#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 0.28 3.03 0.00 -1.26 -4.95 107.32 106.10 1ik0 s GLY 2 Ca 0.00 0.25 -0.30 0.00 0.00 0.00 0.00 44.72 44.67 1ik0 s GLY 2 CO 0.00 0.59 1.61 2.56 0.00 0.00 0.00 173.10 177.86 1ik0 s PRO 3 N -4.92 4.12 0.41 2.90 0.04 -1.26 -4.99 135.00 131.30 1ik0 s PRO 3 Ca 0.61 2.59 -0.20 0.00 0.04 0.00 0.00 61.00 64.04 1ik0 s PRO 3 Cb -0.17 -3.03 -0.11 0.00 0.04 0.00 0.00 34.50 31.24 1ik0 s PRO 3 CO 0.56 -0.65 0.90 0.14 0.04 0.00 0.00 177.00 177.99 1ik0 s VAL 4 N 0.13 4.46 1.07 -0.36 -7.23 -1.26 -5.04 120.40 112.17 1ik0 s VAL 4 Ca 0.65 1.37 -0.12 0.00 -1.81 0.00 0.00 61.98 62.06 1ik0 s VAL 4 Cb -0.48 -3.60 0.23 0.00 0.56 0.00 0.00 36.38 33.09 1ik0 s VAL 4 CO 0.46 -0.29 1.07 -2.16 -0.31 0.00 0.00 175.10 173.87 1ik0 s PRO 5 N -3.14 -0.20 0.11 4.82 0.04 -1.26 -4.74 135.00 130.63 1ik0 s PRO 5 Ca 0.60 1.00 -0.18 0.00 0.04 0.00 0.00 61.00 62.47 1ik0 s PRO 5 Cb -0.09 -1.63 -0.05 0.00 0.04 0.00 0.00 34.50 32.78 1ik0 s PRO 5 CO 0.14 -3.29 1.67 -1.00 0.04 0.00 0.00 177.00 174.56 1ik0 h PRO 6 N -2.32 0.44 -0.98 0.56 0.13 -1.99 -1.76 132.00 126.08 1ik0 h PRO 6 Ca -0.56 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 1ik0 h PRO 6 Cb 1.31 -0.07 -0.05 0.00 0.13 0.00 0.00 31.00 32.32 1ik0 h PRO 6 CO 0.49 0.44 0.62 0.66 -0.23 0.00 0.00 178.00 179.99 1ik0 h SER 7 N 0.34 1.15 -0.26 1.44 4.64 -1.96 -0.87 113.55 118.02 1ik0 h SER 7 Ca 0.10 -0.05 -0.11 0.00 -0.47 0.00 0.00 61.79 61.26 1ik0 h SER 7 Cb 0.16 -0.29 -0.00 0.00 -0.31 0.00 0.00 62.40 61.96 1ik0 h SER 7 CO -0.01 0.85 -0.29 0.74 -0.87 0.00 0.00 176.83 177.26 1ik0 h THR 8 N 1.34 1.31 -0.72 2.95 2.02 -1.89 -2.52 112.91 115.40 1ik0 h THR 8 Ca 0.36 -1.46 -0.02 0.00 0.77 0.00 0.00 66.41 66.06 1ik0 h THR 8 Cb -0.11 1.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.92 1ik0 h THR 8 CO -0.07 0.46 0.39 0.00 0.37 0.00 0.00 175.52 176.67 1ik0 h ALA 9 N 0.68 0.92 -0.19 6.16 0.00 -0.98 -1.40 119.26 124.45 1ik0 h ALA 9 Ca 0.04 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ik0 h ALA 9 Cb 0.85 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 1ik0 h ALA 9 CO 0.07 0.44 0.11 1.25 0.00 0.00 0.00 179.25 181.12 1ik0 h LEU 10 N 0.99 0.23 -1.00 0.00 5.85 -1.11 0.11 115.31 120.38 1ik0 h LEU 10 Ca 0.25 -0.07 0.01 0.00 0.84 0.00 0.00 57.88 58.91 1ik0 h LEU 10 Cb 0.05 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 1ik0 h LEU 10 CO -0.04 0.23 0.66 0.03 -0.34 0.00 0.00 178.44 178.99 1ik0 h ARG 11 N 0.21 1.32 -0.69 1.25 3.08 -1.19 0.22 114.38 118.57 1ik0 h ARG 11 Ca 0.07 -0.08 -0.08 0.00 0.07 0.00 0.00 59.98 59.96 1ik0 h ARG 11 Cb 0.05 -0.30 -0.03 0.00 0.08 0.00 0.00 29.97 29.78 1ik0 h ARG 11 CO -0.01 0.87 0.13 0.93 -1.07 0.00 0.00 179.97 180.82 1ik0 h GLU 12 N 1.36 1.13 -0.33 0.04 4.39 -0.78 -2.17 114.58 118.21 1ik0 h GLU 12 Ca 0.37 -0.29 -0.15 0.00 0.34 0.00 0.00 59.36 59.62 1ik0 h GLU 12 Cb -0.16 -0.14 -0.00 0.00 -0.10 0.00 0.00 28.75 28.35 1ik0 h GLU 12 CO -0.08 1.02 -0.39 1.25 -1.16 0.00 0.00 179.01 179.65 1ik0 h LEU 13 N 1.06 0.92 -0.08 1.33 5.85 0.25 -2.60 115.31 122.03 1ik0 h LEU 13 Ca 0.21 -0.48 -0.00 0.00 0.84 0.00 0.00 57.88 58.45 1ik0 h LEU 13 Cb 0.43 -0.26 -0.00 0.00 0.37 0.00 0.00 40.66 41.19 1ik0 h LEU 13 CO 0.01 1.22 0.05 0.40 -0.34 0.00 0.00 178.44 179.78 1ik0 h ILE 14 N 0.64 1.04 -0.93 4.05 2.04 -0.45 0.08 117.51 123.99 1ik0 h ILE 14 Ca 0.05 -0.11 0.01 0.00 1.00 0.00 0.00 64.86 65.81 1ik0 h ILE 14 Cb 0.98 0.97 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 1ik0 h ILE 14 CO 0.09 0.04 0.61 -0.33 0.00 0.00 0.00 178.15 178.56 1ik0 h GLU 15 N 0.09 1.22 -0.17 2.37 5.08 -1.40 -0.66 114.58 121.10 