 -1.26 -2.70 119.30 125.65 1ik0 s MET 33 Ca 0.64 -1.28 0.06 0.00 -1.71 0.00 0.00 55.69 53.40 1ik0 s MET 33 Cb -0.37 -2.22 -0.05 0.00 2.01 0.00 0.00 34.83 34.21 1ik0 s MET 33 CO 0.45 0.41 -0.11 0.14 -0.01 0.00 0.00 175.02 175.90 1ik0 s VAL 34 N -1.95 1.35 0.18 -6.03 -7.23 0.10 -4.87 120.40 101.95 1ik0 s VAL 34 Ca 0.28 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 58.04 1ik0 s VAL 34 Cb -0.08 -1.92 -0.08 0.00 0.56 0.00 0.00 36.38 34.86 1ik0 s VAL 34 CO 0.18 -0.69 1.24 0.26 -0.31 0.00 0.00 175.10 175.78 1ik0 s TRP 35 N -3.21 3.36 0.49 2.82 0.52 -1.26 -0.10 118.94 121.55 1ik0 s TRP 35 Ca 0.19 1.33 -0.21 0.00 0.02 0.00 0.00 56.10 57.42 1ik0 s TRP 35 Cb 0.02 -3.50 -0.07 0.00 -1.15 0.00 0.00 33.47 28.77 1ik0 s TRP 35 CO 0.03 -1.49 1.14 0.45 0.02 0.00 0.00 176.95 177.10 1ik0 s SER 36 N 0.28 6.00 0.17 2.95 0.15 -1.06 -4.85 113.70 117.34 1ik0 s SER 36 Ca 0.55 2.23 0.05 0.00 0.70 0.00 0.00 55.95 59.48 1ik0 s SER 36 Cb -0.34 -2.59 -0.05 0.00 -1.71 0.00 0.00 66.02 61.33 1ik0 s SER 36 CO 0.37 -1.03 -0.10 0.27 1.20 0.00 0.00 173.24 173.95 1ik0 s ILE 37 N -1.66 1.30 -0.26 6.45 -4.36 -1.26 -4.88 121.20 116.53 1ik0 s ILE 37 Ca 0.67 -2.10 -0.25 0.00 -0.26 0.00 0.00 60.65 58.72 1ik0 s ILE 37 Cb -0.26 -1.96 -0.00 0.00 1.25 0.00 0.00 42.46 41.49 1ik0 s ILE 37 CO 0.31 -0.66 0.86 0.54 0.24 0.00 0.00 174.94 176.23 1ik0 s ASN 38 N -3.22 6.84 -0.48 4.36 4.22 -1.26 -4.99 114.94 120.40 1ik0 s ASN 38 Ca 0.20 1.00 -0.29 0.00 -2.14 0.00 0.00 52.86 51.63 1ik0 s ASN 38 Cb 0.02 -2.45 0.03 0.00 1.28 0.00 0.00 41.25 40.13 1ik0 s ASN 38 CO 0.03 -0.58 1.12 -0.76 -2.04 0.00 0.00 177.10 174.88 1ik0 s LEU 39 N 2.96 3.66 0.00 3.54 2.01 -1.26 -4.81 118.68 124.78 1ik0 s LEU 39 Ca 0.36 0.43 0.00 0.00 0.01 0.00 0.00 54.13 54.93 1ik0 s LEU 39 Cb -0.15 -3.52 0.00 0.00 0.01 0.00 0.00 46.19 42.53 1ik0 s LEU 39 CO 0.09 -1.25 0.00 0.35 1.01 0.00 0.00 176.35 176.55 1ik0 n THR 40 N 6.82 0.00 0.00 5.49 -2.24 -1.26 -5.07 114.28 118.02 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 0.49 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 0.17 -0.30 6.98 0.00 -1.26 -4.60 120.51 118.50 1ik0 n ALA 41 Ca 0.00 -0.05 -0.03 0.00 0.00 0.00 0.00 53.44 53.35 1ik0 n ALA 41 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 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 2.39 1.57 0.31 0.00 0.00 -1.26 -4.30 105.19 103.89 1ik0 n GLY 42 Ca 0.00 -0.33 -0.04 0.00 0.00 0.00 0.00 46.02 45.65 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 4.71 0.93 -0.03 1.61 0.00 -1.89 -1.41 114.93 118.86 1ik0 h MET 43 Ca 0.05 -0.20 0.01 0.00 0.00 0.00 0.00 59.70 59.56 