#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 1.59 1.02 3.03 0.00 -1.26 -4.97 107.32 106.72 1ik0 s GLY 2 Ca 0.00 -0.28 -0.25 0.00 0.00 0.00 0.00 44.72 44.19 1ik0 s GLY 2 CO 0.00 0.28 -1.20 -1.05 0.00 0.00 0.00 173.10 171.13 1ik0 n PRO 3 N -3.99 -0.36 -2.84 2.90 -0.02 -1.26 -4.91 135.00 124.52 1ik0 n PRO 3 Ca 0.06 -0.10 -0.33 0.00 -2.02 0.00 0.00 63.50 61.10 1ik0 n PRO 3 Cb 0.57 -1.15 -0.07 0.00 -0.02 0.00 0.00 33.50 32.83 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 -2.05 4.39 1.11 -1.45 -7.23 -1.26 -5.03 120.40 108.88 1ik0 s VAL 4 Ca 0.39 1.49 -0.20 0.00 -1.81 0.00 0.00 61.98 61.86 1ik0 s VAL 4 Cb 0.06 -3.65 0.08 0.00 0.56 0.00 0.00 36.38 33.43 1ik0 s VAL 4 CO 0.64 -0.25 -0.16 -2.65 -0.31 0.00 0.00 175.10 172.37 1ik0 n PRO 5 N -0.47 -1.49 0.20 4.82 -0.02 -1.26 -4.72 135.00 132.06 1ik0 n PRO 5 Ca 0.06 -0.42 -0.09 0.00 -2.02 0.00 0.00 63.50 61.03 1ik0 n PRO 5 Cb 0.53 -1.63 -0.04 0.00 -0.02 0.00 0.00 33.50 32.35 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 -1.98 -0.54 -0.59 0.52 0.13 -2.00 -2.48 132.00 125.05 1ik0 h PRO 6 Ca -0.53 0.04 -0.02 0.00 -0.87 0.00 0.00 66.00 64.62 1ik0 h PRO 6 Cb 1.37 0.12 -0.03 0.00 0.13 0.00 0.00 31.00 32.59 1ik0 h PRO 6 CO 0.37 -0.36 0.29 0.66 -0.23 0.00 0.00 178.00 178.73 1ik0 h SER 7 N -0.99 0.74 -0.64 1.44 4.64 -1.97 -2.50 113.55 114.28 1ik0 h SER 7 Ca -0.06 -0.07 -0.09 0.00 -0.47 0.00 0.00 61.79 61.10 1ik0 h SER 7 Cb 0.43 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 62.31 1ik0 h SER 7 CO 0.09 0.63 0.04 0.74 -0.87 0.00 0.00 176.83 177.46 1ik0 h THR 8 N 0.83 1.27 -0.78 2.95 2.02 -1.93 -2.50 112.91 114.76 1ik0 h THR 8 Ca 0.21 -1.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.25 1ik0 h THR 8 Cb 0.07 0.73 -0.04 0.00 -1.74 0.00 0.00 68.15 67.18 1ik0 h THR 8 CO -0.03 0.41 0.41 0.00 0.37 0.00 0.00 175.52 176.69 1ik0 h ALA 9 N 1.01 1.01 -0.35 6.16 0.00 -1.01 -1.29 119.26 124.80 1ik0 h ALA 9 Ca 0.18 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ik0 h ALA 9 Cb 0.52 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 1ik0 h ALA 9 CO 0.03 0.54 0.20 1.25 0.00 0.00 0.00 179.25 181.26 1ik0 h LEU 10 N 1.09 0.43 -0.49 0.00 5.85 -1.23 0.21 115.31 121.16 1ik0 h LEU 10 Ca 0.27 -0.07 0.00 0.00 0.84 0.00 0.00 57.88 58.93 1ik0 h LEU 10 Cb 0.06 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 40.96 1ik0 h LEU 10 CO -0.04 0.37 0.33 0.03 -0.34 0.00 0.00 178.44 178.79 1ik0 h ARG 11 N 0.45 0.65 -0.87 1.25 3.08 -1.07 0.28 114.38 118.15 1ik0 h ARG 11 Ca 0.12 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 1ik0 h ARG 11 Cb 0.03 -0.15 -0.04 0.00 0.08 0.00 0.00 29.97 29.90 1ik0 h ARG 11 CO -0.02 0.43 0.43 0.93 -1.07 0.00 0.00 179.97 180.67 1ik0 h GLU 12 N 0.67 1.24 -0.21 0.04 5.08 -0.82 -0.73 114.58 119.85 1ik0 h GLU 12 Ca 0.18 -0.18 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 1ik0 h GLU 12 Cb -0.08 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 28.94 1ik0 h GLU 12 CO -0.04 0.94 -0.12 1.25 -1.00 0.00 0.00 179.01 180.04 1ik0 h LEU 13 N 1.23 0.46 -0.18 1.33 5.85 0.20 -2.26 115.31 121.95 1ik0 h LEU 13 Ca 0.30 -0.43 -0.00 0.00 0.84 0.00 0.00 57.88 58.59 1ik0 h LEU 13 Cb 0.10 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 40.99 1ik0 h LEU 13 CO -0.04 0.79 0.11 0.40 -0.34 0.00 0.00 178.44 179.36 1ik0 h ILE 14 N 0.14 1.07 -1.00 4.05 2.04 -0.23 -0.56 117.51 123.02 1ik0 h ILE 14 Ca 0.04 -0.16 0.01 0.00 1.00 0.00 0.00 64.86 65.75 1ik0 h ILE 14 Cb 0.63 0.85 -0.05 0.00 -0.74 0.00 0.00 36.82 37.51 1ik0 h ILE 14 CO 0.03 0.07 0.66 -0.33 0.00 0.00 0.00 178.15 178.58 1ik0 h GLU 15 N 0.22 1.31 -0.06 2.37 5.08 -1.13 