1ik0 h GLU 15 Ca 0.03 -0.08 -0.08 0.00 -1.00 0.00 0.00 59.36 58.24 1ik0 h GLU 15 Cb 0.02 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 28.99 1ik0 h GLU 15 CO -0.01 0.81 -0.19 1.49 -1.00 0.00 0.00 179.01 180.11 1ik0 h GLU 16 N 1.26 0.44 -0.75 2.33 4.81 -1.17 -0.98 114.58 120.51 1ik0 h GLU 16 Ca 0.34 -0.24 -0.00 0.00 -0.13 0.00 0.00 59.36 59.33 1ik0 h GLU 16 Cb -0.14 0.01 -0.04 0.00 0.63 0.00 0.00 28.75 29.22 1ik0 h GLU 16 CO -0.07 0.81 0.46 -0.07 -0.73 0.00 0.00 179.01 179.41 1ik0 h LEU 17 N 0.08 0.90 -0.63 1.64 3.38 -0.76 -2.26 115.31 117.66 1ik0 h LEU 17 Ca 0.02 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 1ik0 h LEU 17 Cb 0.74 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.24 1ik0 h LEU 17 CO 0.05 0.69 0.02 0.58 0.09 0.00 0.00 178.44 179.87 1ik0 h VAL 18 N 1.03 1.27 -1.00 1.22 2.07 -1.07 -2.87 116.25 116.89 1ik0 h VAL 18 Ca 0.27 -1.14 0.01 0.00 0.82 0.00 0.00 66.70 66.66 1ik0 h VAL 18 Cb -0.05 0.76 -0.05 0.00 -1.52 0.00 0.00 31.29 30.43 1ik0 h VAL 18 CO -0.05 0.42 0.67 0.78 0.02 0.00 0.00 177.57 179.40 1ik0 h ASN 19 N 1.00 1.15 1.58 0.57 2.35 -0.62 -1.10 115.58 120.52 1ik0 h ASN 19 Ca 0.18 -0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 1ik0 h ASN 19 Cb 0.55 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 38.63 1ik0 h ASN 19 CO 0.03 0.84 0.00 0.16 -1.65 0.00 0.00 177.43 176.80 1ik0 h ILE 20 N 1.36 0.00 0.00 2.81 3.07 -1.31 -3.30 117.51 120.14 1ik0 h ILE 20 Ca 0.37 -0.67 -0.00 0.00 1.55 0.00 0.00 64.86 66.10 1ik0 h ILE 20 Cb -0.16 1.65 -0.00 0.00 -0.27 0.00 0.00 36.82 38.04 1ik0 h ILE 20 CO -0.08 0.00 -1.99 0.35 -1.05 0.00 0.00 178.15 175.39 1ik0 n THR 21 N -2.69 0.02 0.02 0.16 -2.24 -0.94 -3.82 114.28 104.79 1ik0 n THR 21 Ca 0.04 -0.49 -0.13 0.00 -2.27 0.00 0.00 64.05 61.20 1ik0 n THR 21 Cb 0.44 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.66 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 0.57 -0.60 -0.78 4.20 -1.29 -3.21 115.11 113.99 1ik0 h GLN 22 Ca -0.01 -0.47 0.00 0.00 0.06 0.00 0.00 58.65 58.24 1ik0 h GLN 22 Cb 1.00 0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1ik0 h GLN 22 CO 0.00 1.09 0.00 0.27 -0.67 0.00 0.00 178.83 179.52 1ik0 n ASN 23 N -3.88 3.60 -4.70 1.46 2.04 -1.25 -4.93 115.26 107.61 1ik0 n ASN 23 Ca -0.06 -1.99 -0.42 0.00 -0.44 0.00 0.00 54.58 51.67 1ik0 n ASN 23 Cb 0.73 -0.40 -0.03 0.00 -2.53 0.00 0.00 39.78 37.55 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 -1.21 4.50 0.00 -3.83 -2.07 -1.22 -4.98 119.66 110.86 1ik0 s GLN 24 Ca 0.44 1.34 0.00 0.00 -1.82 0.00 0.00 55.36 55.32 1ik0 s GLN 24 Cb 0.24 -3.48 0.00 0.00 -1.09 0.00 0.00 33.01 28.67 1ik0 s GLN 24 CO 0.32 -0.12 0.00 1.17 -1.32 0.00 0.00 175.29 175.34 1ik0 n LYS 25 N 4.22 0.00 -2.36 9.60 4.81 -1.26 -4.94 118.16 128.23 1ik0 n LYS 25 Ca 0.06 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.20 1ik0 n LYS 25 Cb 0.50 -0.28 -0.01 0.00 0.02 0.00 0.00 35.03 35.27 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 3.22 0.38 3.14 0.00 -1.26 -4.97 121.76 117.84 1ik0 s ALA 26 Ca 0.00 -0.17 -0.23 0.00 0.00 0.00 0.00 51.96 51.57 1ik0 s ALA 26 Cb 0.00 -2.89 -0.15 0.00 0.00 0.00 0.00 23.12 20.09 1ik0 s ALA 26 CO 0.00 -0.39 0.31 -2.30 0.00 0.00 0.00 175.76 173.38 1ik0 n PRO 27 N -2.12 0.20 0.01 0.00 -0.02 -1.26 -4.84 135.00 126.97 1ik0 n PRO 27 Ca 0.04 0.07 -0.11 0.00 -2.02 0.00 0.00 63.50 61.48 1ik0 n PRO 27 Cb 0.54 -1.18 -0.06 0.00 -0.02 0.00 0.00 33.50 32.79 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 0.58 0.07-10.47 2.45 3.38 -1.97 -3.43 115.31 105.93 1ik0 h LEU 28 Ca -0.37 -0.01 -0.47 0.00 0.09 0.00 0.00 57.88 57.13 1ik0 h LEU 