1ik0 h MET 43 Cb 0.46 -0.14 -0.01 0.00 0.00 0.00 0.00 31.60 31.92 1ik0 h MET 43 CO 0.35 0.83 -0.01 1.88 0.00 0.00 0.00 176.91 179.96 1ik0 h TYR 44 N 0.90 -0.02 -0.24 -0.22 0.05 -1.94 0.60 116.97 116.11 1ik0 h TYR 44 Ca 0.19 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.93 1ik0 h TYR 44 Cb 0.32 0.01 -0.01 0.00 1.01 0.00 0.00 36.73 38.06 1ik0 h TYR 44 CO 0.02 -0.01 -0.03 0.00 -1.05 0.00 0.00 178.16 177.08 1ik0 h ALA 46 N 0.77 0.55 -0.80 0.00 0.00 -1.06 -2.21 119.26 116.51 1ik0 h ALA 46 Ca 0.06 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1ik0 h ALA 46 Cb 0.48 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1ik0 h ALA 46 CO 0.02 0.02 0.40 0.00 0.00 0.00 0.00 179.25 179.68 1ik0 h ALA 47 N 1.14 1.03 0.00 0.00 0.00 0.31 -2.82 119.26 118.94 1ik0 h ALA 47 Ca 0.16 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ik0 h ALA 47 Cb -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.43 1ik0 h ALA 47 CO -0.03 0.59 -0.00 1.25 0.00 0.00 0.00 179.25 181.05 1ik0 h LEU 48 N 1.13 -0.00 -1.18 0.00 5.85 -0.66 -2.31 115.31 118.14 1ik0 h LEU 48 Ca 0.28 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.99 1ik0 h LEU 48 Cb 0.10 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1ik0 h LEU 48 CO -0.04 0.01 0.55 1.05 -0.34 0.00 0.00 178.44 179.68 1ik0 h GLU 49 N -0.02 1.10 -0.84 1.25 4.11 -1.30 -0.77 114.58 118.11 1ik0 h GLU 49 Ca -0.00 -0.07 -0.04 0.00 0.07 0.00 0.00 59.36 59.33 1ik0 h GLU 49 Cb 0.02 -0.25 -0.04 0.00 0.50 0.00 0.00 28.75 28.98 1ik0 h GLU 49 CO 0.00 0.73 0.39 1.03 0.07 0.00 0.00 179.01 181.23 1ik0 h SER 50 N 1.13 1.11 0.16 3.06 0.87 -1.24 -2.35 113.55 116.29 1ik0 h SER 50 Ca 0.31 -0.15 -0.13 0.00 -1.23 0.00 0.00 61.79 60.59 1ik0 h SER 50 Cb -0.13 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.53 1ik0 h SER 50 CO -0.07 0.95 -0.45 -0.07 -0.53 0.00 0.00 176.83 176.66 1ik0 h LEU 51 N 1.20 0.39 -1.33 2.23 3.38 -0.78 -2.68 115.31 117.71 1ik0 h LEU 51 Ca 0.29 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1ik0 h LEU 51 Cb 0.15 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ik0 h LEU 51 CO -0.03 0.79 0.21 0.40 0.09 0.00 0.00 178.44 179.89 1ik0 h ILE 52 N 0.29 0.00 0.00 1.22 1.08 -0.60 0.98 117.51 120.48 1ik0 h ILE 52 Ca 0.02 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.49 1ik0 h ILE 52 Cb 0.92 0.44 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1ik0 h ILE 52 CO 0.08 0.00 -0.33 0.78 -0.69 0.00 0.00 178.15 177.98 1ik0 h ASN 53 N 0.00 0.00 -3.43 1.72 -0.26 -1.52 -3.44 115.58 108.65 1ik0 h ASN 53 Ca 0.00 -0.09 -0.59 0.00 -0.56 0.00 0.00 56.30 55.06 1ik0 h ASN 53 Cb 0.41 