0.12 114.58 122.49 1ik0 h GLU 15 Ca 0.06 -0.08 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 1ik0 h GLU 15 Cb 0.01 -0.30 0.00 0.00 0.50 0.00 0.00 28.75 28.96 1ik0 h GLU 15 CO -0.01 0.87 -0.11 1.49 -1.00 0.00 0.00 179.01 180.24 1ik0 h GLU 16 N 1.35 0.18 -0.65 2.33 4.81 -1.12 -1.38 114.58 120.10 1ik0 h GLU 16 Ca 0.37 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.47 1ik0 h GLU 16 Cb -0.16 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 29.21 1ik0 h GLU 16 CO -0.08 0.70 0.39 -0.07 -0.73 0.00 0.00 179.01 179.22 1ik0 h LEU 17 N -0.31 0.79 -0.43 1.64 3.38 -0.94 -2.03 115.31 117.41 1ik0 h LEU 17 Ca 0.00 -0.06 -0.05 0.00 0.09 0.00 0.00 57.88 57.86 1ik0 h LEU 17 Cb 0.69 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.22 1ik0 h LEU 17 CO 0.03 0.62 0.07 0.58 0.09 0.00 0.00 178.44 179.83 1ik0 h VAL 18 N 0.89 1.24 -0.40 1.22 2.07 -0.99 -1.53 116.25 118.76 1ik0 h VAL 18 Ca 0.23 -0.88 0.00 0.00 0.82 0.00 0.00 66.70 66.87 1ik0 h VAL 18 Cb -0.02 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 30.71 1ik0 h VAL 18 CO -0.04 0.31 0.26 -1.13 0.02 0.00 0.00 177.57 176.99 1ik0 h ASN 19 N 0.57 0.46 1.08 0.57 -0.00 -0.92 0.34 115.58 117.68 1ik0 h ASN 19 Ca 0.13 -0.01 0.00 0.00 -0.00 0.00 0.00 56.30 56.42 1ik0 h ASN 19 Cb 0.37 -0.11 0.00 0.00 -0.00 0.00 0.00 38.32 38.58 1ik0 h ASN 19 CO 0.01 0.34 0.00 2.30 -0.00 0.00 0.00 177.43 180.07 1ik0 n ILE 20 N -4.81 0.19 -0.02 2.57 -5.35 -0.79 -3.52 119.36 107.62 1ik0 n ILE 20 Ca 0.00 -0.05 0.08 0.00 -0.27 0.00 0.00 62.75 62.51 1ik0 n ILE 20 Cb 0.02 -0.55 -0.16 0.00 -1.74 0.00 0.00 39.64 37.21 1ik0 n ILE 20 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 1ik0 n THR 21 N -1.68 0.21 0.08 7.28 -2.24 -0.58 -3.79 114.28 113.56 1ik0 n THR 21 Ca 0.06 -0.54 -0.10 0.00 -2.27 0.00 0.00 64.05 61.20 1ik0 n THR 21 Cb 0.35 -0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.49 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 0.23 -0.12 -0.78 4.20 -0.99 -3.24 115.11 114.41 1ik0 h GLN 22 Ca -0.08 -0.26 0.00 0.00 0.06 0.00 0.00 58.65 58.36 1ik0 h GLN 22 Cb 1.16 0.08 0.00 0.00 0.30 0.00 0.00 27.48 29.02 1ik0 h GLN 22 CO 0.00 1.00 0.00 -1.71 -0.67 0.00 0.00 178.83 177.46 1ik0 n ASN 23 N -3.65 2.60 -4.70 1.46 2.85 -1.24 -4.91 115.26 107.68 1ik0 n ASN 23 Ca -0.04 -1.85 -0.42 0.00 -0.11 0.00 0.00 54.58 52.15 1ik0 n ASN 23 Cb 0.84 -0.07 -0.03 0.00 1.24 0.00 0.00 39.78 41.76 1ik0 n ASN 23 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1ik0 s GLN 24 N -1.87 4.49 0.00 1.20 -2.07 -1.22 -4.97 119.66 115.21 1ik0 s GLN 24 Ca 0.33 1.40 0.00 0.00 -1.82 0.00 0.00 55.36 55.27 1ik0 s GLN 24 Cb 0.21 -3.50 0.00 0.00 -1.09 0.00 0.00 33.01 28.62 1ik0 s GLN 24 CO 0.31 -0.18 0.00 1.17 -1.32 0.00 0.00 175.29 175.27 1ik0 n LYS 25 N 4.45 0.00 -2.19 9.60 4.81 -1.26 -4.96 118.16 128.60 1ik0 n LYS 25 Ca 0.07 0.00 -0.28 0.00 -0.87 0.00 0.00 58.31 57.23 1ik0 n LYS 25 Cb 0.50 -0.29 0.03 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 -4.42 3.16 0.21 3.14 0.00 -1.26 -4.97 121.76 117.62 1ik0 s ALA 26 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 51.96 51.19 1ik0 s ALA 26 Cb 0.00 -2.80 -0.16 0.00 0.00 0.00 0.00 23.12 20.16 1ik0 s ALA 26 CO 0.00 -0.82 0.96 -2.30 0.00 0.00 0.00 175.76 173.60 1ik0 n PRO 27 N -2.69 0.93 -0.26 0.00 -0.02 -1.26 -4.85 135.00 126.84 1ik0 n PRO 27 Ca 0.05 0.33 -0.06 0.00 -2.02 0.00 0.00 63.50 61.80 1ik0 n PRO 27 Cb 0.57 -1.67 0.05 0.00 -0.02 0.00 0.00 33.50 32.43 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 2.32 0.96-10.45 2.45 3.38 -1.97 -3.43 115.31 108.57 1ik0 h LEU 28 Ca -0.39 -0.14 -0.48 0.00 0.09 0.00 0.00 