28 Cb 1.43 -0.02 0.06 0.00 0.09 0.00 0.00 40.66 42.22 1ik0 h LEU 28 CO 0.50 0.06 0.17 0.00 0.09 0.00 0.00 178.44 179.26 1ik0 n ASN 30 N -2.66 1.98 0.00 0.00 4.13 -1.26 -4.22 115.26 113.23 1ik0 n ASN 30 Ca 0.06 -1.59 0.00 0.00 1.68 0.00 0.00 54.58 54.73 1ik0 n ASN 30 Cb 0.59 -0.44 0.00 0.00 -1.54 0.00 0.00 39.78 38.39 1ik0 n ASN 30 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1ik0 n GLY 31 N 2.00 0.51 3.77 7.41 0.00 -1.26 -5.00 105.19 112.62 1ik0 n GLY 31 Ca 0.03 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 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 -2.87 6.13 0.10 1.61 0.01 -1.26 -4.89 113.70 112.53 1ik0 s SER 32 Ca 0.00 3.03 0.05 0.00 1.31 0.00 0.00 55.95 60.34 1ik0 s SER 32 Cb 0.00 -2.66 -0.04 0.00 0.21 0.00 0.00 66.02 63.53 1ik0 s SER 32 CO 0.00 -1.02 0.00 -0.04 0.41 0.00 0.00 173.24 172.59 1ik0 s MET 33 N -2.25 2.53 0.17 12.44 -1.94 -1.26 -2.52 119.30 126.47 1ik0 s MET 33 Ca 0.56 -0.86 0.05 0.00 -1.71 0.00 0.00 55.69 53.74 1ik0 s MET 33 Cb -0.46 -2.53 -0.05 0.00 2.01 0.00 0.00 34.83 33.81 1ik0 s MET 33 CO 0.61 0.53 -0.11 0.14 -0.01 0.00 0.00 175.02 176.18 1ik0 s VAL 34 N -1.35 1.35 0.10 -6.03 -7.23 0.65 -4.85 120.40 103.04 1ik0 s VAL 34 Ca 0.26 -2.11 -0.31 0.00 -1.81 0.00 0.00 61.98 58.01 1ik0 s VAL 34 Cb -0.11 -1.91 -0.07 0.00 0.56 0.00 0.00 36.38 34.85 1ik0 s VAL 34 CO 0.18 -0.70 1.24 0.26 -0.31 0.00 0.00 175.10 175.77 1ik0 s TRP 35 N -3.22 3.39 0.66 2.82 0.52 -1.26 0.21 118.94 122.07 1ik0 s TRP 35 Ca 0.19 1.26 -0.15 0.00 0.02 0.00 0.00 56.10 57.42 1ik0 s TRP 35 Cb 0.02 -3.48 0.00 0.00 -1.15 0.00 0.00 33.47 28.86 1ik0 s TRP 35 CO 0.03 -1.50 1.10 -1.54 0.02 0.00 0.00 176.95 175.06 1ik0 s SER 36 N 0.85 5.11 0.16 2.95 1.04 -1.19 -4.86 113.70 117.75 1ik0 s SER 36 Ca 0.59 1.97 -0.00 0.00 0.48 0.00 0.00 55.95 58.98 1ik0 s SER 36 Cb -0.32 -2.55 -0.04 0.00 0.10 0.00 0.00 66.02 63.21 1ik0 s SER 36 CO 0.31 -1.63 0.05 0.27 0.98 0.00 0.00 173.24 173.23 1ik0 s ILE 37 N -2.40 0.29 -0.32 -1.02 -4.36 -1.26 -4.95 121.20 107.18 1ik0 s ILE 37 Ca 0.66 -1.94 -0.21 0.00 -0.26 0.00 0.00 60.65 58.90 1ik0 s ILE 37 Cb -0.20 -2.14 -0.00 0.00 1.25 0.00 0.00 42.46 41.36 1ik0 s ILE 37 CO 0.42 -0.40 0.67 0.21 0.24 0.00 0.00 174.94 176.08 1ik0 s ASN 38 N -3.11 6.52 -0.26 4.36 2.47 -1.26 -5.01 114.94 118.65 1ik0 s ASN 38 Ca 0.26 0.42 -0.29 0.00 0.42 0.00 0.00 52.86 53.67 1ik0 s ASN 38 Cb 0.07 -2.35 0.01 0.00 -1.45 0.00 0.00 41.25 37.53 1ik0 s ASN 38 CO 0.04 -0.53 1.15 -0.76 -3.72 0.00 0.00 177.10 173.27 1ik0 s LEU 39 N 2.71 4.03 0.00 3.21 2.01 -1.26 -4.84 118.68 124.54 1ik0 s LEU 39 Ca 0.27 1.31 0.00 0.00 0.01 0.00 0.00 54.13 55.72 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 0.13 -0.83 0.00 0.35 1.01 0.00 0.00 176.35 177.01 1ik0 n THR 40 N 5.66 0.00 0.00 5.49 -2.24 -1.26 -5.06 114.28 116.87 1ik0 n THR 40 Ca 0.13 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.88 1ik0 n THR 40 Cb 0.46 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.68 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 2.25 -0.18 6.98 0.00 -1.26 -4.65 120.51 120.65 1ik0 n ALA 41 Ca 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1ik0 n ALA 41 Cb 0.00 0.16 0.00 0.00 0.00 0.00 0.00 19.45 19.61 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 2.80 1.56 0.37 0.00 0.00 -1.26 -4.24 105.19 104.42 1ik0 n GLY 42 Ca -0.05 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.95 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 2.15 1.29 -0.50 1.61 0.00 -1.90 -0.84 114.93 116.75 1ik0 h MET 43 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 59.70 59.60 1ik0 h MET 43 Cb 0.56 -0.28 -0.02 