#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 -4.96 107.32 106.73 1ik0 s GLY 2 Ca 0.00 -0.77 -0.18 0.00 0.00 0.00 0.00 44.72 43.76 1ik0 s GLY 2 CO 0.00 0.01 -0.37 -1.05 0.00 0.00 0.00 173.10 171.69 1ik0 n PRO 3 N -4.49 -0.53 -2.83 2.90 -0.02 -1.26 -4.93 135.00 123.85 1ik0 n PRO 3 Ca 0.10 -0.14 -0.33 0.00 -2.02 0.00 0.00 63.50 61.12 1ik0 n PRO 3 Cb 0.59 -1.45 -0.07 0.00 -0.02 0.00 0.00 33.50 32.55 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 -2.18 4.39 0.88 -1.45 -7.23 -1.26 -5.04 120.40 108.50 1ik0 s VAL 4 Ca 0.49 1.49 -0.11 0.00 -1.81 0.00 0.00 61.98 62.04 1ik0 s VAL 4 Cb -0.12 -3.63 0.12 0.00 0.56 0.00 0.00 36.38 33.31 1ik0 s VAL 4 CO 0.70 -0.28 1.09 -2.16 -0.31 0.00 0.00 175.10 174.15 1ik0 s PRO 5 N -3.08 1.37 0.22 4.82 0.04 -1.26 -4.76 135.00 132.34 1ik0 s PRO 5 Ca 0.61 0.98 -0.08 0.00 0.04 0.00 0.00 61.00 62.55 1ik0 s PRO 5 Cb -0.10 -1.81 0.30 0.00 0.04 0.00 0.00 34.50 32.93 1ik0 s PRO 5 CO 0.14 -2.21 1.78 -1.35 0.04 0.00 0.00 177.00 175.41 1ik0 h PRO 6 N -1.53 0.58 -0.98 0.56 0.10 -1.99 -1.38 132.00 127.36 1ik0 h PRO 6 Ca -0.48 -0.03 0.00 0.00 0.10 0.00 0.00 66.00 65.59 1ik0 h PRO 6 Cb 1.27 -0.13 -0.05 0.00 0.10 0.00 0.00 31.00 32.19 1ik0 h PRO 6 CO 0.52 0.38 0.63 0.66 0.10 0.00 0.00 178.00 180.30 1ik0 h SER 7 N 0.60 1.15 -0.41 -2.05 4.64 -1.94 -0.51 113.55 115.02 1ik0 h SER 7 Ca 0.33 -0.04 -0.15 0.00 -0.47 0.00 0.00 61.79 61.45 1ik0 h SER 7 Cb 0.32 -0.29 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1ik0 h SER 7 CO -0.25 0.85 -0.34 0.74 -0.87 0.00 0.00 176.83 176.96 1ik0 h THR 8 N 1.34 1.27 -0.69 2.95 2.02 -1.73 -2.67 112.91 115.41 1ik0 h THR 8 Ca 0.36 -1.51 -0.04 0.00 0.77 0.00 0.00 66.41 65.98 1ik0 h THR 8 Cb -0.13 1.31 -0.03 0.00 -1.74 0.00 0.00 68.15 67.57 1ik0 h THR 8 CO -0.07 0.51 0.26 0.00 0.37 0.00 0.00 175.52 176.58 1ik0 h ALA 9 N 0.80 0.89 -0.06 6.16 0.00 -0.72 -1.79 119.26 124.55 1ik0 h ALA 9 Ca 0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 1ik0 h ALA 9 Cb 0.93 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1ik0 h ALA 9 CO 0.09 0.53 0.03 1.25 0.00 0.00 0.00 179.25 181.15 1ik0 h LEU 10 N 0.98 0.07 -0.80 0.00 5.85 -1.00 0.15 115.31 120.55 1ik0 h LEU 10 Ca 0.23 -0.04 0.01 0.00 0.84 0.00 0.00 57.88 58.91 1ik0 h LEU 10 Cb 0.23 -0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.21 1ik0 h LEU 10 CO -0.02 0.09 0.53 0.03 -0.34 0.00 0.00 178.44 178.74 1ik0 h ARG 11 N 0.04 1.06 -0.77 1.25 3.08 -1.32 0.27 114.38 117.98 1ik0 h ARG 11 Ca 0.02 -0.06 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1ik0 h ARG 11 Cb 0.04 -0.24 -0.03 0.00 0.08 0.00 0.00 29.97 29.82 1ik0 h ARG 11 CO -0.00 0.70 0.27 0.93 -1.07 0.00 0.00 179.97 180.79 1ik0 h GLU 12 N 1.09 1.18 -0.26 0.04 4.39 -0.96 -2.14 114.58 117.92 1ik0 h GLU 12 Ca 0.29 -0.24 -0.12 0.00 0.34 0.00 0.00 59.36 59.64 1ik0 h GLU 12 Cb -0.13 -0.18 -0.00 0.00 -0.10 0.00 0.00 28.75 28.34 1ik0 h GLU 12 CO -0.06 0.99 -0.30 1.25 -1.16 0.00 0.00 179.01 179.72 1ik0 h LEU 13 N 1.14 0.71 -0.21 1.33 5.85 0.23 -2.68 115.31 121.68 1ik0 h LEU 13 Ca 0.25 -0.49 0.00 0.00 0.84 0.00 0.00 57.88 58.49 1ik0 h LEU 13 Cb 0.28 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.10 1ik0 h LEU 13 CO -0.01 1.06 0.14 0.40 -0.34 0.00 0.00 178.44 179.68 1ik0 h ILE 14 N 0.38 1.05 -1.01 4.05 2.04 -0.34 0.05 117.51 123.74 1ik0 h ILE 14 Ca 0.04 -0.10 0.01 0.00 1.00 0.00 0.00 64.86 65.81 1ik0 h ILE 14 Cb 0.87 0.74 -0.05 0.00 -0.74 0.00 0.00 36.82 37.64 1ik0 h ILE 14 CO 0.07 0.05 0.67 -0.33 0.00 0.00 0.00 178.15 178.61 1ik0 h GLU 15 N 0.29 1.33 -0.27 2.37 5.08 -1.41 -2.15 114.58 119.82 1ik0 h GLU 