57.88 56.96 1ik0 h LEU 28 Cb 1.37 -0.25 0.06 0.00 0.09 0.00 0.00 40.66 41.94 1ik0 h LEU 28 CO 0.63 0.83 0.27 0.00 0.09 0.00 0.00 178.44 180.27 1ik0 n ASN 30 N -2.75 1.75 -0.01 0.00 3.02 -1.26 -4.20 115.26 111.81 1ik0 n ASN 30 Ca 0.05 -1.64 -0.00 0.00 -0.03 0.00 0.00 54.58 52.96 1ik0 n ASN 30 Cb 0.57 -0.42 -0.00 0.00 -0.61 0.00 0.00 39.78 39.32 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 2.33 0.38 3.75 7.41 0.00 -1.26 -5.00 105.19 112.80 1ik0 n GLY 31 Ca 0.07 -1.08 -0.38 0.00 0.00 0.00 0.00 46.02 44.63 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 -3.00 5.35 0.20 1.61 0.01 -1.26 -4.90 113.70 111.71 1ik0 s SER 32 Ca 0.00 2.61 0.11 0.00 1.31 0.00 0.00 55.95 59.97 1ik0 s SER 32 Cb 0.00 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.56 1ik0 s SER 32 CO 0.00 -1.50 -0.19 -0.04 0.41 0.00 0.00 173.24 171.92 1ik0 s MET 33 N -2.99 1.71 0.17 12.44 -1.94 -1.26 -2.56 119.30 124.87 1ik0 s MET 33 Ca 0.72 -1.46 0.05 0.00 -1.71 0.00 0.00 55.69 53.30 1ik0 s MET 33 Cb -0.36 -1.95 -0.05 0.00 2.01 0.00 0.00 34.83 34.49 1ik0 s MET 33 CO 0.42 0.41 -0.11 0.14 -0.01 0.00 0.00 175.02 175.86 1ik0 s VAL 34 N -1.74 1.34 0.12 -6.03 -7.23 0.60 -4.85 120.40 102.62 1ik0 s VAL 34 Ca 0.23 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 57.99 1ik0 s VAL 34 Cb -0.08 -1.92 -0.07 0.00 0.56 0.00 0.00 36.38 34.87 1ik0 s VAL 34 CO 0.12 -0.70 1.23 0.26 -0.31 0.00 0.00 175.10 175.70 1ik0 s TRP 35 N -3.22 3.40 0.33 2.82 0.52 -1.26 -0.30 118.94 121.23 1ik0 s TRP 35 Ca 0.19 1.30 -0.28 0.00 0.02 0.00 0.00 56.10 57.32 1ik0 s TRP 35 Cb 0.02 -3.47 -0.09 0.00 -1.15 0.00 0.00 33.47 28.77 1ik0 s TRP 35 CO 0.03 -1.43 1.17 0.45 0.02 0.00 0.00 176.95 177.19 1ik0 s SER 36 N 0.66 6.90 0.21 2.95 0.15 -1.18 -4.89 113.70 118.51 1ik0 s SER 36 Ca 0.57 2.40 0.04 0.00 0.70 0.00 0.00 55.95 59.65 1ik0 s SER 36 Cb -0.32 -2.63 -0.05 0.00 -1.71 0.00 0.00 66.02 61.31 1ik0 s SER 36 CO 0.33 -0.41 -0.03 0.27 1.20 0.00 0.00 173.24 174.59 1ik0 s ILE 37 N -1.25 1.08 -0.18 6.45 -4.36 -1.26 -4.86 121.20 116.82 1ik0 s ILE 37 Ca 0.50 -2.04 -0.22 0.00 -0.26 0.00 0.00 60.65 58.62 1ik0 s ILE 37 Cb -0.33 -2.21 -0.02 0.00 1.25 0.00 0.00 42.46 41.15 1ik0 s ILE 37 CO 0.43 -0.44 0.69 0.20 0.24 0.00 0.00 174.94 176.06 1ik0 s ASN 38 N -3.27 6.78 -0.35 4.36 0.01 -1.26 -5.01 114.94 116.20 1ik0 s ASN 38 Ca 0.25 0.95 -0.28 0.00 -0.71 0.00 0.00 52.86 53.07 1ik0 s ASN 38 Cb 0.05 -2.38 0.02 0.00 0.41 0.00 0.00 41.25 39.34 1ik0 s ASN 38 CO 0.06 -0.30 1.06 -0.76 -1.51 0.00 0.00 177.10 175.65 1ik0 s LEU 39 N 1.93 3.90 0.00 0.60 2.01 -1.26 -4.84 118.68 121.02 1ik0 s LEU 39 Ca 0.32 0.88 0.00 0.00 0.01 0.00 0.00 54.13 55.34 1ik0 s LEU 39 Cb -0.16 -3.49 0.00 0.00 0.01 0.00 0.00 46.19 42.55 1ik0 s LEU 39 CO 0.11 -0.93 0.00 0.35 1.01 0.00 0.00 176.35 176.89 1ik0 n THR 40 N 6.03 0.00 0.00 5.49 -2.24 -1.26 -5.04 114.28 117.26 1ik0 n THR 40 Ca 0.11 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.89 1ik0 n THR 40 Cb 0.48 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.71 1ik0 n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ik0 n ALA 41 N -3.00 0.00 -0.24 6.98 0.00 -1.26 -4.39 120.51 118.61 1ik0 n ALA 41 Ca 0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 53.44 53.41 1ik0 n ALA 41 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 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 2.43 1.40 0.04 0.00 0.00 -1.26 -4.35 105.19 103.45 1ik0 n GLY 42 Ca 0.00 -0.22 -0.12 0.00 0.00 0.00 0.00 46.02 45.68 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 4.40 -0.01 -0.73 1.61 0.00 -1.89 0.74 114.93 119.05 1ik0 h MET 43 