0.00 0.00 0.00 0.00 31.60 31.86 1ik0 h MET 43 CO 0.00 0.89 0.33 1.88 0.00 0.00 0.00 176.91 180.01 1ik0 h TYR 44 N 1.32 0.64 0.08 -0.22 -1.99 -1.94 0.85 116.97 115.70 1ik0 h TYR 44 Ca 0.35 0.01 -0.00 0.00 2.00 0.00 0.00 58.73 61.09 1ik0 h TYR 44 Cb -0.09 -0.21 0.00 0.00 2.00 0.00 0.00 36.73 38.42 1ik0 h TYR 44 CO 0.00 0.40 -0.04 0.00 -0.00 0.00 0.00 178.16 178.53 1ik0 h ALA 46 N 0.38 0.28 -0.88 0.00 0.00 -1.00 -2.63 119.26 115.41 1ik0 h ALA 46 Ca -0.01 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1ik0 h ALA 46 Cb 0.43 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1ik0 h ALA 46 CO 0.02 -0.22 0.47 0.00 0.00 0.00 0.00 179.25 179.51 1ik0 h ALA 47 N 1.05 1.16 0.00 0.00 0.00 0.72 -2.75 119.26 119.45 1ik0 h ALA 47 Ca 0.08 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ik0 h ALA 47 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 17.79 17.44 1ik0 h ALA 47 CO -0.02 0.66 -0.00 1.25 0.00 0.00 0.00 179.25 181.15 1ik0 h LEU 48 N 1.24 -0.00 -1.01 0.00 5.85 -0.76 -1.30 115.31 119.32 1ik0 h LEU 48 Ca 0.31 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.04 1ik0 h LEU 48 Cb 0.05 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 1ik0 h LEU 48 CO -0.05 -0.00 0.67 1.05 -0.34 0.00 0.00 178.44 179.77 1ik0 h GLU 49 N -0.00 1.33 -0.81 1.25 4.11 -1.35 0.16 114.58 119.25 1ik0 h GLU 49 Ca -0.00 -0.08 -0.04 0.00 0.07 0.00 0.00 59.36 59.31 1ik0 h GLU 49 Cb 0.00 -0.30 -0.04 0.00 0.50 0.00 0.00 28.75 28.92 1ik0 h GLU 49 CO 0.00 0.88 0.34 0.77 0.07 0.00 0.00 179.01 181.07 1ik0 h SER 50 N 1.37 1.11 -0.17 3.06 0.02 -1.18 -2.69 113.55 115.07 1ik0 h SER 50 Ca 0.37 -0.17 -0.15 0.00 -0.84 0.00 0.00 61.79 61.00 1ik0 h SER 50 Cb -0.16 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.09 1ik0 h SER 50 CO -0.08 0.97 -0.43 -0.07 -1.14 0.00 0.00 176.83 176.08 1ik0 h LEU 51 N 1.18 0.77 -0.26 5.07 3.38 -0.46 -2.68 115.31 122.31 1ik0 h LEU 51 Ca 0.27 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1ik0 h LEU 51 Cb 0.20 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.73 1ik0 h LEU 51 CO -0.02 1.09 0.21 -0.38 0.09 0.00 0.00 178.44 179.43 1ik0 n ILE 52 N -4.03 1.10 0.34 1.22 2.08 -0.03 0.19 119.36 120.23 1ik0 n ILE 52 Ca -0.02 0.57 0.12 0.00 0.56 0.00 0.00 62.75 63.98 1ik0 n ILE 52 Cb 0.55 -1.57 0.13 0.00 -0.75 0.00 0.00 39.64 38.00 1ik0 n ILE 52 CO 0.00 0.00 0.00 0.78 0.56 0.00 0.00 176.55 177.89 1ik0 h ASN 53 N 0.00 0.00 -3.64 4.38 2.35 -1.53 -3.44 115.58 113.71 1ik0 h ASN 53 Ca 0.00 -0.07 -0.63 0.00 -0.55 0.00 0.00 56.30 55.05 1ik0 h ASN 53 Cb 0.41 0.00 -0.14 0.00 0.05 0.00 0.00 38.32 38.64 1ik0 h ASN 53 CO 0.00 0.04 -0.10 -0.69 -1.65 0.00 0.00 177.43 175.03 1ik0 s VAL 54 N -3.24 5.10 0.06 2.81 1.01 0.50 -5.06 120.40 121.58 1ik0 s VAL 54 Ca 0.04 0.68 0.06 0.00 0.00 0.00 0.00 61.98 62.76 1ik0 s VAL 54 Cb 0.10 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.65 1ik0 s VAL 54 CO 0.72 0.06 -0.16 -0.44 0.00 0.00 0.00 175.10 175.28 1ik0 s SER 55 N 1.61 1.93 0.00 3.32 0.01 -1.26 -4.73 113.70 114.58 1ik0 s SER 55 Ca 0.19 -0.57 0.00 0.00 1.31 0.00 0.00 55.95 56.88 1ik0 s SER 55 Cb -0.16 -0.10 0.00 0.00 0.21 0.00 0.00 66.02 65.97 1ik0 s SER 55 CO 0.10 0.01 0.00 0.61 0.41 0.00 0.00 173.24 174.37 1ik0 n GLY 56 N 1.51 0.50 3.33 3.44 0.00 -1.26 -5.01 105.19 107.70 1ik0 n GLY 56 Ca -0.19 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.36 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 7.74 0.85 0.00 0.00 0.87 -1.96 -2.18 113.55 118.87 1ik0 h SER 58 Ca 0.11 -0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.61 1ik0 h SER 58 Cb 1.03 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 