15 Ca 0.08 -0.08 -0.15 0.00 -1.00 0.00 0.00 59.36 58.21 1ik0 h GLU 15 Cb -0.03 -0.30 -0.00 0.00 0.50 0.00 0.00 28.75 28.92 1ik0 h GLU 15 CO -0.02 0.88 -0.41 1.49 -1.00 0.00 0.00 179.01 179.95 1ik0 h GLU 16 N 1.37 0.75 -0.62 2.33 4.81 -1.10 -2.31 114.58 119.81 1ik0 h GLU 16 Ca 0.37 -0.45 0.00 0.00 -0.13 0.00 0.00 59.36 59.15 1ik0 h GLU 16 Cb -0.16 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.23 1ik0 h GLU 16 CO -0.08 1.08 0.41 -0.07 -0.73 0.00 0.00 179.01 179.62 1ik0 h LEU 17 N 0.50 0.72 -0.61 1.64 3.38 -0.69 -2.21 115.31 118.04 1ik0 h LEU 17 Ca 0.02 -0.02 -0.09 0.00 0.09 0.00 0.00 57.88 57.88 1ik0 h LEU 17 Cb 1.01 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1ik0 h LEU 17 CO 0.10 0.53 0.04 0.58 0.09 0.00 0.00 178.44 179.77 1ik0 h VAL 18 N 0.84 1.26 -0.58 1.22 2.07 -1.38 -2.59 116.25 117.09 1ik0 h VAL 18 Ca 0.23 -1.10 0.01 0.00 0.82 0.00 0.00 66.70 66.66 1ik0 h VAL 18 Cb -0.09 0.77 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1ik0 h VAL 18 CO -0.05 0.40 0.38 0.78 0.02 0.00 0.00 177.57 179.11 1ik0 h ASN 19 N 0.95 0.66 1.62 0.57 2.35 -0.95 0.11 115.58 120.90 1ik0 h ASN 19 Ca 0.18 -0.02 0.00 0.00 -0.55 0.00 0.00 56.30 55.91 1ik0 h ASN 19 Cb 0.51 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.71 1ik0 h ASN 19 CO 0.02 0.48 0.00 0.16 -1.65 0.00 0.00 177.43 176.44 1ik0 h ILE 20 N 0.78 0.00 0.00 2.81 3.07 -1.34 -3.27 117.51 119.56 1ik0 h ILE 20 Ca 0.21 -0.74 0.00 0.00 1.55 0.00 0.00 64.86 65.88 1ik0 h ILE 20 Cb -0.09 1.73 0.00 0.00 -0.27 0.00 0.00 36.82 38.19 1ik0 h ILE 20 CO -0.05 0.00 -1.81 0.35 -1.05 0.00 0.00 178.15 175.59 1ik0 n THR 21 N -2.85 0.00 0.06 0.16 -2.24 -0.99 -3.88 114.28 104.54 1ik0 n THR 21 Ca 0.04 -0.41 -0.11 0.00 -2.27 0.00 0.00 64.05 61.30 1ik0 n THR 21 Cb 0.45 0.18 -0.13 0.00 -2.10 0.00 0.00 70.33 68.73 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 0.11 -0.46 -0.78 1.08 -1.05 -3.30 115.11 110.71 1ik0 h GLN 22 Ca 0.00 -0.18 0.00 0.00 -1.45 0.00 0.00 58.65 57.02 1ik0 h GLN 22 Cb 0.90 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.40 1ik0 h GLN 22 CO 0.00 1.01 0.00 0.09 -0.95 0.00 0.00 178.83 178.98 1ik0 n ASN 23 N -3.37 3.31 -4.73 1.46 4.13 -1.23 -4.93 115.26 109.89 1ik0 n ASN 23 Ca -0.07 -1.97 -0.41 0.00 1.68 0.00 0.00 54.58 53.82 1ik0 n ASN 23 Cb 0.99 -0.30 -0.04 0.00 -1.54 0.00 0.00 39.78 38.89 1ik0 n ASN 23 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1ik0 s GLN 24 N -1.39 4.60 0.00 3.52 -2.07 -1.24 -5.00 119.66 118.08 1ik0 s GLN 24 Ca 0.40 1.30 0.00 0.00 -1.82 0.00 0.00 55.36 55.25 1ik0 s GLN 24 Cb 0.22 -3.39 0.00 0.00 -1.09 0.00 0.00 33.01 28.75 1ik0 s GLN 24 CO 0.31 0.17 0.00 1.17 -1.32 0.00 0.00 175.29 175.62 1ik0 n LYS 25 N 3.08 0.00 -2.11 9.60 4.81 -1.26 -4.94 118.16 127.34 1ik0 n LYS 25 Ca 0.02 0.00 -0.29 0.00 -0.87 0.00 0.00 58.31 57.16 1ik0 n LYS 25 Cb 0.50 -0.34 0.02 0.00 0.02 0.00 0.00 35.03 35.23 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 -4.31 3.13 0.47 3.14 0.00 -1.26 -4.98 121.76 117.94 1ik0 s ALA 26 Ca 0.00 -0.36 -0.21 0.00 0.00 0.00 0.00 51.96 51.39 1ik0 s ALA 26 Cb 0.00 -2.88 -0.12 0.00 0.00 0.00 0.00 23.12 20.12 1ik0 s ALA 26 CO 0.00 -0.80 0.50 -2.30 0.00 0.00 0.00 175.76 173.16 1ik0 n PRO 27 N -2.72 0.54 0.04 0.00 -0.02 -1.26 -4.87 135.00 126.71 1ik0 n PRO 27 Ca 0.05 0.20 -0.12 0.00 -2.02 0.00 0.00 63.50 61.61 1ik0 n PRO 27 Cb 0.56 -1.54 -0.07 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 0.61 -0.00-10.52 2.45 3.38 -1.97 -3.43 115.31 105.83 1ik0 h LEU 28 Ca -0.42 -0.01 -0.46 0.00 0.09 0.00 0.00 57.88 57.08 1ik0 h LEU 28 Cb 1.40 0.00 0.07 0.00 0.09 0.00 