0.00 -0.10 0.00 -1.06 0.00 0.00 38.32 37.57 1ik0 h ASN 53 CO 0.00 0.05 -0.11 -0.69 -1.06 0.00 0.00 177.43 175.62 1ik0 s VAL 54 N -3.16 5.15 0.09 2.81 1.01 0.34 -5.07 120.40 121.58 1ik0 s VAL 54 Ca 0.08 0.88 0.06 0.00 0.00 0.00 0.00 61.98 63.00 1ik0 s VAL 54 Cb 0.12 -3.80 -0.03 0.00 0.00 0.00 0.00 36.38 32.66 1ik0 s VAL 54 CO 0.67 0.24 -0.15 -0.44 0.00 0.00 0.00 175.10 175.42 1ik0 s SER 55 N 0.98 1.88 0.00 3.32 0.01 -1.26 -4.74 113.70 113.89 1ik0 s SER 55 Ca 0.23 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.80 1ik0 s SER 55 Cb -0.15 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 66.01 1ik0 s SER 55 CO 0.09 -0.09 0.00 0.61 0.41 0.00 0.00 173.24 174.26 1ik0 n GLY 56 N 0.99 1.49 3.36 3.44 0.00 -1.26 -4.98 105.19 108.22 1ik0 n GLY 56 Ca -0.19 0.00 -0.46 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 7.93 0.00 0.00 0.00 0.87 -1.97 -3.14 113.55 117.25 1ik0 h SER 58 Ca 0.13 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.69 1ik0 h SER 58 Cb 1.03 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 1ik0 h SER 58 CO 0.84 0.49 0.38 0.00 -0.53 0.00 0.00 176.83 178.02 1ik0 h ALA 59 N 1.51 1.30 -0.02 6.23 0.00 -1.95 0.80 119.26 127.12 1ik0 h ALA 59 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1ik0 h ALA 59 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1ik0 h ALA 59 CO 0.06 -0.30 0.00 0.44 0.00 0.00 0.00 179.25 179.46 1ik0 n ILE 60 N -2.24 0.98 -0.25 0.00 -5.35 -1.19 -4.67 119.36 106.65 1ik0 n ILE 60 Ca -0.01 -0.99 -0.05 0.00 -0.27 0.00 0.00 62.75 61.43 1ik0 n ILE 60 Cb 0.41 0.51 0.06 0.00 -1.74 0.00 0.00 39.64 38.88 1ik0 n ILE 60 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 1ik0 h GLU 61 N 0.10 0.92 -0.98 6.28 4.81 0.53 -1.04 114.58 125.20 1ik0 h GLU 61 Ca 0.00 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1ik0 h GLU 61 Cb 0.50 -0.21 -0.05 0.00 0.63 0.00 0.00 28.75 29.63 1ik0 h GLU 61 CO 0.00 0.61 0.62 0.87 -0.73 0.00 0.00 179.01 180.38 1ik0 h LYS 62 N 0.95 1.31 -0.97 1.92 1.57 -1.83 -2.07 116.57 117.44 1ik0 h LYS 62 Ca 0.26 -0.10 0.01 0.00 -1.87 0.00 0.00 60.65 58.96 1ik0 h LYS 62 Cb -0.10 -0.29 -0.05 0.00 0.08 0.00 0.00 32.23 31.88 1ik0 h LYS 62 CO -0.06 0.89 0.64 1.15 -0.57 0.00 0.00 179.45 181.50 1ik0 h THR 63 N 1.34 1.24 -0.62 -0.16 2.02 -1.52 -1.96 112.91 113.25 1ik0 h THR 63 Ca 0.36 -0.45 -0.00 0.00 0.77 0.00 0.00 66.41 67.08 1ik0 h THR 63 Cb -0.11 -0.18 -0.03 0.00 -1.74 0.00 0.00 68.15 66.09 1ik0 h THR 63 CO -0.07 0.24 0.37 1.56 0.37 0.00 0.00 175.52 177.99 1ik0 h GLN 64 N 1.31 0.85 -0.17 6.66 4.20 -0.66 -0.60 115.11 126.69 1ik0 h GLN 64 Ca 0.36 -0.08 -0.01 