1ik0 h SER 58 CO 0.76 0.68 0.51 0.00 -0.53 0.00 0.00 176.83 178.25 1ik0 h ALA 59 N 1.46 1.49 0.00 6.23 0.00 -1.95 0.98 119.26 127.48 1ik0 h ALA 59 Ca 0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1ik0 h ALA 59 Cb 0.01 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ik0 h ALA 59 CO -0.04 -0.49 0.00 0.44 0.00 0.00 0.00 179.25 179.16 1ik0 n ILE 60 N -2.65 0.00 -0.29 0.00 -5.35 -0.87 -4.71 119.36 105.49 1ik0 n ILE 60 Ca -0.01 -0.37 -0.04 0.00 -0.27 0.00 0.00 62.75 62.05 1ik0 n ILE 60 Cb 0.54 1.18 0.07 0.00 -1.74 0.00 0.00 39.64 39.69 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 0.00 1.05 -0.74 6.28 4.81 -0.22 -1.04 114.58 124.72 1ik0 h GLU 61 Ca 0.00 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.13 1ik0 h GLU 61 Cb 0.09 -0.24 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1ik0 h GLU 61 CO 0.00 0.69 0.30 0.87 -0.73 0.00 0.00 179.01 180.14 1ik0 h LYS 62 N 1.08 1.10 -0.93 1.92 1.57 -1.84 -2.38 116.57 117.08 1ik0 h LYS 62 Ca 0.29 -0.19 0.02 0.00 -1.87 0.00 0.00 60.65 58.90 1ik0 h LYS 62 Cb -0.13 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 31.95 1ik0 h LYS 62 CO -0.06 0.89 0.61 1.15 -0.57 0.00 0.00 179.45 181.47 1ik0 h THR 63 N 1.07 1.20 -1.01 -0.16 2.02 -1.51 -1.73 112.91 112.79 1ik0 h THR 63 Ca 0.25 -0.42 0.01 0.00 0.77 0.00 0.00 66.41 67.02 1ik0 h THR 63 Cb 0.20 -0.12 -0.05 0.00 -1.74 0.00 0.00 68.15 66.44 1ik0 h THR 63 CO -0.02 0.22 0.67 1.56 0.37 0.00 0.00 175.52 178.32 1ik0 h GLN 64 N 1.22 1.33 -0.45 6.66 4.20 -0.79 0.30 115.11 127.57 1ik0 h GLN 64 Ca 0.35 -0.08 -0.05 0.00 0.06 0.00 0.00 58.65 58.93 1ik0 h GLN 64 Cb -0.07 -0.30 -0.02 0.00 0.30 0.00 0.00 27.48 27.39 1ik0 h GLN 64 CO -0.09 0.88 0.07 0.00 -0.67 0.00 0.00 178.83 179.02 1ik0 h ARG 65 N 1.37 0.75 -0.65 1.46 3.08 -1.26 -2.42 114.38 116.71 1ik0 h ARG 65 Ca 0.37 -0.20 -0.09 0.00 0.07 0.00 0.00 59.98 60.13 1ik0 h ARG 65 Cb -0.16 -0.09 -0.02 0.00 0.08 0.00 0.00 29.97 29.78 1ik0 h ARG 65 CO -0.08 0.77 0.07 0.52 -1.07 0.00 0.00 179.97 180.18 1ik0 h MET 66 N 0.61 1.11 -0.94 0.04 2.86 -0.85 -2.83 114.93 114.93 1ik0 h MET 66 Ca 0.14 -0.32 -0.01 0.00 -2.06 0.00 0.00 59.70 57.45 1ik0 h MET 66 Cb 0.39 -0.12 -0.04 0.00 0.06 0.00 0.00 31.60 31.88 1ik0 h MET 66 CO 0.01 1.04 0.55 -0.07 1.06 0.00 0.00 176.91 179.50 1ik0 h LEU 67 N 1.03 1.14 -1.09 1.22 3.38 -0.80 -2.05 115.31 118.14 1ik0 h LEU 67 Ca 0.19 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 58.11 1ik0 h LEU 67 Cb 0.49 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.91 1ik0 h LEU 67 CO 0.02 0.88 0.62 0.28 0.09 0.00 0.00 178.44 180.33 1ik0 h SER 68 N 1.30 1.05 -1.02 -0.43 0.02 -1.20 -0.53 113.55 112.74 1ik0 h SER 68 Ca 0.33 -0.02 0.29 0.00 -0.84 0.00 0.00 61.79 61.56 1ik0 h SER 68 Cb -0.03 -0.25 -0.04 0.00 0.14 0.00 0.00 62.40 62.22 1ik0 h SER 68 CO -0.06 0.74 0.73 1.23 -1.14 0.00 0.00 176.83 178.33 1ik0 h GLY 69 N 1.23 0.03 0.55 -3.77 0.00 -1.22 0.78 103.07 100.67 1ik0 h GLY 69 Ca 0.36 -0.01 0.00 0.00 0.00 0.00 0.00 47.33 47.68 1ik0 h GLY 69 CO -0.09 -0.00 -1.24 0.69 0.00 0.00 0.00 176.54 175.89 1ik0 n PHE 70 N -4.24 0.38 -3.59 5.60 3.72 -0.28 -4.72 117.46 114.33 1ik0 n PHE 70 Ca 0.21 0.11 -0.29 0.00 -0.05 0.00 0.00 57.45 57.43 1ik0 n PHE 70 Cb 1.08 -0.57 -0.14 0.00 -0.94 0.00 0.00 39.48 38.91 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 4.37 0.08 -2.95 0.00 -0.02 -1.13 -4.46 135.00 130.88 1ik0 n PRO 72 Ca 0.04 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.09 1ik0 n PRO 72 Cb 0.39 -1.46 -0.04 0.00 -0.02 0.00 0.00 33.50 32.36 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 1.59 2.82 -1.39 