0.00 40.66 42.22 1ik0 h LEU 28 CO 0.50 0.01 0.21 0.00 0.09 0.00 0.00 178.44 179.24 1ik0 n ASN 30 N -2.80 2.03 0.00 0.00 3.02 -1.26 -4.31 115.26 111.94 1ik0 n ASN 30 Ca 0.07 -1.51 0.00 0.00 -0.03 0.00 0.00 54.58 53.11 1ik0 n ASN 30 Cb 0.59 -0.43 0.00 0.00 -0.61 0.00 0.00 39.78 39.34 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 1.76 0.39 3.75 7.41 0.00 -1.26 -5.01 105.19 112.23 1ik0 n GLY 31 Ca 0.00 -1.02 -0.36 0.00 0.00 0.00 0.00 46.02 44.64 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 -2.99 5.16 0.19 1.61 0.01 -1.26 -4.89 113.70 111.54 1ik0 s SER 32 Ca 0.00 2.40 0.08 0.00 1.31 0.00 0.00 55.95 59.74 1ik0 s SER 32 Cb 0.00 -2.60 -0.04 0.00 0.21 0.00 0.00 66.02 63.59 1ik0 s SER 32 CO 0.00 -1.61 0.01 -0.04 0.41 0.00 0.00 173.24 172.01 1ik0 s MET 33 N -3.33 2.42 0.17 12.44 -1.94 -1.26 -2.56 119.30 125.23 1ik0 s MET 33 Ca 0.78 -1.14 0.05 0.00 -1.71 0.00 0.00 55.69 53.67 1ik0 s MET 33 Cb -0.31 -2.35 -0.05 0.00 2.01 0.00 0.00 34.83 34.14 1ik0 s MET 33 CO 0.33 0.44 -0.11 0.14 -0.01 0.00 0.00 175.02 175.81 1ik0 s VAL 34 N -1.82 1.34 0.08 -6.03 -7.23 0.13 -4.84 120.40 102.02 1ik0 s VAL 34 Ca 0.28 -2.11 -0.31 0.00 -1.81 0.00 0.00 61.98 58.04 1ik0 s VAL 34 Cb -0.09 -1.92 -0.06 0.00 0.56 0.00 0.00 36.38 34.87 1ik0 s VAL 34 CO 0.19 -0.69 1.28 0.26 -0.31 0.00 0.00 175.10 175.83 1ik0 s TRP 35 N -3.22 3.33 0.50 2.82 0.52 -1.26 0.17 118.94 121.81 1ik0 s TRP 35 Ca 0.19 1.14 -0.21 0.00 0.02 0.00 0.00 56.10 57.24 1ik0 s TRP 35 Cb 0.02 -3.53 -0.07 0.00 -1.15 0.00 0.00 33.47 28.73 1ik0 s TRP 35 CO 0.03 -1.77 1.12 -1.54 0.02 0.00 0.00 176.95 174.81 1ik0 s SER 36 N 1.12 6.00 0.20 2.95 1.04 -1.14 -4.87 113.70 118.99 1ik0 s SER 36 Ca 0.61 2.16 0.00 0.00 0.48 0.00 0.00 55.95 59.21 1ik0 s SER 36 Cb -0.32 -2.58 -0.05 0.00 0.10 0.00 0.00 66.02 63.17 1ik0 s SER 36 CO 0.29 -1.03 0.08 0.27 0.98 0.00 0.00 173.24 173.83 1ik0 s ILE 37 N -1.74 0.37 -0.17 -1.02 -4.36 -1.26 -4.90 121.20 108.12 1ik0 s ILE 37 Ca 0.69 -1.98 -0.24 0.00 -0.26 0.00 0.00 60.65 58.86 1ik0 s ILE 37 Cb -0.24 -2.39 -0.02 0.00 1.25 0.00 0.00 42.46 41.06 1ik0 s ILE 37 CO 0.28 -0.18 0.75 0.20 0.24 0.00 0.00 174.94 176.23 1ik0 s ASN 38 N -3.20 6.87 -0.34 4.36 0.01 -1.26 -5.01 114.94 116.37 1ik0 s ASN 38 Ca 0.33 1.06 -0.28 0.00 -0.71 0.00 0.00 52.86 53.26 1ik0 s ASN 38 Cb 0.07 -2.41 0.02 0.00 0.41 0.00 0.00 41.25 39.33 1ik0 s ASN 38 CO 0.09 -0.33 1.01 -0.76 -1.51 0.00 0.00 177.10 175.60 1ik0 s LEU 39 N 1.95 3.95 0.00 0.60 2.01 -1.26 -4.85 118.68 121.08 1ik0 s LEU 39 Ca 0.35 0.86 0.00 0.00 0.01 0.00 0.00 54.13 55.35 1ik0 s LEU 39 Cb -0.16 -3.42 0.00 0.00 0.01 0.00 0.00 46.19 42.62 1ik0 s LEU 39 CO 0.12 -0.86 0.00 0.35 1.01 0.00 0.00 176.35 176.97 1ik0 n THR 40 N 5.90 0.00 -0.00 5.49 -2.24 -1.26 -5.07 114.28 117.11 1ik0 n THR 40 Ca 0.10 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.84 1ik0 n THR 40 Cb 0.48 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.69 1ik0 n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ik0 n ALA 41 N -3.00 2.23 0.16 6.98 0.00 -1.26 -4.63 120.51 120.98 1ik0 n ALA 41 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.14 1ik0 n ALA 41 Cb 0.00 0.17 0.00 0.00 0.00 0.00 0.00 19.45 19.62 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 2.75 1.23 0.37 0.00 0.00 -1.26 -4.15 105.19 104.14 1ik0 n GLY 42 Ca -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 45.96 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 1.68 1.20 -0.33 1.61 0.00 -1.89 0.39 114.93 117.58 1ik0 h MET 43 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 59.70 59.63 1ik0 h MET 43 Cb 0.50 -0.27 -0.02 0.00 0.00 0.00 0.00 31.60 31.81 1ik0 h MET 43 CO 0.00 0.80 0.22 1.88 0.00 0.00 0.00 176.91 179.80 1ik0 h TYR 44 N 1.24 0.41 0.11 -0.22 -1.99 -1.94 0.86 116.97 115.44 1ik0 h TYR 44 Ca 0.33 0.01 -0.01 0.00 2.00 0.00 0.00 58.73 61.07 1ik0 h TYR 44 Cb -0.14 -0.14 0.00 0.00 2.00 0.00 0.00 36.73 38.45 1ik0 h TYR 44 CO 0.00 0.26 -0.05 0.00 -0.00 0.00 0.00 178.16 178.36 1ik0 h ALA 46 N 0.13 0.54 -0.89 0.00 0.00 -0.85 -1.99 119.26 116.20 1ik0 h ALA 46 Ca -0.02 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 1ik0 h ALA 46 Cb 0.51 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.08 1ik0 h ALA 46 CO 0.03 -0.00 0.49 0.00 0.00 0.00 0.00 179.25 179.76 1ik0 h ALA 47 N 1.16 1.18 0.12 0.00 0.00 0.72 -2.71 119.26 119.73 1ik0 h ALA 47 Ca 0.16 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 1ik0 h ALA 47 Cb -0.07 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 17.37 1ik0 h ALA 47 CO -0.03 0.66 -0.06 1.25 0.00 0.00 0.00 179.25 181.07 1ik0 h LEU 48 N 1.25 -0.14 -1.29 0.00 5.85 -0.39 -1.38 115.31 119.21 1ik0 h LEU 48 Ca 0.31 0.01 0.01 0.00 0.84 0.00 0.00 57.88 59.05 1ik0 h LEU 48 Cb 0.03 0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.06 1ik0 h LEU 48 CO -0.05 -0.10 0.48 1.05 -0.34 0.00 0.00 178.44 179.48 1ik0 h GLU 49 N -0.16 0.95 -0.75 1.25 4.11 -1.27 0.04 114.58 118.74 1ik0 h GLU 49 Ca -0.02 -0.06 -0.06 0.00 0.07 0.00 0.00 59.36 59.30 1ik0 h GLU 49 Cb 0.13 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 29.13 1ik0 h GLU 49 CO 0.03 0.63 0.23 1.03 0.07 0.00 0.00 179.01 181.00 1ik0 h SER 50 N 0.98 1.09 0.21 3.06 0.87 -1.15 -2.57 113.55 116.03 1ik0 h SER 50 Ca 0.27 -0.21 -0.13 0.00 -1.23 0.00 0.00 61.79 60.50 1ik0 h SER 50 Cb -0.09 -0.29 -0.01 0.00 -0.44 0.00 0.00 62.40 61.57 1ik0 h SER 50 CO -0.06 1.01 -0.47 -0.07 -0.53 0.00 0.00 176.83 176.71 1ik0 h LEU 51 N 1.12 0.34 -1.10 2.23 3.38 -0.11 -2.79 115.31 118.37 1ik0 h LEU 51 Ca 0.24 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1ik0 h LEU 51 Cb 0.31 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.97 1ik0 h LEU 51 CO -0.01 0.76 0.27 0.40 0.09 0.00 0.00 178.44 179.96 1ik0 h ILE 52 N 0.25 0.00 0.00 1.22 1.08 -0.61 1.01 117.51 120.47 1ik0 h ILE 52 Ca 0.01 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.48 1ik0 h ILE 52 Cb 0.93 0.37 0.00 0.00 -3.07 0.00 0.00 36.82 35.05 1ik0 h ILE 52 CO 0.08 0.00 -0.29 0.78 -0.69 0.00 0.00 178.15 178.03 1ik0 h ASN 53 N 0.00 0.00 -3.56 1.72 -0.26 -1.58 -3.44 115.58 108.47 1ik0 h ASN 53 Ca 0.00 -0.06 -0.62 0.00 -0.56 0.00 0.00 56.30 55.06 1ik0 h ASN 53 Cb 0.55 0.00 -0.12 0.00 -1.06 0.00 0.00 38.32 37.68 1ik0 h ASN 53 CO 0.00 0.03 0.03 -0.69 -1.06 0.00 0.00 177.43 175.74 1ik0 s VAL 54 N -3.17 5.05 0.09 2.81 1.01 0.35 -5.06 120.40 121.48 1ik0 s VAL 54 Ca 0.07 0.94 0.06 0.00 0.00 0.00 0.00 61.98 63.06 1ik0 s VAL 54 Cb 0.11 -3.86 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1ik0 s VAL 54 CO 0.67 0.07 -0.15 -0.44 0.00 0.00 0.00 175.10 175.24 1ik0 s SER 55 N 1.53 1.93 0.00 3.32 0.01 -1.26 -4.74 113.70 114.48 1ik0 s SER 55 Ca 0.22 -0.69 0.00 0.00 1.31 0.00 0.00 55.95 56.79 1ik0 s SER 55 Cb -0.16 -0.07 0.00 0.00 0.21 0.00 0.00 66.02 66.00 1ik0 s SER 55 CO 0.09 -0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.27 1ik0 n GLY 56 N 0.99 1.30 3.40 3.44 0.00 -1.26 -4.99 105.19 108.07 1ik0 n GLY 56 Ca -0.19 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 8.23 0.76 0.00 0.00 0.87 -1.95 -2.53 113.55 118.93 1ik0 h SER 58 Ca 0.15 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 1ik0 h SER 58 Cb 1.02 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.78 