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.74 1ik0 h MET 43 Cb 0.39 0.00 -0.04 0.00 0.00 0.00 0.00 31.60 31.95 1ik0 h MET 43 CO 0.27 -0.01 0.47 1.88 0.00 0.00 0.00 176.91 179.52 1ik0 h TYR 44 N -0.01 0.93 0.32 -0.22 0.05 -1.93 0.66 116.97 116.77 1ik0 h TYR 44 Ca -0.00 0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.78 1ik0 h TYR 44 Cb 0.01 -0.31 0.00 0.00 1.01 0.00 0.00 36.73 37.44 1ik0 h TYR 44 CO -0.08 0.61 -0.16 0.00 -1.05 0.00 0.00 178.16 177.48 1ik0 h ALA 46 N -0.07 0.29 -0.86 0.00 0.00 -0.68 -2.69 119.26 115.25 1ik0 h ALA 46 Ca -0.04 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1ik0 h ALA 46 Cb 0.47 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 18.13 1ik0 h ALA 46 CO 0.07 -0.18 0.47 0.00 0.00 0.00 0.00 179.25 179.61 1ik0 h ALA 47 N 1.01 1.21 0.00 0.00 0.00 0.34 -2.80 119.26 119.02 1ik0 h ALA 47 Ca 0.08 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.86 1ik0 h ALA 47 Cb 0.07 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1ik0 h ALA 47 CO -0.01 0.64 -0.00 1.25 0.00 0.00 0.00 179.25 181.12 1ik0 h LEU 48 N 1.20 -0.00 -1.17 0.00 5.85 -0.49 -2.51 115.31 118.19 1ik0 h LEU 48 Ca 0.30 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 59.03 1ik0 h LEU 48 Cb 0.03 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.01 1ik0 h LEU 48 CO -0.05 -0.00 0.56 1.05 -0.34 0.00 0.00 178.44 179.66 1ik0 h GLU 49 N -0.01 1.11 -1.00 1.25 4.11 -1.36 -1.85 114.58 116.84 1ik0 h GLU 49 Ca -0.00 -0.07 0.01 0.00 0.07 0.00 0.00 59.36 59.37 1ik0 h GLU 49 Cb 0.00 -0.25 -0.05 0.00 0.50 0.00 0.00 28.75 28.95 1ik0 h GLU 49 CO 0.00 0.74 0.66 0.77 0.07 0.00 0.00 179.01 181.25 1ik0 h SER 50 N 1.15 1.15 0.02 3.06 0.02 -1.21 -2.12 113.55 115.62 1ik0 h SER 50 Ca 0.31 -0.03 -0.14 0.00 -0.84 0.00 0.00 61.79 61.09 1ik0 h SER 50 Cb -0.12 -0.29 -0.01 0.00 0.14 0.00 0.00 62.40 62.12 1ik0 h SER 50 CO -0.07 0.84 -0.45 -0.07 -1.14 0.00 0.00 176.83 175.94 1ik0 h LEU 51 N 1.36 0.54 -1.03 5.07 3.38 -0.96 -2.73 115.31 120.94 1ik0 h LEU 51 Ca 0.37 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1ik0 h LEU 51 Cb -0.15 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.45 1ik0 h LEU 51 CO -0.08 0.92 0.26 0.40 0.09 0.00 0.00 178.44 180.02 1ik0 h ILE 52 N 0.41 0.00 0.00 1.22 1.08 -0.64 1.11 117.51 120.69 1ik0 h ILE 52 Ca 0.03 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.50 1ik0 h ILE 52 Cb 0.94 0.34 0.00 0.00 -3.07 0.00 0.00 36.82 35.04 1ik0 h ILE 52 CO 0.08 0.00 -0.32 0.59 -0.69 0.00 0.00 178.15 177.82 1ik0 n ASN 53 N -2.14 0.64 -4.66 1.72 3.02 -1.03 -4.75 115.26 108.06 1ik0 n ASN 53 Ca -0.01 0.29 -0.38 0.00 -0.03 0.00 0.00 54.58 54.44 1ik0 n ASN 53 Cb 0.28 -0.25 -0.07 0.00 -0.61 0.00 0.00 39.78 39.13 1ik0 n ASN 53 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1ik0 s VAL 54 N -3.11 5.18 0.12 2.41 1.01 0.38 -5.06 120.40 121.34 1ik0 s VAL 54 Ca 0.09 0.73 0.06 0.00 0.00 0.00 0.00 61.98 62.86 1ik0 s VAL 54 Cb 0.14 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 1ik0 s VAL 54 CO 0.65 0.23 -0.14 -0.44 0.00 0.00 0.00 175.10 175.40 1ik0 s SER 55 N 1.11 1.97 0.00 3.32 0.01 -1.26 -4.74 113.70 114.10 1ik0 s SER 55 Ca 0.19 -0.79 0.00 0.00 1.31 0.00 0.00 55.95 56.67 1ik0 s SER 55 Cb -0.15 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.01 1ik0 s SER 55 CO 0.08 -0.13 0.00 0.61 0.41 0.00 0.00 173.24 174.21 1ik0 n GLY 56 N 0.63 1.09 3.31 3.44 0.00 -1.26 -5.00 105.19 107.41 1ik0 n GLY 56 Ca -0.16 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.40 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 8.12 0.82 -0.43 0.00 0.87 -1.97 -3.09 113.55 117.86 1ik0 h SER 58 Ca -0.04 -0.39 