6.00 2.46 -1.26 -4.94 115.29 120.56 1ik0 s HIS 73 Ca 0.00 -0.55 -0.16 0.00 0.47 0.00 0.00 55.06 54.83 1ik0 s HIS 73 Cb 0.00 -4.09 0.05 0.00 -0.13 0.00 0.00 32.58 28.41 1ik0 s HIS 73 CO 0.00 -1.44 2.03 1.63 -2.47 0.00 0.00 174.74 174.50 1ik0 n LYS 74 N 7.15 2.95 -3.36 2.88 5.02 -1.26 -4.91 118.16 126.63 1ik0 n LYS 74 Ca -0.05 -2.85 -0.39 0.00 -2.02 0.00 0.00 58.31 53.00 1ik0 n LYS 74 Cb 0.45 -3.37 -0.09 0.00 -0.02 0.00 0.00 35.03 32.00 1ik0 n LYS 74 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1ik0 s VAL 75 N 3.70 5.15 0.53 -0.18 0.11 -1.26 -5.04 120.40 123.41 1ik0 s VAL 75 Ca 0.50 0.64 0.02 0.00 -2.93 0.00 0.00 61.98 60.21 1ik0 s VAL 75 Cb 0.10 -3.72 0.03 0.00 -1.53 0.00 0.00 36.38 31.26 1ik0 s VAL 75 CO -0.02 0.15 0.74 -0.94 -3.33 0.00 0.00 175.10 171.70 1ik0 s SER 76 N 1.60 5.33 0.14 3.54 1.04 -1.26 -4.91 113.70 119.17 1ik0 s SER 76 Ca 0.16 -0.08 0.11 0.00 0.48 0.00 0.00 55.95 56.62 1ik0 s SER 76 Cb -0.16 -0.83 0.55 0.00 0.10 0.00 0.00 66.02 65.68 1ik0 s SER 76 CO 0.10 -1.09 1.33 0.00 0.98 0.00 0.00 173.24 174.56 1ik0 n ALA 77 N -2.27 1.11 -0.01 5.32 0.00 -1.26 -1.33 120.51 122.08 1ik0 n ALA 77 Ca 0.08 0.08 -0.14 0.00 0.00 0.00 0.00 53.44 53.45 1ik0 n ALA 77 Cb 0.60 -1.16 -0.14 0.00 0.00 0.00 0.00 19.45 18.75 1ik0 n ALA 77 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ik0 h GLY 78 N 0.33 0.14 -5.48 0.00 0.00 -1.97 -3.46 103.07 92.62 1ik0 h GLY 78 Ca 0.00 -0.36 -0.59 0.00 0.00 0.00 0.00 47.33 46.38 1ik0 h GLY 78 CO 0.00 0.31 -0.22 1.20 0.00 0.00 0.00 176.54 177.83 1ik0 s GLN 79 N -2.58 4.17 0.06 4.80 -1.52 -0.44 -5.08 119.66 119.07 1ik0 s GLN 79 Ca -0.12 0.32 0.05 0.00 -1.95 0.00 0.00 55.36 53.66 1ik0 s GLN 79 Cb 0.07 -3.36 -0.03 0.00 -0.22 0.00 0.00 33.01 29.47 1ik0 s GLN 79 CO 0.80 0.35 -0.14 -0.06 -0.25 0.00 0.00 175.29 176.00 1ik0 s PHE 80 N 0.04 1.19 0.08 0.91 0.08 -1.26 -4.23 117.98 114.79 1ik0 s PHE 80 Ca 0.22 -0.44 0.00 0.00 0.12 0.00 0.00 56.93 56.83 1ik0 s PHE 80 Cb -0.15 -0.68 0.00 0.00 -0.57 0.00 0.00 43.02 41.62 1ik0 s PHE 80 CO 0.09 0.05 0.00 0.43 -0.10 0.00 0.00 175.22 175.69 1ik0 n SER 81 N 1.41 0.65 -0.39 1.36 7.64 -1.26 -4.84 113.62 118.19 1ik0 n SER 81 Ca -0.21 0.12 0.12 0.00 1.01 0.00 0.00 58.87 59.92 1ik0 n SER 81 Cb 0.54 -0.17 0.23 0.00 -1.01 0.00 0.00 64.21 63.80 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 -3.32 1.54 -1.22 6.43 2.88 -1.26 -4.21 113.62 114.46 1ik0 n SER 82 Ca 0.00 -1.23 -0.04 0.00 -1.33 0.00 0.00 58.87 56.27 1ik0 n SER 82 Cb 0.15 0.25 0.04 0.00 -0.75 0.00 0.00 64.21 63.90 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 -0.26 3.62 0.04 2.46 4.32 -1.26 -4.04 117.00 121.89 1ik0 n LEU 83 Ca 0.12 -1.86 -0.20 0.00 -0.02 0.00 0.00 56.01 54.05 1ik0 n LEU 83 Cb 0.41 -0.57 -0.11 0.00 -1.62 0.00 0.00 43.42 41.53 1ik0 n LEU 83 CO 0.26 0.59 0.08 0.45 -1.22 0.00 0.00 177.39 177.55 1ik0 h HIS 84 N 0.27 0.97 -4.03 -1.77 3.86 -1.94 -3.44 115.15 109.06 1ik0 h HIS 84 Ca 0.12 -0.54 -0.48 0.00 -1.16 0.00 0.00 60.37 58.31 1ik0 h HIS 84 Cb 1.34 -0.11 0.03 0.00 1.06 0.00 0.00 27.41 29.73 1ik0 h HIS 84 CO 0.33 1.38 0.40 0.14 0.86 0.00 0.00 177.93 181.04 1ik0 s VAL 85 N -3.24 3.71 -1.26 2.45 -7.23 -1.26 -4.94 120.40 108.63 1ik0 s VAL 85 Ca -0.10 1.15 -0.09 0.00 -1.81 0.00 0.00 61.98 61.12 1ik0 s VAL 85 Cb 0.06 -3.52 0.18 0.00 0.56 0.00 0.00 36.38 33.66 1ik0 s VAL 85 CO 0.91 -0.14 1.82 0.54 -0.31 0.00 0.00 175.10 177.91 1ik0 n ARG 86 N -0.66 3.66 -2.16 4.82 1.74 -1.26 -4.98 116.66 117.81 1ik0 n ARG 86 Ca 0.08 -3.61 -0.27 0.00 -0.77 0.00 0.00 57.85 53.27 1ik0 n ARG 86 Cb 0.51 -2.91 0.13 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 