#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3icl h THR 2 N 0.00 0.72 -0.62 5.18 2.02 -1.95 2.04 112.91 120.30 3icl h THR 2 Ca 0.00 -0.22 -0.05 0.00 0.77 0.00 0.00 66.41 66.91 3icl h THR 2 Cb 0.00 0.01 -0.03 0.00 -1.74 0.00 0.00 68.15 66.39 3icl h THR 2 CO 0.00 0.12 0.21 0.58 0.37 0.00 0.00 175.52 176.80 3icl h VAL 3 N 0.65 1.24 0.00 3.16 2.07 -1.98 -3.35 116.25 118.05 3icl h VAL 3 Ca 0.49 -0.81 -0.03 0.00 0.82 0.00 0.00 66.70 67.17 3icl h VAL 3 Cb 0.71 0.60 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 3icl h VAL 3 CO -0.37 0.31 -1.51 0.35 0.02 0.00 0.00 177.57 176.37 3icl n THR 4 N -4.39 0.11 -0.87 2.57 -2.24 -0.94 -4.20 114.28 104.31 3icl n THR 4 Ca 0.04 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 3icl n THR 4 Cb 0.20 0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 3icl n THR 4 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3icl n GLY 5 N 1.99 0.67 3.89 3.38 0.00 0.69 -4.87 105.19 110.93 3icl n GLY 5 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 3icl n GLY 5 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3icl s LEU 6 N 0.00 2.99 0.72 0.99 1.43 -1.24 -4.71 118.68 118.86 3icl s LEU 6 Ca 0.00 1.10 -0.15 0.00 -1.03 0.00 0.00 54.13 54.05 3icl s LEU 6 Cb 0.00 -3.93 0.03 0.00 0.03 0.00 0.00 46.19 42.32 3icl s LEU 6 CO 0.00 -1.24 1.21 -2.84 0.23 0.00 0.00 176.35 173.71 3icl s PRO 7 N -5.28 2.23 1.00 1.29 0.02 -1.25 -0.59 135.00 132.41 3icl s PRO 7 Ca 0.57 1.77 -0.12 0.00 0.02 0.00 0.00 61.00 63.24 3icl s PRO 7 Cb -0.11 -1.84 0.19 0.00 0.02 0.00 0.00 34.50 32.75 3icl s PRO 7 CO 0.51 -1.77 1.08 -0.80 -0.33 0.00 0.00 177.00 175.69 3icl s ASN 8 N -1.98 2.57 0.33 2.53 0.01 -1.26 -4.53 114.94 112.61 3icl s ASN 8 Ca 0.75 1.41 0.03 0.00 -0.71 0.00 0.00 52.86 54.34 3icl s ASN 8 Cb -0.29 -2.09 0.58 0.00 0.41 0.00 0.00 41.25 39.86 3icl s ASN 8 CO 0.44 -3.20 1.90 -0.09 -1.51 0.00 0.00 177.10 174.64 3icl h ARG 9 N -1.93 0.63 -0.32 -0.60 9.65 -1.94 -1.09 114.38 118.77 3icl h ARG 9 Ca -0.54 -0.11 -0.06 0.00 -1.10 0.00 0.00 59.98 58.17 3icl h ARG 9 Cb 1.31 -0.10 -0.01 0.00 -1.39 0.00 0.00 29.97 29.78 3icl h ARG 9 CO 0.54 0.58 -0.03 0.37 2.80 0.00 0.00 179.97 184.22 3icl h GLN 10 N 0.62 0.59 -0.52 0.20 5.75 -1.99 -0.92 115.11 118.84 3icl h GLN 10 Ca 0.14 -0.21 -0.10 0.00 -0.15 0.00 0.00 58.65 58.34 3icl h GLN 10 Cb 0.23 -0.04 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 