0.13 0.00 -1.23 0.00 0.00 61.79 60.26 1ik0 h SER 58 Cb 1.06 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 62.77 1ik0 h SER 58 CO 0.84 1.13 0.51 0.00 -0.53 0.00 0.00 176.83 178.79 1ik0 h ALA 59 N 0.90 2.13 -0.02 6.23 0.00 -1.98 0.79 119.26 127.32 1ik0 h ALA 59 Ca 0.04 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ik0 h ALA 59 Cb 0.99 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1ik0 h ALA 59 CO 0.09 -0.73 -0.33 0.44 0.00 0.00 0.00 179.25 178.72 1ik0 n ILE 60 N -3.60 0.00 -0.30 0.00 -5.35 -1.17 -4.39 119.36 104.54 1ik0 n ILE 60 Ca 0.08 -0.34 -0.04 0.00 -0.27 0.00 0.00 62.75 62.19 1ik0 n ILE 60 Cb 0.69 1.28 0.08 0.00 -1.74 0.00 0.00 39.64 39.94 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 2.62 1.09 -0.93 6.28 5.08 -0.87 -0.65 114.58 127.21 1ik0 h GLU 61 Ca 0.00 -0.07 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1ik0 h GLU 61 Cb 0.72 -0.25 -0.05 0.00 0.50 0.00 0.00 28.75 29.68 1ik0 h GLU 61 CO 0.00 0.72 0.60 0.87 -1.00 0.00 0.00 179.01 180.20 1ik0 h LYS 62 N 1.12 1.23 -0.86 2.33 1.57 -1.77 -1.21 116.57 118.98 1ik0 h LYS 62 Ca 0.30 -0.08 0.01 0.00 -1.87 0.00 0.00 60.65 59.01 1ik0 h LYS 62 Cb -0.13 -0.27 -0.04 0.00 0.08 0.00 0.00 32.23 31.86 1ik0 h LYS 62 CO -0.07 0.83 0.57 1.15 -0.57 0.00 0.00 179.45 181.36 1ik0 h THR 63 N 1.27 1.21 -0.79 -0.16 2.02 -1.40 -2.03 112.91 113.04 1ik0 h THR 63 Ca 0.34 -0.40 0.01 0.00 0.77 0.00 0.00 66.41 67.13 1ik0 h THR 63 Cb -0.13 -0.05 -0.04 0.00 -1.74 0.00 0.00 68.15 66.20 1ik0 h THR 63 CO -0.07 0.21 0.52 1.56 0.37 0.00 0.00 175.52 178.11 1ik0 h GLN 64 N 1.16 1.02 -0.30 6.66 1.08 -0.31 -0.28 115.11 124.14 1ik0 h GLN 64 Ca 0.32 -0.06 -0.01 0.00 -1.45 0.00 0.00 58.65 57.45 1ik0 h GLN 64 Cb -0.12 -0.23 -0.01 0.00 -0.05 0.00 0.00 27.48 27.07 1ik0 h GLN 64 CO -0.07 0.67 0.15 0.00 -0.95 0.00 0.00 178.83 178.63 1ik0 h ARG 65 N 1.05 0.43 -0.77 1.46 3.08 -1.17 -2.20 114.38 116.25 1ik0 h ARG 65 Ca 0.29 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 60.23 1ik0 h ARG 65 Cb -0.10 -0.08 -0.03 0.00 0.08 0.00 0.00 29.97 29.84 1ik0 h ARG 65 CO -0.07 0.40 0.27 0.52 -1.07 0.00 0.00 179.97 180.01 1ik0 h MET 66 N 0.36 1.18 -0.86 0.04 2.86 -1.05 -2.75 114.93 114.72 1ik0 h MET 66 Ca 0.10 -0.24 -0.03 0.00 -2.06 0.00 0.00 59.70 57.47 1ik0 h MET 66 Cb 0.10 -0.18 -0.04 0.00 0.06 0.00 0.00 31.60 31.54 1ik0 h MET 66 CO -0.01 0.99 0.42 -0.07 1.06 0.00 0.00 176.91 179.29 1ik0 h LEU 67 N 1.14 1.12 -1.01 1.22 3.38 -0.82 -2.49 115.31 117.85 1ik0 h LEU 67 Ca 0.25 -0.13 0.01 0.00 0.09 0.00 0.00 57.88 58.10 1ik0 h LEU 67 Cb 0.28 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.69 1ik0 h LEU 67 CO -0.01 0.94 0.66 0.28 0.09 0.00 0.00 178.44 180.40 1ik0 h SER 68 N 1.23 1.15 -0.62 -0.43 0.02 -1.11 -1.11 113.55 112.68 1ik0 h SER 68 Ca 0.30 -0.03 0.18 0.00 -0.84 0.00 0.00 61.79 61.39 1ik0 h SER 68 Cb 0.11 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.34 1ik0 h SER 68 CO -0.04 0.84 0.69 1.23 -1.14 0.00 0.00 176.83 178.41 1ik0 h GLY 69 N 1.36 0.00 0.46 -3.77 0.00 -1.27 0.73 103.07 100.58 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 -1.24 0.69 0.00 0.00 0.00 176.54 175.91 1ik0 n PHE 70 N -3.57 0.27 -3.46 5.60 3.72 -0.43 -4.78 117.46 114.81 1ik0 n PHE 70 Ca 0.13 0.08 -0.23 0.00 -0.05 0.00 0.00 57.45 57.38 1ik0 n PHE 70 Cb 0.91 -0.48 -0.12 0.00 -0.94 0.00 0.00 39.48 38.86 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 5.15 0.00 -3.03 0.00 -0.02 -1.21 -4.60 135.00 131.30 1ik0 n PRO 72 Ca -0.02 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.03 1ik0 n PRO 72 Cb 0.44 -1.43 -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 