0.85 3.99 0.36 0.55 1.01 -1.26 -5.08 116.67 117.09 1ik0 s ASP 87 Ca 0.39 0.21 0.00 0.00 0.71 0.00 0.00 52.55 53.86 1ik0 s ASP 87 Cb 0.08 -0.54 -0.03 0.00 1.01 0.00 0.00 42.92 43.44 1ik0 s ASP 87 CO 0.01 -2.14 0.56 0.42 0.21 0.00 0.00 175.17 174.23 1ik0 s THR 88 N -3.51 5.07 0.49 -1.27 -4.23 -1.26 -4.91 115.64 106.03 1ik0 s THR 88 Ca 0.67 -0.43 -0.07 0.00 -1.18 0.00 0.00 61.69 60.68 1ik0 s THR 88 Cb -0.07 -3.85 -0.04 0.00 1.34 0.00 0.00 72.50 69.88 1ik0 s THR 88 CO 0.48 -0.57 0.83 -0.54 -0.54 0.00 0.00 174.62 174.28 1ik0 s LYS 89 N -4.34 3.59 0.13 3.99 1.02 -1.26 -3.16 119.74 119.71 1ik0 s LYS 89 Ca 0.40 0.34 0.03 0.00 0.02 0.00 0.00 55.97 56.77 1ik0 s LYS 89 Cb -0.10 -2.33 -0.04 0.00 -0.52 0.00 0.00 37.83 34.84 1ik0 s LYS 89 CO 0.36 -0.24 -0.08 0.96 -0.92 0.00 0.00 175.35 175.44 1ik0 s ILE 90 N -2.76 0.94 0.46 2.17 -4.36 0.13 -4.85 121.20 112.94 1ik0 s ILE 90 Ca 0.49 -2.01 -0.24 0.00 -0.26 0.00 0.00 60.65 58.64 1ik0 s ILE 90 Cb -0.10 -1.82 -0.07 0.00 1.25 0.00 0.00 42.46 41.72 1ik0 s ILE 90 CO 0.44 -0.76 1.28 -1.61 0.24 0.00 0.00 174.94 174.53 1ik0 s GLU 91 N -3.80 3.66 0.25 0.37 2.02 -1.26 -0.26 118.70 119.68 1ik0 s GLU 91 Ca 0.16 2.07 -0.05 0.00 0.02 0.00 0.00 54.97 57.16 1ik0 s GLU 91 Cb 0.04 -2.50 0.31 0.00 0.10 0.00 0.00 34.13 32.08 1ik0 s GLU 91 CO -0.01 -0.72 1.90 0.28 0.02 0.00 0.00 175.26 176.73 1ik0 h VAL 92 N 1.98 1.18 -1.00 2.63 2.07 -1.83 -0.78 116.25 120.49 1ik0 h VAL 92 Ca -0.50 -0.43 0.12 0.00 0.82 0.00 0.00 66.70 66.71 1ik0 h VAL 92 Cb 1.26 -0.18 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 1ik0 h VAL 92 CO 0.60 0.23 0.63 0.00 0.02 0.00 0.00 177.57 179.05 1ik0 h ALA 93 N 1.40 1.52 -0.11 1.67 0.00 -1.90 0.24 119.26 122.07 1ik0 h ALA 93 Ca 0.39 0.02 -0.20 0.00 0.00 0.00 0.00 54.91 55.12 1ik0 h ALA 93 Cb -0.01 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.56 1ik0 h ALA 93 CO -0.12 0.23 -0.74 1.96 0.00 0.00 0.00 179.25 180.59 1ik0 h GLN 94 N 1.00 0.55 -0.01 0.00 4.20 -1.60 -2.84 115.11 116.42 1ik0 h GLN 94 Ca 0.50 -0.44 0.00 0.00 0.06 0.00 0.00 58.65 58.76 1ik0 h GLN 94 Cb 0.48 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.35 1ik0 h GLN 94 CO -0.26 1.07 0.01 0.35 -0.67 0.00 0.00 178.83 179.32 1ik0 h PHE 95 N 0.38 0.01 -0.36 2.96 3.04 0.33 -0.82 116.94 122.48 1ik0 h PHE 95 Ca -0.04 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.90 1ik0 h PHE 95 Cb 1.33 -0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.82 1ik0 h PHE 95 CO 0.06 0.01 0.15 0.28 -2.02 0.00 0.00 178.31 176.79 1ik0 h VAL 96 N 0.01 1.18 -0.09 1.41 2.07 -1.14 -1.79 116.25 117.90 1ik0 h VAL 96 Ca 0.00 -0.55 0.00 0.00 0.82 0.00 0.00 66.70 66.97 1ik0 h VAL 96 Cb 0.00 0.87 -0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1ik0 h VAL 96 CO -0.00 0.20 0.06 0.11 0.02 0.00 0.00 177.57 177.96 1ik0 h LYS 97 N 0.44 0.12 -1.01 1.57 1.57 -1.33 -0.01 116.57 117.93 1ik0 h LYS 97 Ca 0.12 -0.01 0.01 0.00 -1.87 0.00 0.00 60.65 58.91 1ik0 h LYS 97 Cb 0.17 -0.03 -0.05 0.00 0.08 0.00 0.00 32.23 32.40 1ik0 h LYS 97 CO -0.01 0.08 0.67 -0.44 -0.57 0.00 0.00 179.45 179.18 1ik0 h ASP 98 N 0.12 1.16 -0.81 0.86 3.32 -1.06 -0.97 116.42 119.04 1ik0 h ASP 98 Ca 0.03 -0.03 -0.02 0.00 0.02 0.00 0.00 57.03 57.04 1ik0 h ASP 98 Cb -0.01 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 39.21 1ik0 h ASP 98 CO -0.01 0.84 0.43 0.25 -1.72 0.00 0.00 179.24 179.03 1ik0 h LEU 99 N 1.37 1.02 -0.74 1.55 5.85 -0.81 -2.79 115.31 120.76 1ik0 h LEU 99 Ca 0.37 -0.09 0.06 0.00 0.84 0.00 0.00 57.88 59.05 1ik0 h LEU 99 Cb -0.16 -0.26 -0.06 0.00 0.37 0.00 0.00 40.66 40.56 1ik0 h LEU 99 CO -0.08 0.83 0.44 0.25 -0.34 