0.00 0.06 0.00 0.00 58.65 58.98 1ik0 h GLN 64 Cb -0.13 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.46 1ik0 h GLN 64 CO -0.08 0.61 0.08 -0.09 -0.67 0.00 0.00 178.83 178.68 1ik0 h ARG 65 N 0.84 0.25 -0.75 1.46 9.65 -1.19 -0.73 114.38 123.92 1ik0 h ARG 65 Ca 0.22 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 59.04 1ik0 h ARG 65 Cb -0.02 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 28.48 1ik0 h ARG 65 CO -0.04 0.30 0.39 0.52 2.80 0.00 0.00 179.97 183.94 1ik0 h MET 66 N 0.15 1.06 -0.92 0.20 2.86 -1.13 -1.58 114.93 115.56 1ik0 h MET 66 Ca 0.06 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.55 1ik0 h MET 66 Cb 0.14 -0.20 -0.04 0.00 0.06 0.00 0.00 31.60 31.55 1ik0 h MET 66 CO -0.01 0.80 0.53 -0.07 1.06 0.00 0.00 176.91 179.23 1ik0 h LEU 67 N 1.04 1.13 -1.12 1.22 3.38 -0.88 -1.30 115.31 118.78 1ik0 h LEU 67 Ca 0.26 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.16 1ik0 h LEU 67 Cb 0.07 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.49 1ik0 h LEU 67 CO -0.04 0.88 0.60 0.28 0.09 0.00 0.00 178.44 180.25 1ik0 h SER 68 N 1.28 1.02 -1.05 -0.43 0.02 -0.32 -0.44 113.55 113.63 1ik0 h SER 68 Ca 0.33 -0.02 0.29 0.00 -0.84 0.00 0.00 61.79 61.55 1ik0 h SER 68 Cb -0.02 -0.25 -0.06 0.00 0.14 0.00 0.00 62.40 62.22 1ik0 h SER 68 CO -0.06 0.73 0.74 1.23 -1.14 0.00 0.00 176.83 178.33 1ik0 h GLY 69 N 1.20 0.32 0.57 -3.77 0.00 -0.31 1.46 103.07 102.55 1ik0 h GLY 69 Ca 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.61 1ik0 h GLY 69 CO -0.08 -0.03 -1.04 0.69 0.00 0.00 0.00 176.54 176.08 1ik0 n PHE 70 N -4.32 0.26 -3.27 5.60 3.01 -0.28 -4.57 117.46 113.89 1ik0 n PHE 70 Ca 0.23 0.08 -0.24 0.00 1.01 0.00 0.00 57.45 58.53 1ik0 n PHE 70 Cb 1.05 -0.43 -0.08 0.00 -0.01 0.00 0.00 39.48 40.01 1ik0 n PHE 70 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1ik0 n PRO 72 N 2.47 0.75 -3.47 0.00 -0.04 0.35 -4.40 135.00 130.65 1ik0 n PRO 72 Ca 0.26 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 63.39 1ik0 n PRO 72 Cb 0.50 -1.13 -0.05 0.00 -0.04 0.00 0.00 33.50 32.78 1ik0 n PRO 72 CO 0.00 0.00 0.00 -3.38 -0.04 0.00 0.00 175.50 172.08 1ik0 s HIS 73 N 0.30 3.51 -0.07 0.54 -3.43 -1.26 -5.04 115.29 109.85 1ik0 s HIS 73 Ca 0.00 0.86 -0.30 0.00 -0.80 0.00 0.00 55.06 54.82 1ik0 s HIS 73 Cb 0.00 -2.23 -0.03 0.00 -1.43 0.00 0.00 32.58 28.89 1ik0 s HIS 73 CO 0.00 0.39 1.11 0.15 -2.00 0.00 0.00 174.74 174.39 1ik0 s LYS 74 N -2.37 4.40 -0.13 -0.38 1.02 -1.26 -5.02 119.74 116.00 1ik0 s LYS 74 Ca 0.41 1.55 0.01 0.00 0.02 0.00 0.00 55.97 57.96 1ik0 s LYS 74 Cb -0.13 -3.53 -0.01 0.00 -0.52 0.00 0.00 37.83 