3icl h GLN 10 CO -0.00 0.75 -0.06 1.25 -2.65 0.00 0.00 178.83 178.12 3icl h LEU 11 N 0.38 0.95 -0.47 -2.39 5.85 -1.84 -0.43 115.31 117.36 3icl h LEU 11 Ca 0.09 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 58.49 3icl h LEU 11 Cb 0.50 -0.26 -0.03 0.00 0.37 0.00 0.00 40.66 41.25 3icl h LEU 11 CO 0.02 1.06 0.29 0.15 -0.34 0.00 0.00 178.44 179.62 3icl h PHE 12 N 0.82 0.55 -0.50 1.25 3.04 -1.11 0.95 116.94 121.95 3icl h PHE 12 Ca 0.14 0.02 0.06 0.00 3.98 0.00 0.00 57.97 62.17 3icl h PHE 12 Cb 0.60 -0.18 -0.05 0.00 2.56 0.00 0.00 35.95 38.88 3icl h PHE 12 CO 0.04 0.33 0.20 0.00 -2.02 0.00 0.00 178.31 176.86 3icl h ASP 14 N 0.39 0.88 -0.48 0.00 3.32 -0.41 -1.77 116.42 118.36 3icl h ASP 14 Ca 0.24 -0.22 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 3icl h ASP 14 Cb 0.23 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 3icl h ASP 14 CO -0.23 0.87 0.27 0.03 -1.72 0.00 0.00 179.24 178.46 3icl h ARG 15 N 0.85 0.66 -0.46 3.56 2.47 -0.11 -2.16 114.38 119.18 3icl h ARG 15 Ca 0.19 -0.07 -0.03 0.00 -1.26 0.00 0.00 59.98 58.81 3icl h ARG 15 Cb 0.32 -0.13 -0.02 0.00 -1.65 0.00 0.00 29.97 28.49 3icl h ARG 15 CO -0.00 0.51 0.18 1.25 0.56 0.00 0.00 179.97 182.47 3icl h LEU 16 N 0.63 0.64 -0.77 3.04 5.85 -0.66 -1.17 115.31 122.87 3icl h LEU 16 Ca 0.17 -0.17 0.01 0.00 0.84 0.00 0.00 57.88 58.72 3icl h LEU 16 Cb 0.04 -0.17 -0.04 0.00 0.37 0.00 0.00 40.66 40.86 3icl h LEU 16 CO -0.03 0.64 0.50 -0.07 -0.34 0.00 0.00 178.44 179.14 3icl h LEU 17 N 0.61 0.89 -0.53 2.25 3.38 -1.17 -0.98 115.31 119.75 3icl h LEU 17 Ca 0.15 -0.03 -0.12 0.00 0.09 0.00 0.00 57.88 57.97 3icl h LEU 17 Cb 0.20 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.71 3icl h LEU 17 CO -0.01 0.65 -0.16 -0.61 0.09 0.00 0.00 178.44 178.40 3icl h GLN 18 N 1.05 1.02 -0.63 1.13 5.75 -1.15 -2.50 115.11 119.77 3icl h GLN 18 Ca 0.28 -0.40 -0.09 0.00 -0.15 0.00 0.00 58.65 58.29 3icl h GLN 18 Cb -0.11 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.37 3icl h GLN 18 CO -0.06 1.09 0.05 0.00 -2.65 0.00 0.00 178.83 177.26 3icl h ALA 19 N 0.91 0.90 0.00 3.38 0.00 -0.87 -0.91 119.26 122.68 3icl h ALA 19 Ca 0.13 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.70 3icl h ALA 19 Cb 0.74 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 3icl h ALA 19 CO 0.06 0.66 -0.25 -0.07 0.00 0.00 0.00 179.25 179.65 3icl