1.65 3.01 -0.95 6.00 2.46 -1.26 -4.98 115.29 121.23 1ik0 s HIS 73 Ca 0.00 0.02 -0.23 0.00 0.47 0.00 0.00 55.06 55.32 1ik0 s HIS 73 Cb 0.00 -3.55 0.06 0.00 -0.13 0.00 0.00 32.58 28.96 1ik0 s HIS 73 CO 0.00 -0.96 1.36 0.15 -2.47 0.00 0.00 174.74 172.82 1ik0 s LYS 74 N 3.09 3.50 -0.10 2.88 -0.14 -1.26 -4.97 119.74 122.75 1ik0 s LYS 74 Ca 0.26 -1.04 -0.16 0.00 -1.36 0.00 0.00 55.97 53.67 1ik0 s LYS 74 Cb -0.13 -5.06 -0.05 0.00 -1.68 0.00 0.00 37.83 30.91 1ik0 s LYS 74 CO 0.20 -2.13 0.41 0.08 -0.76 0.00 0.00 175.35 173.16 1ik0 s VAL 75 N 4.78 5.17 0.18 3.17 1.01 -1.26 -5.06 120.40 128.39 1ik0 s VAL 75 Ca 0.41 0.82 0.05 0.00 0.00 0.00 0.00 61.98 63.27 1ik0 s VAL 75 Cb -0.03 -3.74 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 1ik0 s VAL 75 CO -0.05 0.41 0.16 -0.44 0.00 0.00 0.00 175.10 175.18 1ik0 s SER 76 N 0.12 5.60 0.00 3.32 0.01 -1.25 -4.96 113.70 116.54 1ik0 s SER 76 Ca 0.23 -0.12 0.00 0.00 1.31 0.00 0.00 55.95 57.37 1ik0 s SER 76 Cb -0.15 -1.48 0.00 0.00 0.21 0.00 0.00 66.02 64.60 1ik0 s SER 76 CO 0.10 0.05 0.92 0.00 0.41 0.00 0.00 173.24 174.72 1ik0 n ALA 77 N -0.48 0.97 -0.08 1.44 0.00 -1.26 -1.13 120.51 119.96 1ik0 n ALA 77 Ca -0.08 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.27 1ik0 n ALA 77 Cb 0.55 -0.93 -0.12 0.00 0.00 0.00 0.00 19.45 18.94 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 -1.42 -0.75 3.66 0.00 0.00 -1.26 -4.91 105.19 100.50 1ik0 n GLY 78 Ca 0.00 -0.26 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.39 4.16 0.09 1.61 -0.21 -0.29 -5.06 119.66 117.56 1ik0 s GLN 79 Ca -0.10 0.33 0.06 0.00 0.02 0.00 0.00 55.36 55.67 1ik0 s GLN 79 Cb 0.05 -3.57 -0.03 0.00 1.00 0.00 0.00 33.01 30.46 1ik0 s GLN 79 CO 0.64 -0.15 -0.15 -0.06 -2.12 0.00 0.00 175.29 173.45 1ik0 s PHE 80 N 1.66 1.33 0.00 0.91 0.08 -1.26 -3.85 117.98 116.85 1ik0 s PHE 80 Ca 0.22 -0.48 0.00 0.00 0.12 0.00 0.00 56.93 56.79 1ik0 s PHE 80 Cb -0.15 -0.73 0.00 0.00 -0.57 0.00 0.00 43.02 41.56 1ik0 s PHE 80 CO 0.09 0.10 0.00 0.43 -0.10 0.00 0.00 175.22 175.74 1ik0 n SER 81 N 1.07 3.76 -0.68 1.36 7.64 -1.26 -4.82 113.62 120.69 1ik0 n SER 81 Ca -0.20 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.76 1ik0 n SER 81 Cb 0.55 0.12 0.12 0.00 -1.01 0.00 0.00 64.21 63.99 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 -2.23 2.64 -0.64 6.43 2.88 -1.26 -4.46 113.62 116.98 1ik0 n SER 82 Ca 0.00 -1.78 0.04 0.00 -1.33 0.00 0.00 58.87 55.81 1ik0 n SER 82 Cb 0.44 -0.13 0.13 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 0.81 1.82 0.23 2.46 4.77 -1.26 -3.82 117.00 122.01 1ik0 n LEU 83 Ca 0.11 -0.91 0.14 0.00 -0.03 0.00 0.00 56.01 55.32 1ik0 n LEU 83 Cb 0.41 -0.27 0.36 0.00 -2.33 0.00 0.00 43.42 41.59 1ik0 n LEU 83 CO 0.09 0.39 0.88 0.45 -1.33 0.00 0.00 177.39 177.87 1ik0 h HIS 84 N 1.66 0.00 -3.94 -1.77 3.86 -1.94 -3.44 115.15 109.58 1ik0 h HIS 84 Ca 0.00 0.00 -0.49 0.00 -1.16 0.00 0.00 60.37 58.72 1ik0 h HIS 84 Cb 0.53 0.00 0.03 0.00 1.06 0.00 0.00 27.41 29.03 1ik0 h HIS 84 CO 0.24 0.00 0.44 0.08 0.86 0.00 0.00 177.93 179.55 1ik0 s VAL 85 N -3.36 3.57 -0.63 2.45 1.01 -1.25 -4.92 120.40 117.27 1ik0 s VAL 85 Ca 0.05 1.27 -0.04 0.00 0.00 0.00 0.00 61.98 63.26 1ik0 s VAL 85 Cb 0.07 -3.69 0.06 0.00 0.00 0.00 0.00 36.38 32.82 1ik0 s VAL 85 CO 0.62 0.07 2.73 0.54 0.00 0.00 0.00 175.10 179.06 1ik0 n ARG 86 N 0.12 2.88 -2.04 2.72 1.74 -1.26 -4.95 116.66 115.87 1ik0 n ARG 86 Ca 0.04 -2.54 -0.29 0.00 -0.77 0.00 0.00 57.85 54.30 1ik0 n ARG 86 Cb 0.48 -2.25 0.06 0.00 -1.02 0.00 0.00 32.46 29.73 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 0.44 5.18 0.41 0.55 1.01 -1.26 -5.06 116.67 