33.64 1ik0 s LYS 74 CO 0.20 -0.36 -0.17 0.08 -0.92 0.00 0.00 175.35 174.19 1ik0 s VAL 75 N 2.00 2.65 0.12 3.17 1.01 -1.26 -5.09 120.40 123.00 1ik0 s VAL 75 Ca 0.53 -0.79 0.05 0.00 0.00 0.00 0.00 61.98 61.77 1ik0 s VAL 75 Cb -0.22 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 1ik0 s VAL 75 CO 0.21 0.53 0.02 -0.44 0.00 0.00 0.00 175.10 175.42 1ik0 s SER 76 N 0.56 5.08 0.34 3.32 0.01 -1.26 -4.97 113.70 116.78 1ik0 s SER 76 Ca -0.10 -0.20 0.22 0.00 1.31 0.00 0.00 55.95 57.18 1ik0 s SER 76 Cb -0.16 -1.22 1.22 0.00 0.21 0.00 0.00 66.02 66.08 1ik0 s SER 76 CO 0.04 0.14 1.68 0.00 0.41 0.00 0.00 173.24 175.51 1ik0 h ALA 77 N 3.14 1.02 0.00 1.44 0.00 -1.98 0.11 119.26 122.99 1ik0 h ALA 77 Ca -0.47 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.32 1ik0 h ALA 77 Cb 1.18 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 1ik0 h ALA 77 CO 0.60 -0.02 -1.68 0.41 0.00 0.00 0.00 179.25 178.57 1ik0 n GLY 78 N -1.28 -1.16 3.67 0.00 0.00 -1.26 -4.85 105.19 100.31 1ik0 n GLY 78 Ca -0.01 -0.31 -0.38 0.00 0.00 0.00 0.00 46.02 45.31 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 -3.14 4.19 0.07 1.61 -0.21 0.39 -5.07 119.66 117.51 1ik0 s GLN 79 Ca -0.05 0.28 0.05 0.00 0.02 0.00 0.00 55.36 55.66 1ik0 s GLN 79 Cb 0.10 -3.54 -0.03 0.00 1.00 0.00 0.00 33.01 30.54 1ik0 s GLN 79 CO 0.84 -0.06 -0.15 -0.06 -2.12 0.00 0.00 175.29 173.75 1ik0 s PHE 80 N 1.35 1.26 0.00 0.91 0.08 -1.26 -4.32 117.98 116.00 1ik0 s PHE 80 Ca 0.21 -0.46 0.00 0.00 0.12 0.00 0.00 56.93 56.80 1ik0 s PHE 80 Cb -0.15 -0.71 0.00 0.00 -0.57 0.00 0.00 43.02 41.59 1ik0 s PHE 80 CO 0.09 0.07 0.00 0.43 -0.10 0.00 0.00 175.22 175.70 1ik0 n SER 81 N 1.26 0.58 -0.52 1.36 7.64 -1.26 -4.84 113.62 117.84 1ik0 n SER 81 Ca -0.21 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.78 1ik0 n SER 81 Cb 0.54 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.78 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 -2.85 2.04 -1.10 6.43 2.88 -1.26 -4.32 113.62 115.44 1ik0 n SER 82 Ca 0.00 -1.51 -0.03 0.00 -1.33 0.00 0.00 58.87 56.00 1ik0 n SER 82 Cb 0.44 0.41 0.06 0.00 -0.75 0.00 0.00 64.21 64.37 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 0.05 3.17 0.06 2.46 4.32 -1.26 -4.00 117.00 121.80 1ik0 n LEU 83 Ca 0.10 -1.62 -0.21 0.00 -0.02 0.00 0.00 56.01 54.26 1ik0 n LEU 83 Cb 0.47 -0.56 -0.12 0.00 -1.62 0.00 0.00 43.42 41.59 1ik0 n LEU 83 CO 0.27 0.51 0.02 0.45 -1.22 0.00 0.00 177.39 177.42 1ik0 h HIS 84 N 0.48 1.04 -4.11 -1.77 3.86 -1.94 -3.45 115.15 109.26 1ik0 h HIS 84 Ca 0.09 -0.60 -0.48 0.00 -1.16 0.00 0.00 60.37 58.22 1ik0 h HIS 84 Cb 1.20 -0.10 0.04 0.00 