1ik0 h SER 58 CO 0.96 0.73 0.35 0.00 -0.53 0.00 0.00 176.83 178.34 1ik0 n ALA 59 N -2.46 0.46 -0.47 6.23 0.00 -1.26 -0.15 120.51 122.86 1ik0 n ALA 59 Ca 0.04 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1ik0 n ALA 59 Cb 0.21 -0.53 0.00 0.00 0.00 0.00 0.00 19.45 19.13 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 -1.62 0.13 -0.25 0.00 -5.35 -0.96 -4.76 119.36 106.55 1ik0 n ILE 60 Ca -0.00 -0.33 -0.05 0.00 -0.27 0.00 0.00 62.75 62.10 1ik0 n ILE 60 Cb 0.35 1.29 0.06 0.00 -1.74 0.00 0.00 39.64 39.60 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 0.93 -0.78 6.28 4.57 -0.43 -1.10 114.58 124.04 1ik0 h GLU 61 Ca 0.00 -0.06 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 1ik0 h GLU 61 Cb 0.35 -0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 28.70 1ik0 h GLU 61 CO 0.00 0.62 0.39 0.87 -1.18 0.00 0.00 179.01 179.71 1ik0 h LYS 62 N 0.96 1.11 -0.85 1.92 1.57 -1.86 -2.01 116.57 117.41 1ik0 h LYS 62 Ca 0.26 -0.15 0.05 0.00 -1.87 0.00 0.00 60.65 58.94 1ik0 h LYS 62 Cb -0.11 -0.21 -0.05 0.00 0.08 0.00 0.00 32.23 31.94 1ik0 h LYS 62 CO -0.06 0.84 0.56 1.15 -0.57 0.00 0.00 179.45 181.38 1ik0 h THR 63 N 1.11 1.10 -0.97 -0.16 2.02 -1.53 -1.37 112.91 113.11 1ik0 h THR 63 Ca 0.27 -0.35 0.01 0.00 0.77 0.00 0.00 66.41 67.12 1ik0 h THR 63 Cb 0.09 0.00 -0.05 0.00 -1.74 0.00 0.00 68.15 66.45 1ik0 h THR 63 CO -0.04 0.18 0.64 1.56 0.37 0.00 0.00 175.52 178.24 1ik0 h GLN 64 N 1.01 1.27 -0.38 6.66 1.08 -0.64 -0.01 115.11 124.11 1ik0 h GLN 64 Ca 0.35 -0.08 -0.06 0.00 -1.45 0.00 0.00 58.65 57.42 1ik0 h GLN 64 Cb 0.11 -0.29 -0.01 0.00 -0.05 0.00 0.00 27.48 27.24 1ik0 h GLN 64 CO -0.11 0.84 0.02 0.00 -0.95 0.00 0.00 178.83 178.62 1ik0 h ARG 65 N 1.31 0.65 -0.71 1.46 3.08 -1.20 -1.92 114.38 117.05 1ik0 h ARG 65 Ca 0.35 -0.20 -0.07 0.00 0.07 0.00 0.00 59.98 60.13 1ik0 h ARG 65 Cb -0.15 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.81 1ik0 h ARG 65 CO -0.08 0.74 0.17 0.52 -1.07 0.00 0.00 179.97 180.25 1ik0 h MET 66 N 0.48 1.14 -0.82 0.04 2.86 -0.95 -2.46 114.93 115.22 1ik0 h MET 66 Ca 0.11 -0.28 -0.03 0.00 -2.06 0.00 0.00 59.70 57.44 1ik0 h MET 66 Cb 0.44 -0.15 -0.04 0.00 0.06 0.00 0.00 31.60 31.91 1ik0 h MET 66 CO 0.02 1.01 0.40 -0.07 1.06 0.00 0.00 176.91 179.33 1ik0 h LEU 67 N 1.08 1.06 -1.11 1.22 3.38 -0.87 -1.83 115.31 118.25 1ik0 h LEU 67 Ca 0.22 -0.12 0.05 0.00 0.09 0.00 0.00 57.88 58.12 1ik0 h LEU 67 Cb 0.38 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1ik0 h LEU 67 CO 0.00 0.89 0.60 0.28 0.09 0.00 0.00 178.44 180.31 1ik0 h SER 68 N 1.17 0.98 -1.00 -0.43 0.02 -0.89 0.38 113.55 113.77 1ik0 h SER 68 Ca 0.28 -0.00 0.28 0.00 -0.84 0.00 0.00 61.79 61.51 1ik0 h SER 68 Cb 0.10 -0.22 -0.05 0.00 0.14 0.00 0.00 62.40 62.37 1ik0 h SER 68 CO -0.04 0.65 0.70 1.23 -1.14 0.00 0.00 176.83 178.24 1ik0 h GLY 69 N 1.12 0.24 0.71 -3.77 0.00 -1.00 1.62 103.07 101.99 1ik0 h GLY 69 Ca 0.38 -0.04 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1ik0 h GLY 69 CO -0.13 -0.02 -0.74 0.69 0.00 0.00 0.00 176.54 176.34 1ik0 n PHE 70 N -4.31 0.10 -3.41 5.60 3.01 0.05 -4.53 117.46 113.97 1ik0 n PHE 70 Ca 0.21 0.03 -0.27 0.00 1.01 0.00 0.00 57.45 58.44 1ik0 n PHE 70 Cb 1.01 -0.27 -0.10 0.00 -0.01 0.00 0.00 39.48 40.10 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 2.68 0.22 -3.29 0.00 -0.02 -0.63 -4.52 135.00 129.43 1ik0 n PRO 72 Ca 0.29 0.00 -0.39 0.00 -2.02 0.00 0.00 63.50 61.38 1ik0 n PRO 72 Cb 0.47 -1.19 -0.06 0.00 -0.02 0.00 0.00 33.50 32.70 1ik0 n PRO 72 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1ik0 s HIS 73 N -2.00 3.75 0.38 6.00 -3.43 -1.26 -5.05 115.29 113.68 1ik0 s HIS 73 Ca 0.04 1.19 -0.25 0.00 -0.80 0.00 0.00 55.06 55.25 1ik0 s HIS 73 Cb 0.02 -2.50 -0.09 0.00 -1.43 0.00 0.00 32.58 28.58 1ik0 s HIS 73 CO 0.03 0.51 1.02 0.15 -2.00 0.00 0.00 174.74 174.46 1ik0 s LYS 74 N -0.77 4.29 -0.06 -0.38 1.02 -1.26 -5.06 119.74 117.52 1ik0 s LYS 74 Ca 0.28 1.46 0.02 0.00 0.02 0.00 0.00 55.97 57.76 1ik0 s LYS 74 Cb -0.18 -2.61 0.01 0.00 -0.52 0.00 0.00 37.83 34.53 1ik0 s LYS 74 CO 0.17 -0.02 -0.10 0.08 -0.92 0.00 0.00 175.35 174.56 1ik0 s VAL 75 N -1.65 1.00 0.10 3.17 1.01 -1.26 -5.12 120.40 117.65 1ik0 s VAL 75 Ca 0.56 -0.40 0.03 0.00 0.00 0.00 0.00 61.98 62.16 1ik0 s VAL 75 Cb -0.21 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.20 1ik0 s VAL 75 CO 0.26 0.32 0.15 -0.55 0.00 0.00 0.00 175.10 175.29 1ik0 s SER 76 N 0.71 5.84 0.14 3.32 0.15 -1.26 -4.96 113.70 117.64 1ik0 s SER 76 Ca -0.14 0.06 0.10 0.00 0.70 0.00 0.00 55.95 56.66 1ik0 s SER 76 Cb -0.15 -1.65 0.52 0.00 -1.71 0.00 0.00 66.02 63.02 1ik0 s SER 76 CO 0.03 0.13 1.30 0.00 1.20 0.00 0.00 173.24 175.90 1ik0 n ALA 77 N 0.09 1.05 -0.08 5.45 0.00 -1.26 -1.03 120.51 124.72 1ik0 n ALA 77 Ca -0.07 0.08 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 1ik0 n ALA 77 Cb 0.52 -1.14 -0.15 0.00 0.00 0.00 0.00 19.45 18.68 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 -1.34 -0.89 3.67 0.00 0.00 -1.26 -4.87 105.19 100.51 1ik0 n GLY 78 Ca -0.00 -0.25 -0.40 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 -2.52 4.25 0.06 1.61 -0.21 -0.20 -5.05 119.66 117.60 1ik0 s GLN 79 Ca -0.13 0.64 0.05 0.00 0.02 0.00 0.00 55.36 55.95 1ik0 s GLN 79 Cb 0.07 -3.55 -0.03 0.00 1.00 0.00 0.00 33.01 30.50 1ik0 s GLN 79 CO 0.79 -0.17 -0.15 -0.06 -2.12 0.00 0.00 175.29 173.58 1ik0 s PHE 80 N 1.67 1.28 0.00 0.91 0.08 -1.26 -4.12 117.98 116.54 1ik0 s PHE 80 Ca 0.30 -0.40 0.00 0.00 0.12 0.00 0.00 56.93 56.95 1ik0 s PHE 80 Cb -0.16 -0.74 0.00 0.00 -0.57 0.00 0.00 43.02 41.55 1ik0 s PHE 80 CO 0.11 0.06 0.00 0.43 -0.10 0.00 0.00 175.22 175.72 1ik0 n SER 81 N 1.60 2.81 -0.78 1.36 7.64 -1.26 -4.80 113.62 120.19 1ik0 n SER 81 Ca -0.19 0.00 0.12 0.00 1.01 0.00 0.00 58.87 59.80 1ik0 n SER 81 Cb 0.54 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.81 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 -2.54 2.63 -1.30 6.43 2.88 -1.26 -4.31 113.62 116.16 1ik0 n SER 82 Ca 0.00 -1.82 -0.05 0.00 -1.33 0.00 0.00 58.87 55.67 1ik0 n SER 82 Cb 0.46 0.18 0.09 0.00 -0.75 0.00 0.00 64.21 64.18 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 3.81 0.06 2.46 4.77 -1.26 -4.08 117.00 123.59 1ik0 n LEU 83 Ca 0.12 -1.97 -0.14 0.00 -0.03 0.00 0.00 56.01 53.99 1ik0 n LEU 83 Cb 0.55 -0.60 -0.05 0.00 -2.33 0.00 0.00 43.42 40.98 1ik0 n LEU 83 CO 0.20 0.60 0.17 0.45 -1.33 0.00 0.00 177.39 177.48 1ik0 h HIS 84 N 0.70 0.67 -4.07 -1.77 3.86 -1.93 -3.45 115.15 109.16 1ik0 h HIS 84 Ca 0.15 -0.36 -0.47 0.00 -1.16 0.00 0.00 60.37 58.53 1ik0 h HIS 84 Cb 1.46 -0.08 0.02 0.00 1.06 0.00 0.00 27.41 29.88 1ik0 h HIS 84 CO 0.51 1.18 0.38 0.14 0.86 0.00 0.00 177.93 181.01 1ik0 s VAL 85 N -3.28 3.86 -1.27 2.45 -7.23 -1.26 -4.94 120.40 108.72 1ik0 s VAL 85 Ca -0.06 1.17 -0.07 0.00 -1.81 0.00 0.00 61.98 61.20 1ik0 s VAL 85 Cb 0.09 -3.48 0.17 0.00 0.56 0.00 0.00 36.38 33.72 1ik0 s VAL 85 CO 0.87 -0.24 2.02 0.54 -0.31 0.00 0.00 175.10 177.98 1ik0 n ARG 86 N -0.89 4.07 -2.14 4.82 1.74 -1.26 -4.98 116.66 118.02 1ik0 n ARG 86 Ca 0.09 -3.61 -0.26 0.00 -0.77 0.00 0.00 57.85 53.29 1ik0 n ARG 86 Cb 0.53 -2.78 0.07 0.00 -1.02 0.00 0.00 32.46 29.26 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 