0.00 0.00 178.44 179.55 1ik0 h LEU 100 N 1.14 0.68 -0.62 2.25 5.85 0.40 -0.31 115.31 124.70 1ik0 h LEU 100 Ca 0.29 0.02 0.01 0.00 0.84 0.00 0.00 57.88 59.03 1ik0 h LEU 100 Cb 0.05 -0.12 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1ik0 h LEU 100 CO -0.04 0.44 0.41 -0.07 -0.34 0.00 0.00 178.44 178.84 1ik0 h LEU 101 N 0.82 0.72 -0.45 2.25 -0.00 -1.31 -2.73 115.31 114.61 1ik0 h LEU 101 Ca 0.33 -0.02 -0.15 0.00 -0.00 0.00 0.00 57.88 58.03 1ik0 h LEU 101 Cb 0.16 -0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 40.63 1ik0 h LEU 101 CO -0.17 0.52 -0.37 0.45 -0.00 0.00 0.00 178.44 178.87 1ik0 h HIS 102 N 0.85 1.05 0.35 1.13 3.86 -1.40 -2.28 115.15 118.71 1ik0 h HIS 102 Ca 0.23 -0.31 -0.00 0.00 -1.16 0.00 0.00 60.37 59.13 1ik0 h HIS 102 Cb -0.10 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.13 1ik0 h HIS 102 CO -0.03 1.12 -0.31 -0.07 0.86 0.00 0.00 177.93 179.50 1ik0 h LEU 103 N 0.73 -0.82 -1.40 2.43 3.38 -0.77 -1.55 115.31 117.30 1ik0 h LEU 103 Ca 0.06 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1ik0 h LEU 103 Cb 0.95 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1ik0 h LEU 103 CO 0.09 -0.45 0.00 0.07 0.09 0.00 0.00 178.44 178.24 1ik0 h LYS 104 N -0.68 0.00 -0.01 1.13 2.10 -1.58 -3.11 116.57 114.43 1ik0 h LYS 104 Ca -0.02 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.62 1ik0 h LYS 104 Cb 0.60 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.93 1ik0 h LYS 104 CO -0.03 0.00 0.00 -0.22 -2.00 0.00 0.00 179.45 177.20 1ik0 h LYS 105 N 0.00 0.01 0.00 0.07 3.64 -0.67 -2.55 116.57 117.07 1ik0 h LYS 105 Ca 0.00 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.35 1ik0 h LYS 105 Cb 0.42 -0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.24 1ik0 h LYS 105 CO 0.00 0.19 -0.11 -0.07 -2.27 0.00 0.00 179.45 177.20 1ik0 h LEU 106 N -0.17 0.00 -0.89 5.20 -0.00 -1.41 -2.64 115.31 115.40 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 0.19 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.80 1ik0 h LEU 106 CO -0.00 0.11 0.59 0.15 -0.00 0.00 0.00 178.44 179.28 1ik0 h PHE 107 N 0.00 1.11 -0.73 1.13 3.57 -1.49 -1.01 116.94 119.52 1ik0 h PHE 107 Ca -0.00 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.51 1ik0 h PHE 107 Cb 0.25 -0.38 -0.04 0.00 2.79 0.00 0.00 35.95 38.58 1ik0 h PHE 107 CO 0.00 0.70 0.40 0.00 -2.23 0.00 0.00 178.31 177.18 1ik0 h ARG 108 N 1.20 1.01 0.00 1.11 3.08 -1.45 -1.44 114.38 117.88 1ik0 h ARG 108 Ca 0.33 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1ik0 h ARG 108 Cb -0.13 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.72 1ik0 h ARG 108 CO -0.07 0.73 -0.12 0.39 -1.07 0.00 0.00 179.97 179.83 1ik0 n GLU 109 N -4.36 0.00 -0.94 0.04 1.02 -0.82 -4.88 120.64 110.70 1ik0 n GLU 109 Ca 0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.21 1ik0 n GLU 109 Cb 0.09 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.01 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 1.50 0.12 3.37 0.62 0.00 -0.45 -4.91 105.19 105.44 1ik0 n GLY 110 Ca 0.07 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.45 3.12 0.06 1.61 0.52 -1.21 -5.03 118.95 116.57 1ik0 s ARG 111 Ca 0.00 -1.51 -0.13 0.00 -0.52 0.00 0.00 55.73 53.58 1ik0 s ARG 111 Cb 0.00 -4.33 -0.06 0.00 0.52 0.00 0.00 34.95 31.08 1ik0 s ARG 111 CO 0.00 -1.51 0.43 -0.06 0.02 0.00 0.00 175.30 174.19 1ik0 s PHE 112 N 2.31 3.65 0.00 -0.53 0.08 -1.26 -4.83 117.98 117.40 1ik0 s PHE 112 Ca 0.12 0.93 0.00 0.00 0.12 0.00 0.00 56.93 58.10 1ik0 s PHE 112 Cb -0.23 -2.26 0.00 0.00 -0.57 0.00 0.00 43.02 39.97 1ik0 s PHE 112 CO 0.03 0.55 0.00 -1.71 -0.10 0.00 0.00 175.22 174.00