1.06 0.00 0.00 27.41 29.60 1ik0 h HIS 84 CO 0.32 1.44 0.38 0.08 0.86 0.00 0.00 177.93 181.01 1ik0 s VAL 85 N -3.18 3.82 -1.31 2.45 1.01 -1.26 -4.93 120.40 117.01 1ik0 s VAL 85 Ca -0.10 1.04 -0.11 0.00 0.00 0.00 0.00 61.98 62.82 1ik0 s VAL 85 Cb 0.06 -3.44 0.14 0.00 0.00 0.00 0.00 36.38 33.14 1ik0 s VAL 85 CO 0.93 -0.33 1.89 0.54 0.00 0.00 0.00 175.10 178.13 1ik0 n ARG 86 N -1.30 3.44 -2.14 2.72 1.74 -1.26 -4.97 116.66 114.89 1ik0 n ARG 86 Ca 0.09 -3.38 -0.26 0.00 -0.77 0.00 0.00 57.85 53.53 1ik0 n ARG 86 Cb 0.53 -3.02 0.08 0.00 -1.02 0.00 0.00 32.46 29.02 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 1.59 4.70 0.28 0.55 1.01 -1.26 -5.08 116.67 118.46 1ik0 s ASP 87 Ca 0.42 0.50 -0.01 0.00 0.71 0.00 0.00 52.55 54.16 1ik0 s ASP 87 Cb 0.09 -1.09 -0.04 0.00 1.01 0.00 0.00 42.92 42.89 1ik0 s ASP 87 CO -0.01 -1.69 0.49 0.28 0.21 0.00 0.00 175.17 174.44 1ik0 s THR 88 N -3.33 5.13 0.41 -1.27 -1.32 -1.26 -4.85 115.64 109.15 1ik0 s THR 88 Ca 0.61 -0.34 -0.16 0.00 -1.21 0.00 0.00 61.69 60.59 1ik0 s THR 88 Cb -0.10 -3.79 -0.09 0.00 -1.51 0.00 0.00 72.50 67.01 1ik0 s THR 88 CO 0.46 -0.37 0.85 -0.54 -2.21 0.00 0.00 174.62 172.81 1ik0 s LYS 89 N -3.80 3.99 0.11 7.08 1.02 -1.26 -2.57 119.74 124.32 1ik0 s LYS 89 Ca 0.40 0.80 0.04 0.00 0.02 0.00 0.00 55.97 57.22 1ik0 s LYS 89 Cb -0.10 -2.29 -0.04 0.00 -0.52 0.00 0.00 37.83 34.88 1ik0 s LYS 89 CO 0.32 -0.03 -0.10 0.96 -0.92 0.00 0.00 175.35 175.58 1ik0 s ILE 90 N -2.27 0.98 0.45 2.17 -4.36 0.85 -4.88 121.20 114.14 1ik0 s ILE 90 Ca 0.56 -1.84 -0.24 0.00 -0.26 0.00 0.00 60.65 58.87 1ik0 s ILE 90 Cb -0.10 -1.59 -0.07 0.00 1.25 0.00 0.00 42.46 41.95 1ik0 s ILE 90 CO 0.23 -0.68 1.24 -1.61 0.24 0.00 0.00 174.94 174.36 1ik0 s GLU 91 N -3.31 3.75 0.28 0.37 2.02 -1.26 0.00 118.70 120.55 1ik0 s GLU 91 Ca 0.11 1.99 0.00 0.00 0.02 0.00 0.00 54.97 57.09 1ik0 s GLU 91 Cb 0.00 -2.52 0.52 0.00 0.10 0.00 0.00 34.13 32.23 1ik0 s GLU 91 CO -0.01 -0.62 1.85 0.28 0.02 0.00 0.00 175.26 176.78 1ik0 h VAL 92 N 2.04 0.96 -0.91 2.63 2.07 -1.85 -0.43 116.25 120.76 1ik0 h VAL 92 Ca -0.50 -0.36 0.17 0.00 0.82 0.00 0.00 66.70 66.84 1ik0 h VAL 92 Cb 1.25 -0.17 -0.10 0.00 -1.52 0.00 0.00 31.29 30.75 1ik0 h VAL 92 CO 0.61 0.19 0.49 0.00 0.02 0.00 0.00 177.57 178.87 1ik0 h ALA 93 N 1.52 1.44 -0.02 1.67 0.00 -1.90 0.67 119.26 122.63 1ik0 h ALA 93 Ca 0.48 0.10 -0.23 0.00 0.00 0.00 0.00 54.91 55.26 1ik0 h ALA 93 Cb 0.41 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 18.19 1ik0 h ALA 93 CO -0.24 -0.12 -0.92 1.96 0.00 0.00 0.00 179.25 179.93 1ik0 h GLN 94 N 0.63 0.49 -0.30 0.00 4.20 -1.47 -2.88 115.11 