h LEU 20 N 0.99 0.00 0.03 0.00 3.38 -1.05 0.34 115.31 119.00 3icl h LEU 20 Ca 0.19 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 57.91 3icl h LEU 20 Cb 0.49 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 3icl h LEU 20 CO 0.02 0.25 -1.13 0.00 0.09 0.00 0.00 178.44 177.67 3icl h ALA 21 N 1.75 0.22 0.19 1.53 0.00 -1.00 -3.36 119.26 118.59 3icl h ALA 21 Ca -0.00 -0.86 -0.33 0.00 0.00 0.00 0.00 54.91 53.71 3icl h ALA 21 Cb 0.48 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.25 3icl h ALA 21 CO 0.03 1.02 -1.58 0.00 0.00 0.00 0.00 179.25 178.72 3icl h ALA 22 N 0.73 0.07 -3.83 0.00 0.00 -0.68 -3.44 119.26 112.11 3icl h ALA 22 Ca -0.09 -1.03 -0.67 0.00 0.00 0.00 0.00 54.91 53.13 3icl h ALA 22 Cb 1.85 0.30 -0.38 0.00 0.00 0.00 0.00 17.79 19.56 3icl h ALA 22 CO 0.18 0.94 -0.78 -1.01 0.00 0.00 0.00 179.25 178.57 3icl s HIS 23 N -2.60 3.35 -0.03 0.00 3.76 0.11 -4.88 115.29 115.01 3icl s HIS 23 Ca -0.11 -2.45 0.04 0.00 -0.15 0.00 0.00 55.06 52.38 3icl s HIS 23 Cb 0.05 -2.12 0.06 0.00 1.11 0.00 0.00 32.58 31.68 3icl s HIS 23 CO 0.89 -0.89 0.93 0.39 -0.85 0.00 0.00 174.74 175.20 3icl n GLU 24 N 4.40 0.48 -3.29 1.40 -0.58 -1.26 -3.96 120.64 117.82 3icl n GLU 24 Ca -0.10 -1.25 -0.37 0.00 -0.42 0.00 0.00 57.16 55.02 3icl n GLU 24 Cb 0.42 -0.73 -0.06 0.00 -0.57 0.00 0.00 31.44 30.50 3icl n GLU 24 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 3icl s ARG 25 N -0.64 4.09 0.59 3.49 0.52 -1.26 -4.92 118.95 120.82 3icl s ARG 25 Ca 0.06 0.63 0.37 0.00 -0.52 0.00 0.00 55.73 56.27 3icl s ARG 25 Cb 0.06 -3.03 1.80 0.00 0.52 0.00 0.00 34.95 34.30 3icl s ARG 25 CO 0.01 0.52 2.15 0.22 0.02 0.00 0.00 175.30 178.22 3icl h ASP 26 N 3.86 0.00 0.93 0.23 3.58 -1.97 -1.64 116.42 121.40 3icl h ASP 26 Ca -0.49 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.96 3icl h ASP 26 Cb 1.20 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.25 3icl h ASP 26 CO 0.65 0.03 -0.46 0.61 -2.88 0.00 0.00 179.24 177.18 3icl n GLY 27 N -0.53 -1.45 2.56 -0.78 0.00 -1.26 -4.33 105.19 99.40 3icl n GLY 27 Ca -0.01 -0.21 -0.11 0.00 0.00 0.00 0.00 46.02 45.68 3icl n GLY 27 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3icl n ASN 28 N -2.02 -0.60 -4.77 1.61 5.15 -0.95 -3.97 115.26 109.72 3icl n ASN 28 Ca 0.04 -3.04 -0.29 0.00 -0.60 0.00 0.00 54.58 50.69 3icl n ASN 28 Cb 0.42 0.52 0.13 0.00 -0.53 0.00 0.00 39.78 