0.41 4.77 0.30 0.55 1.01 -1.26 -5.07 116.67 117.38 1ik0 s ASP 87 Ca 0.44 0.53 -0.04 0.00 0.71 0.00 0.00 52.55 54.19 1ik0 s ASP 87 Cb 0.12 -1.15 -0.05 0.00 1.01 0.00 0.00 42.92 42.85 1ik0 s ASP 87 CO -0.02 -1.65 0.56 0.42 0.21 0.00 0.00 175.17 174.68 1ik0 s THR 88 N -3.31 5.03 0.46 -1.27 -4.23 -1.26 -4.88 115.64 106.18 1ik0 s THR 88 Ca 0.60 -0.02 -0.09 0.00 -1.18 0.00 0.00 61.69 61.01 1ik0 s THR 88 Cb -0.11 -3.76 -0.05 0.00 1.34 0.00 0.00 72.50 69.92 1ik0 s THR 88 CO 0.46 -0.37 0.81 -0.54 -0.54 0.00 0.00 174.62 174.43 1ik0 s LYS 89 N -3.70 3.69 0.20 3.99 1.02 -1.26 -2.91 119.74 120.78 1ik0 s LYS 89 Ca 0.43 0.43 0.03 0.00 0.02 0.00 0.00 55.97 56.88 1ik0 s LYS 89 Cb -0.11 -2.34 -0.05 0.00 -0.52 0.00 0.00 37.83 34.81 1ik0 s LYS 89 CO 0.31 -0.15 0.00 0.96 -0.92 0.00 0.00 175.35 175.55 1ik0 s ILE 90 N -2.58 0.84 0.35 2.17 -4.36 0.13 -4.85 121.20 112.89 1ik0 s ILE 90 Ca 0.51 -2.01 -0.28 0.00 -0.26 0.00 0.00 60.65 58.61 1ik0 s ILE 90 Cb -0.10 -2.25 -0.10 0.00 1.25 0.00 0.00 42.46 41.26 1ik0 s ILE 90 CO 0.38 -0.38 1.34 -1.61 0.24 0.00 0.00 174.94 174.90 1ik0 s GLU 91 N -3.90 4.25 0.21 0.37 2.02 -1.26 0.19 118.70 120.59 1ik0 s GLU 91 Ca 0.27 2.27 -0.11 0.00 0.02 0.00 0.00 54.97 57.42 1ik0 s GLU 91 Cb 0.06 -3.01 0.15 0.00 0.10 0.00 0.00 34.13 31.43 1ik0 s GLU 91 CO 0.07 -0.29 1.88 0.28 0.02 0.00 0.00 175.26 177.21 1ik0 h VAL 92 N 2.94 1.19 -0.73 2.63 2.07 -1.83 -0.71 116.25 121.80 1ik0 h VAL 92 Ca -0.49 -0.34 0.11 0.00 0.82 0.00 0.00 66.70 66.79 1ik0 h VAL 92 Cb 1.23 0.11 -0.08 0.00 -1.52 0.00 0.00 31.29 31.03 1ik0 h VAL 92 CO 0.65 0.18 0.35 0.00 0.02 0.00 0.00 177.57 178.77 1ik0 h ALA 93 N 1.27 1.02 -0.01 1.67 0.00 -1.91 0.08 119.26 121.38 1ik0 h ALA 93 Ca 0.27 0.07 -0.17 0.00 0.00 0.00 0.00 54.91 55.08 1ik0 h ALA 93 Cb -0.12 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.65 1ik0 h ALA 93 CO -0.06 -0.09 -0.75 0.37 0.00 0.00 0.00 179.25 178.72 1ik0 h GLN 94 N 0.56 0.10 -0.31 0.00 4.15 -1.83 -2.94 115.11 114.85 1ik0 h GLN 94 Ca 0.37 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.70 1ik0 h GLN 94 Cb 0.45 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 28.15 1ik0 h GLN 94 CO -0.31 0.81 0.21 0.35 -1.93 0.00 0.00 178.83 177.95 1ik0 h PHE 95 N 0.07 0.39 -0.33 3.99 3.04 0.48 -0.44 116.94 124.14 1ik0 h PHE 95 Ca -0.02 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.94 1ik0 h PHE 95 Cb 1.33 -0.13 -0.02 0.00 2.56 0.00 0.00 35.95 39.69 1ik0 h PHE 95 CO 0.01 0.25 0.19 0.28 -2.02 0.00 0.00 178.31 177.01 1ik0 h VAL 96 N 0.42 1.13 -0.19 1.41 2.07 -1.12 -1.44 116.25 118.53 1ik0 h VAL 96 Ca 0.11 -0.33 0.00 0.00 0.82 0.00 0.00 66.70 67.31 1ik0 h VAL 96 Cb -0.05 0.75 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1ik0 h VAL 96 CO -0.03 0.13 0.13 0.11 0.02 0.00 0.00 177.57 177.93 1ik0 h LYS 97 N 0.42 0.25 -1.00 1.57 1.57 -1.29 0.44 116.57 118.53 1ik0 h LYS 97 Ca 0.12 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.89 1ik0 h LYS 97 Cb 0.05 -0.06 -0.05 0.00 0.08 0.00 0.00 32.23 32.25 1ik0 h LYS 97 CO -0.02 0.17 0.66 -0.44 -0.57 0.00 0.00 179.45 179.26 1ik0 h ASP 98 N 0.26 1.15 -0.83 0.86 3.32 -0.93 -1.19 116.42 119.06 1ik0 h ASP 98 Ca 0.07 -0.03 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 1ik0 h ASP 98 Cb -0.02 -0.29 -0.04 0.00 0.22 0.00 0.00 39.33 39.20 1ik0 h ASP 98 CO -0.01 0.84 0.39 0.25 -1.72 0.00 0.00 179.24 178.98 1ik0 h LEU 99 N 1.36 1.10 -0.68 1.55 5.85 -0.71 -2.86 115.31 120.92 1ik0 h LEU 99 Ca 0.37 -0.14 0.07 0.00 0.84 0.00 0.00 57.88 59.01 1ik0 h LEU 99 Cb -0.16 -0.28 -0.06 0.00 0.37 0.00 0.00 40.66 40.53 1ik0 h LEU 99 CO -0.08 