115.78 1ik0 h GLN 94 Ca 0.52 -0.50 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1ik0 h GLN 94 Cb 0.81 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.71 1ik0 h GLN 94 CO -0.40 1.14 0.20 0.35 -0.67 0.00 0.00 178.83 179.45 1ik0 h PHE 95 N 0.29 0.38 0.00 2.96 3.04 -0.08 0.29 116.94 123.83 1ik0 h PHE 95 Ca -0.08 0.01 -0.00 0.00 3.98 0.00 0.00 57.97 61.88 1ik0 h PHE 95 Cb 1.55 -0.13 0.00 0.00 2.56 0.00 0.00 35.95 39.93 1ik0 h PHE 95 CO 0.07 0.24 -0.00 0.28 -2.02 0.00 0.00 178.31 176.88 1ik0 h VAL 96 N 0.41 1.09 -0.65 1.41 2.07 -1.00 -1.04 116.25 118.54 1ik0 h VAL 96 Ca 0.11 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.30 1ik0 h VAL 96 Cb -0.05 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 30.97 1ik0 h VAL 96 CO -0.02 0.07 0.18 0.11 0.02 0.00 0.00 177.57 177.92 1ik0 h LYS 97 N -0.12 1.03 -0.73 1.57 1.57 -1.31 -0.72 116.57 117.86 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 0.12 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.25 1ik0 h LYS 97 CO 0.00 0.92 0.48 -0.44 -0.57 0.00 0.00 179.45 179.84 1ik0 h ASP 98 N 0.96 0.84 -0.42 0.86 3.32 -0.27 -1.48 116.42 120.23 1ik0 h ASP 98 Ca 0.21 -0.02 -0.06 0.00 0.02 0.00 0.00 57.03 57.17 1ik0 h ASP 98 Cb 0.34 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 1ik0 h ASP 98 CO -0.00 0.61 0.05 0.25 -1.72 0.00 0.00 179.24 178.44 1ik0 h LEU 99 N 0.99 0.74 -0.55 1.55 5.85 -0.80 -3.01 115.31 120.08 1ik0 h LEU 99 Ca 0.27 -0.16 0.06 0.00 0.84 0.00 0.00 57.88 58.89 1ik0 h LEU 99 Cb -0.11 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.67 1ik0 h LEU 99 CO -0.06 0.77 0.27 0.25 -0.34 0.00 0.00 178.44 179.33 1ik0 h LEU 100 N 0.74 0.36 -0.75 2.25 5.85 -0.05 -0.65 115.31 123.07 1ik0 h LEU 100 Ca 0.15 0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.92 1ik0 h LEU 100 Cb 0.37 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.34 1ik0 h LEU 100 CO 0.01 0.24 0.49 -0.07 -0.34 0.00 0.00 178.44 178.77 1ik0 h LEU 101 N 0.51 0.86 -0.38 2.25 -0.00 -1.37 -2.70 115.31 114.48 1ik0 h LEU 101 Ca 0.25 -0.03 -0.17 0.00 -0.00 0.00 0.00 57.88 57.94 1ik0 h LEU 101 Cb 0.20 -0.22 -0.00 0.00 -0.00 0.00 0.00 40.66 40.64 1ik0 h LEU 101 CO -0.19 0.63 -0.43 0.45 -0.00 0.00 0.00 178.44 178.90 1ik0 h HIS 102 N 1.01 1.10 0.12 1.13 3.86 -1.46 -2.37 115.15 118.54 1ik0 h HIS 102 Ca 0.27 -0.35 0.00 0.00 -1.16 0.00 0.00 60.37 59.14 1ik0 h HIS 102 Cb -0.11 -0.23 -0.01 0.00 1.06 0.00 0.00 27.41 28.13 1ik0 h HIS 102 CO -0.02 1.17 -0.10 -0.07 0.86 0.00 0.00 177.93 179.77 1ik0 h LEU 103 N 0.73 -0.27 -1.61 2.43 3.38 -0.86 -1.90 115.31 117.21 1ik0 h LEU 103 Ca 0.05 0.03 