117.93 1ik0 s ASP 87 Ca 0.58 0.88 -0.05 0.00 0.71 0.00 0.00 52.55 54.67 1ik0 s ASP 87 Cb 0.34 -1.62 -0.04 0.00 1.01 0.00 0.00 42.92 42.60 1ik0 s ASP 87 CO -0.19 -1.45 0.69 -0.89 0.21 0.00 0.00 175.17 173.55 1ik0 s THR 88 N -3.32 4.95 0.40 -1.27 2.01 -1.26 -4.85 115.64 112.29 1ik0 s THR 88 Ca 0.58 0.12 -0.15 0.00 0.31 0.00 0.00 61.69 62.55 1ik0 s THR 88 Cb -0.11 -3.82 -0.09 0.00 0.01 0.00 0.00 72.50 68.50 1ik0 s THR 88 CO 0.49 -0.64 0.83 -0.54 -0.69 0.00 0.00 174.62 174.07 1ik0 s LYS 89 N -4.28 3.98 0.16 4.92 1.02 -1.26 -3.10 119.74 121.19 1ik0 s LYS 89 Ca 0.46 0.75 0.06 0.00 0.02 0.00 0.00 55.97 57.26 1ik0 s LYS 89 Cb -0.10 -2.32 -0.04 0.00 -0.52 0.00 0.00 37.83 34.84 1ik0 s LYS 89 CO 0.38 -0.00 -0.12 0.96 -0.92 0.00 0.00 175.35 175.65 1ik0 s ILE 90 N -2.23 1.35 0.43 2.17 -4.36 0.59 -4.87 121.20 114.28 1ik0 s ILE 90 Ca 0.56 -2.11 -0.25 0.00 -0.26 0.00 0.00 60.65 58.59 1ik0 s ILE 90 Cb -0.10 -1.91 -0.08 0.00 1.25 0.00 0.00 42.46 41.62 1ik0 s ILE 90 CO 0.22 -0.70 1.30 -1.61 0.24 0.00 0.00 174.94 174.39 1ik0 s GLU 91 N -3.71 3.85 0.26 0.37 0.41 -1.26 -0.29 118.70 118.33 1ik0 s GLU 91 Ca 0.18 2.13 -0.03 0.00 -0.41 0.00 0.00 54.97 56.84 1ik0 s GLU 91 Cb 0.01 -2.66 0.38 0.00 -1.78 0.00 0.00 34.13 30.08 1ik0 s GLU 91 CO 0.03 -0.58 1.89 0.28 -0.49 0.00 0.00 175.26 176.39 1ik0 h VAL 92 N 2.29 1.13 -0.90 2.63 2.07 -1.84 -1.81 116.25 119.81 1ik0 h VAL 92 Ca -0.50 -0.42 0.18 0.00 0.82 0.00 0.00 66.70 66.78 1ik0 h VAL 92 Cb 1.25 -0.21 -0.11 0.00 -1.52 0.00 0.00 31.29 30.71 1ik0 h VAL 92 CO 0.62 0.22 0.48 0.00 0.02 0.00 0.00 177.57 178.91 1ik0 h ALA 93 N 1.44 1.43 0.04 1.67 0.00 -1.90 0.70 119.26 122.64 1ik0 h ALA 93 Ca 0.42 0.10 -0.22 0.00 0.00 0.00 0.00 54.91 55.21 1ik0 h ALA 93 Cb 0.10 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1ik0 h ALA 93 CO -0.15 -0.15 -1.01 0.37 0.00 0.00 0.00 179.25 178.31 1ik0 h GLN 94 N 0.60 0.20 -0.11 0.00 4.15 -1.72 -2.84 115.11 115.38 1ik0 h GLN 94 Ca 0.52 -0.26 0.00 0.00 0.77 0.00 0.00 58.65 59.68 1ik0 h GLN 94 Cb 0.84 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.61 1ik0 h GLN 94 CO -0.41 1.05 0.07 0.35 -1.93 0.00 0.00 178.83 177.96 1ik0 h PHE 95 N 0.09 0.14 -0.27 3.99 3.04 -0.25 0.16 116.94 123.83 1ik0 h PHE 95 Ca -0.07 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 61.88 1ik0 h PHE 95 Cb 1.69 -0.05 -0.01 0.00 2.56 0.00 0.00 35.95 40.14 1ik0 h PHE 95 CO 0.04 0.09 0.14 0.28 -2.02 0.00 0.00 178.31 176.84 1ik0 h VAL 96 N 0.15 1.13 -0.46 1.41 2.07 -1.09 -1.34 116.25 118.12 1ik0 h VAL 96 Ca 0.04 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1ik0 h VAL 96 Cb -0.02 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.59 1ik0 h VAL 96 CO -0.01 0.13 0.29 0.11 0.02 0.00 0.00 177.57 178.11 1ik0 h LYS 97 N 0.32 0.61 -0.90 1.57 1.57 -1.23 -0.22 116.57 118.29 1ik0 h LYS 97 Ca 0.10 -0.05 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 1ik0 h LYS 97 Cb 0.08 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 32.21 1ik0 h LYS 97 CO -0.01 0.43 0.59 -0.44 -0.57 0.00 0.00 179.45 179.44 1ik0 h ASP 98 N 0.62 1.04 -0.75 0.86 3.32 -0.47 -1.63 116.42 119.41 1ik0 h ASP 98 Ca 0.17 -0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.14 1ik0 h ASP 98 Cb -0.04 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 39.22 1ik0 h ASP 98 CO -0.03 0.76 0.29 0.25 -1.72 0.00 0.00 179.24 178.79 1ik0 h LEU 99 N 1.22 1.05 -0.45 1.55 5.85 -0.66 -2.98 115.31 120.87 1ik0 h LEU 99 Ca 0.33 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.94 1ik0 h LEU 99 Cb -0.13 -0.27 -0.05 0.00 0.37 0.00 0.00 40.66 40.58 1ik0 h LEU 99 CO -0.07 0.93 0.19 0.25 -0.34 0.00 