0.94 0.37 0.25 -0.34 0.00 0.00 178.44 179.58 1ik0 h LEU 100 N 1.20 0.53 -1.01 2.25 5.85 0.34 -0.19 115.31 124.27 1ik0 h LEU 100 Ca 0.29 0.04 0.01 0.00 0.84 0.00 0.00 57.88 59.05 1ik0 h LEU 100 Cb 0.14 -0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.05 1ik0 h LEU 100 CO -0.03 0.33 0.67 -0.07 -0.34 0.00 0.00 178.44 179.00 1ik0 h LEU 101 N 0.66 1.16 -0.40 2.25 -0.00 -1.26 -2.33 115.31 115.39 1ik0 h LEU 101 Ca 0.31 -0.03 -0.18 0.00 -0.00 0.00 0.00 57.88 57.98 1ik0 h LEU 101 Cb 0.24 -0.29 -0.00 0.00 -0.00 0.00 0.00 40.66 40.61 1ik0 h LEU 101 CO -0.21 0.84 -0.63 0.45 -0.00 0.00 0.00 178.44 178.89 1ik0 h HIS 102 N 1.37 0.78 -0.00 1.13 3.86 -1.34 -2.55 115.15 118.40 1ik0 h HIS 102 Ca 0.37 -0.31 0.00 0.00 -1.16 0.00 0.00 60.37 59.27 1ik0 h HIS 102 Cb -0.16 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.18 1ik0 h HIS 102 CO -0.00 1.07 0.00 -0.07 0.86 0.00 0.00 177.93 179.80 1ik0 h LEU 103 N 0.45 0.00 -1.29 2.43 3.38 -0.54 -2.33 115.31 117.40 1ik0 h LEU 103 Ca -0.01 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.89 1ik0 h LEU 103 Cb 1.21 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.95 1ik0 h LEU 103 CO 0.12 0.00 -0.33 0.07 0.09 0.00 0.00 178.44 178.39 1ik0 h LYS 104 N 0.00 0.00 -0.33 1.13 2.10 -1.51 -3.14 116.57 114.82 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 0.00 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.32 1ik0 h LYS 104 CO -0.00 0.33 0.12 -0.22 -2.00 0.00 0.00 179.45 177.68 1ik0 h LYS 105 N 0.00 0.51 0.00 0.07 3.64 -0.98 -2.63 116.57 117.17 1ik0 h LYS 105 Ca -0.00 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 59.26 1ik0 h LYS 105 Cb 0.66 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1ik0 h LYS 105 CO 0.04 0.53 -0.08 -0.07 -2.27 0.00 0.00 179.45 177.60 1ik0 h LEU 106 N 0.39 0.00 -1.13 5.20 -0.00 -1.42 -2.45 115.31 115.90 1ik0 h LEU 106 Ca 0.11 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 58.00 1ik0 h LEU 106 Cb 0.22 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 40.84 1ik0 h LEU 106 CO -0.01 0.08 0.57 0.15 -0.00 0.00 0.00 178.44 179.24 1ik0 h PHE 107 N 0.00 1.11 -1.00 1.13 3.57 -1.50 -1.17 116.94 119.07 1ik0 h PHE 107 Ca -0.00 0.02 0.01 0.00 3.53 0.00 0.00 57.97 61.53 1ik0 h PHE 107 Cb 0.15 -0.37 -0.05 0.00 2.79 0.00 0.00 35.95 38.47 1ik0 h PHE 107 CO 0.00 0.70 0.66 0.00 -2.23 0.00 0.00 178.31 177.44 1ik0 h ARG 108 N 1.19 1.32 0.00 1.11 3.08 -1.47 -1.69 114.38 117.92 1ik0 h ARG 108 Ca 0.32 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 60.29 1ik0 h ARG 108 Cb -0.13 -0.30 0.00 0.00 0.08 0.00 0.00 29.97 29.62 1ik0 h ARG 108 CO -0.07 0.88 -0.27 0.39 -1.07 0.00 0.00 179.97 179.83 1ik0 n GLU 109 N -4.38 0.01 -0.84 0.04 1.02 -0.89 -4.89 120.64 110.71 1ik0 n GLU 109 Ca 0.12 0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.26 1ik0 n GLU 109 Cb 0.01 -1.51 0.00 0.00 -0.02 0.00 0.00 31.44 29.93 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 1.49 0.45 3.47 0.62 0.00 -0.49 -4.94 105.19 105.80 1ik0 n GLY 110 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.61 3.15 -0.24 1.61 0.52 -1.20 -4.99 118.95 117.18 1ik0 s ARG 111 Ca 0.00 -0.74 -0.12 0.00 -0.52 0.00 0.00 55.73 54.35 1ik0 s ARG 111 Cb 0.00 -4.03 -0.05 0.00 0.52 0.00 0.00 34.95 31.39 1ik0 s ARG 111 CO 0.00 -1.07 0.24 -0.06 0.02 0.00 0.00 175.30 174.43 1ik0 s PHE 112 N 2.53 3.31 0.00 -0.53 0.08 -1.26 -4.74 117.98 117.36 1ik0 s PHE 112 Ca 0.16 0.32 0.00 0.00 0.12 0.00 0.00 56.93 57.52 1ik0 s PHE 112 Cb -0.18 -2.38 0.00 0.00 -0.57 0.00 0.00 43.02 39.90 1ik0 s PHE 112 CO 0.14 -0.02 0.00 0.27 -0.10 0.00 0.00 175.22 175.51