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 1ik0 h LEU 103 Cb 1.02 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 1ik0 h LEU 103 CO 0.10 -0.16 -0.19 0.07 0.09 0.00 0.00 178.44 178.35 1ik0 h LYS 104 N -0.24 0.00 -0.17 1.13 2.10 -1.54 -3.07 116.57 114.78 1ik0 h LYS 104 Ca 0.00 0.00 -0.02 0.00 -2.00 0.00 0.00 60.65 58.63 1ik0 h LYS 104 Cb 0.22 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.55 1ik0 h LYS 104 CO -0.02 0.19 0.01 -0.22 -2.00 0.00 0.00 179.45 177.41 1ik0 h LYS 105 N 0.00 0.30 0.00 0.07 3.64 -0.80 -2.72 116.57 117.06 1ik0 h LYS 105 Ca -0.00 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.29 1ik0 h LYS 105 Cb 0.49 -0.03 -0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1ik0 h LYS 105 CO 0.02 0.50 -0.00 -0.07 -2.27 0.00 0.00 179.45 177.63 1ik0 h LEU 106 N 0.06 0.00 -1.01 5.20 -0.00 -1.36 -1.45 115.31 116.75 1ik0 h LEU 106 Ca 0.05 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.94 1ik0 h LEU 106 Cb 0.36 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.97 1ik0 h LEU 106 CO 0.01 0.00 0.67 0.15 -0.00 0.00 0.00 178.44 179.27 1ik0 h PHE 107 N 0.00 1.26 -0.73 1.13 3.57 -1.50 -0.87 116.94 119.81 1ik0 h PHE 107 Ca -0.00 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.54 1ik0 h PHE 107 Cb 0.01 -0.43 -0.04 0.00 2.79 0.00 0.00 35.95 38.28 1ik0 h PHE 107 CO 0.00 0.79 0.48 0.00 -2.23 0.00 0.00 178.31 177.35 1ik0 h ARG 108 N 1.36 0.97 0.00 1.11 2.47 -1.23 -0.72 114.38 118.34 1ik0 h ARG 108 Ca 0.37 -0.06 0.00 0.00 -1.26 0.00 0.00 59.98 59.03 1ik0 h ARG 108 Cb -0.15 -0.22 0.00 0.00 -1.65 0.00 0.00 29.97 27.96 1ik0 h ARG 108 CO -0.08 0.64 -0.21 0.39 0.56 0.00 0.00 179.97 181.27 1ik0 n GLU 109 N -4.42 0.17 -0.94 0.04 1.02 -0.72 -4.88 120.64 110.91 1ik0 n GLU 109 Ca 0.08 0.10 0.00 0.00 -0.02 0.00 0.00 57.16 57.32 1ik0 n GLU 109 Cb 0.03 -1.66 0.00 0.00 -0.02 0.00 0.00 31.44 29.79 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 0.11 3.35 0.62 0.00 -0.28 -4.90 105.19 105.48 1ik0 n GLY 110 Ca 0.05 0.00 -0.46 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 -1.50 3.41 0.13 1.61 0.52 -1.23 -5.03 118.95 116.86 1ik0 s ARG 111 Ca 0.00 -2.08 -0.21 0.00 -0.52 0.00 0.00 55.73 52.92 1ik0 s ARG 111 Cb 0.00 -4.45 -0.07 0.00 0.52 0.00 0.00 34.95 30.95 1ik0 s ARG 111 CO 0.00 -1.39 0.65 -0.06 0.02 0.00 0.00 175.30 174.52 1ik0 s PHE 112 N 1.09 3.79 0.00 -0.53 0.08 -1.26 -4.89 117.98 116.26 1ik0 s PHE 112 Ca 0.16 1.38 0.00 0.00 0.12 0.00 0.00 56.93 58.59 1ik0 s PHE 112 Cb -0.15 -2.58 0.00 0.00 -0.57 0.00 0.00 43.02 39.72 1ik0 s PHE 112 CO -0.05 0.51 0.00 0.09 -0.10 0.00 0.00 175.22 175.67