0.00 178.44 179.40 1ik0 h LEU 100 N 1.10 0.23 -0.97 2.25 5.85 -0.06 0.29 115.31 124.00 1ik0 h LEU 100 Ca 0.25 0.04 0.01 0.00 0.84 0.00 0.00 57.88 59.02 1ik0 h LEU 100 Cb 0.22 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 41.21 1ik0 h LEU 100 CO -0.02 0.16 0.64 -0.07 -0.34 0.00 0.00 178.44 178.81 1ik0 h LEU 101 N 0.37 1.11 -0.39 2.25 -0.00 -1.35 -2.59 115.31 114.72 1ik0 h LEU 101 Ca 0.21 -0.03 -0.17 0.00 -0.00 0.00 0.00 57.88 57.89 1ik0 h LEU 101 Cb 0.18 -0.28 -0.00 0.00 -0.00 0.00 0.00 40.66 40.55 1ik0 h LEU 101 CO -0.19 0.81 -0.44 0.45 -0.00 0.00 0.00 178.44 179.06 1ik0 h HIS 102 N 1.31 1.08 -0.26 1.13 3.86 -1.34 -2.72 115.15 118.22 1ik0 h HIS 102 Ca 0.35 -0.34 0.02 0.00 -1.16 0.00 0.00 60.37 59.24 1ik0 h HIS 102 Cb -0.15 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.08 1ik0 h HIS 102 CO -0.00 1.16 0.13 -0.07 0.86 0.00 0.00 177.93 180.01 1ik0 h LEU 103 N 0.71 0.19 -1.39 2.43 3.38 -0.58 -1.63 115.31 118.42 1ik0 h LEU 103 Ca 0.04 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 1ik0 h LEU 103 Cb 1.03 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.75 1ik0 h LEU 103 CO 0.10 0.15 -0.25 0.07 0.09 0.00 0.00 178.44 178.60 1ik0 h LYS 104 N 0.27 0.00 -0.06 1.13 2.10 -1.54 -3.17 116.57 115.30 1ik0 h LYS 104 Ca 0.11 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.75 1ik0 h LYS 104 Cb 0.03 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.36 1ik0 h LYS 104 CO -0.07 0.25 0.01 -0.22 -2.00 0.00 0.00 179.45 177.42 1ik0 h LYS 105 N 0.00 0.09 -0.04 0.07 3.64 -0.97 -2.64 116.57 116.72 1ik0 h LYS 105 Ca -0.00 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.34 1ik0 h LYS 105 Cb 0.61 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.42 1ik0 h LYS 105 CO 0.03 0.30 -0.02 -0.07 -2.27 0.00 0.00 179.45 177.41 1ik0 h LEU 106 N -0.12 0.05 -1.01 5.20 -0.00 -1.46 -1.46 115.31 116.52 1ik0 h LEU 106 Ca 0.02 -0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.91 1ik0 h LEU 106 Cb 0.24 -0.01 -0.05 0.00 -0.00 0.00 0.00 40.66 40.84 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 0.06 1.27 -0.83 1.13 3.57 -1.47 0.15 116.94 120.82 1ik0 h PHE 107 Ca 0.02 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.56 1ik0 h PHE 107 Cb 0.09 -0.43 -0.04 0.00 2.79 0.00 0.00 35.95 38.36 1ik0 h PHE 107 CO 0.00 0.80 0.55 0.00 -2.23 0.00 0.00 178.31 177.43 1ik0 h ARG 108 N 1.37 1.08 0.00 1.11 3.08 -1.11 -1.63 114.38 118.29 1ik0 h ARG 108 Ca 0.37 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.36 1ik0 h ARG 108 Cb -0.16 -0.24 0.00 0.00 0.08 0.00 0.00 29.97 29.65 1ik0 h ARG 108 CO -0.08 0.72 -0.33 0.39 -1.07 0.00 0.00 179.97 179.60 1ik0 n GLU 109 N -4.41 0.02 -1.10 0.04 -0.58 -0.68 -4.91 120.64 109.01 1ik0 n GLU 109 Ca 0.09 0.01 -0.04 0.00 -0.42 0.00 0.00 57.16 56.81 1ik0 n GLU 109 Cb 0.03 -1.51 -0.02 0.00 -0.57 0.00 0.00 31.44 29.37 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 1.49 0.52 3.42 0.62 0.00 -0.05 -4.95 105.19 106.25 1ik0 n GLY 110 Ca 0.06 -0.12 -0.44 0.00 0.00 0.00 0.00 46.02 45.52 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 -1.74 3.05 -0.14 1.61 0.52 -1.17 -5.03 118.95 116.05 1ik0 s ARG 111 Ca 0.00 -1.10 -0.08 0.00 -0.52 0.00 0.00 55.73 54.03 1ik0 s ARG 111 Cb 0.00 -4.10 -0.04 0.00 0.52 0.00 0.00 34.95 31.33 1ik0 s ARG 111 CO 0.00 -1.07 0.14 -0.06 0.02 0.00 0.00 175.30 174.33 1ik0 s PHE 112 N 2.07 3.55 0.00 -0.53 0.08 -1.26 -4.77 117.98 117.12 1ik0 s PHE 112 Ca 0.09 0.48 0.00 0.00 0.12 0.00 0.00 56.93 57.62 1ik0 s PHE 112 Cb -0.21 -1.99 0.00 0.00 -0.57 0.00 0.00 43.02 40.24 1ik0 s PHE 112 CO 0.10 0.63 0.00 0.27 -0.10 0.00 0.00 175.22 176.11