40.32 3icl n ASN 28 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 3icl s PRO 29 N -1.19 1.34 0.05 1.20 0.04 -0.66 -4.27 135.00 131.51 3icl s PRO 29 Ca 0.28 0.48 -0.22 0.00 0.04 0.00 0.00 61.00 61.57 3icl s PRO 29 Cb 0.37 -1.85 -0.06 0.00 0.04 0.00 0.00 34.50 33.00 3icl s PRO 29 CO -0.05 -2.10 0.67 0.08 0.04 0.00 0.00 177.00 175.64 3icl s VAL 30 N -3.17 4.74 -0.02 -0.36 1.01 -1.25 -0.61 120.40 120.75 3icl s VAL 30 Ca 0.63 1.42 0.03 0.00 0.00 0.00 0.00 61.98 64.06 3icl s VAL 30 Cb -0.15 -4.01 -0.00 0.00 0.00 0.00 0.00 36.38 32.21 3icl s VAL 30 CO 0.54 0.45 -0.12 -0.69 0.00 0.00 0.00 175.10 175.28 3icl s VAL 31 N -0.48 0.95 -0.12 2.92 1.01 -1.07 -1.72 120.40 121.89 3icl s VAL 31 Ca 0.33 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.85 3icl s VAL 31 Cb -0.20 -0.81 -0.00 0.00 0.00 0.00 0.00 36.38 35.37 3icl s VAL 31 CO 0.21 0.28 -0.19 -0.22 0.00 0.00 0.00 175.10 175.17 3icl s LEU 32 N -0.07 2.34 -0.09 3.92 2.96 -0.39 -0.39 118.68 126.96 3icl s LEU 32 Ca 0.01 -0.48 0.01 0.00 -0.22 0.00 0.00 54.13 53.45 3icl s LEU 32 Cb -0.07 -1.50 -0.02 0.00 0.50 0.00 0.00 46.19 45.10 3icl s LEU 32 CO 0.00 0.14 -0.11 -0.76 -1.32 0.00 0.00 176.35 174.29 3icl s LEU 33 N 0.50 2.86 -0.27 -0.68 1.02 0.43 -1.26 118.68 121.28 3icl s LEU 33 Ca -0.13 -0.20 0.02 0.00 0.02 0.00 0.00 54.13 53.85 3icl s LEU 33 Cb -0.17 -1.62 0.06 0.00 0.02 0.00 0.00 46.19 44.48 3icl s LEU 33 CO 0.05 0.28 -0.08 0.12 0.02 0.00 0.00 176.35 176.73 3icl s PHE 34 N -0.30 3.29 -0.11 0.29 2.19 -0.36 0.40 117.98 123.38 3icl s PHE 34 Ca 0.03 -2.28 -0.05 0.00 0.33 0.00 0.00 56.93 54.96 3icl s PHE 34 Cb -0.13 -2.01 -0.04 0.00 -1.31 0.00 0.00 43.02 39.53 3icl s PHE 34 CO 0.03 -0.87 0.09 -1.17 1.83 0.00 0.00 175.22 175.13 3icl s LEU 35 N 1.12 4.10 -0.08 6.12 0.20 0.44 -1.53 118.68 129.05 3icl s LEU 35 Ca -0.07 0.35 0.03 0.00 0.69 0.00 0.00 54.13 55.13 3icl s LEU 35 Cb -0.20 -1.98 0.00 0.00 -0.43 0.00 0.00 46.19 43.58 3icl s LEU 35 CO -0.04 0.40 -0.20 -0.62 -0.29 0.00 0.00 176.35 175.60 3icl s ASP 36 N -0.96 2.59 -0.85 3.68 -1.08 -0.20 -0.65 116.67 119.21 3icl s ASP 36 Ca 0.14 -0.46 -0.19 0.00 -0.52 0.00 0.00 52.55 51.52 3icl s ASP 36 Cb -0.12 -1.16 0.13 0.00 -1.46 0.00 0.00 42.92 40.31 3icl s ASP 36 CO 0.03 0.12 1.03 -0.69 0.52 0.00 0.00 175.17 176.18 3icl s VAL 37 N 0.43 4.75 0.25 1.11 1.01 -0.93 -1.96 120.40 125.06 3icl s VAL 37 Ca -0.17 -1.41 -0.03 0.00 0.00 0.00 0.00 61.98 60.37 3icl s VAL 37 Cb -0.17 -4.71 0.23 0.00 0.00 0.00 0.00 36.38 31.73 3icl s VAL 37 CO 0.07 -1.42 1.71 0.44 0.00 0.00 0.00 175.10 175.90 3icl h ASP 38 N 8.89 0.22 -0.54 3.32 3.32 -1.33 -2.69 116.42 127.62 3icl h ASP 38 Ca 0.04 0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.21 3icl h ASP 38 Cb 1.04 0.12 -0.00 0.00 0.22 0.00 0.00 39.33 40.71 3icl h ASP 38 CO 1.09 0.05 0.01 -0.46 -1.72 0.00 0.00 179.24 178.21 3icl n ASN 39 N -5.05 5.49 -0.13 6.45 6.94 -1.25 -4.63 115.26 123.09 3icl n ASN 39 Ca 0.16 -2.96 -0.08 0.00 -0.02 0.00 0.00 54.58 51.67 3icl n ASN 39 Cb 0.47 -0.67 -0.00 0.00 -2.36 0.00 0.00 39.78 37.21 3icl n ASN 39 CO 0.00 0.00 0.00 0.15 -1.03 0.00 0.00 177.26 176.38 3icl h PHE 40 N 3.68 0.51 -0.43 -2.53 3.57 -1.81 -2.75 116.94 117.18 3icl h PHE 40 Ca 0.01 0.00 0.07 0.00 3.53 0.00 0.00 57.97 61.58 3icl h PHE 40 Cb 1.93 -0.17 -0.06 0.00 2.79 0.00 0.00 35.95 40.44 3icl h PHE 40 CO 1.03 0.35 0.07 -0.22 -2.23 0.00 0.00 178.31 177.31 3icl h LYS 41 N 0.52 0.20 -0.90 1.11 3.64 -1.83 0.58 116.57 119.89 3icl h LYS 41 Ca 0.14 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.49 3icl h LYS 41 Cb -0.02 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 3icl h LYS 41 CO -0.03 0.13 0.49 0.66 -2.27 0.00 0.00 179.45 178.43 3icl h SER 42 N 0.20 1.13 0.38 4.20 4.64 -1.90 0.24 113.55 122.44 3icl h SER 42 Ca 0.21 -0.10 -0.02 0.00 -0.47 0.00 0.00 61.79 61.41 3icl h SER 42 Cb 0.27 -0.29 0.00 0.00 -0.31 0.00 0.00 62.40 62.07 3icl h SER 42 CO -0.28 0.90 -0.18 0.40 -0.87 0.00 0.00 176.83 176.80 3icl h ILE 43 N 1.26 0.60 -0.84 0.95 1.08 -0.96 -0.29 117.51 119.30 3icl h ILE 43 Ca 0.32 -0.42 0.09 0.00 -0.39 0.00 0.00 64.86 64.45 3icl h ILE 43 Cb 0.03 0.80 -0.06 0.00 -3.07 0.00 0.00 36.82 34.52 3icl h ILE 43 CO -0.05 0.08 0.55 -1.13 -0.69 0.00 0.00 178.15 176.90 3icl h ASN 44 N -0.77 0.76 0.03 1.72 -1.24 0.34 0.21 115.58 116.64 3icl h ASN 44 Ca -0.05 0.02 -0.00 0.00 0.71 0.00 0.00 56.30 56.97 3icl h ASN 44 Cb 0.52 -0.14 0.00 0.00 0.73 0.00 0.00 38.32 39.43 3icl h ASN 44 CO 0.09 0.46 -0.02 0.44 -1.29 0.00 0.00 177.43 177.11 3icl h ASP 45 N 0.85 -0.04 0.02 1.15 3.32 -0.43 -0.96 116.42 120.33 3icl h ASP 45 Ca 0.38 -0.46 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 3icl h ASP 45 Cb 0.37 0.01 0.00 0.00 0.22 0.00 0.00 39.33 39.93 3icl h ASP 45 CO -0.15 0.45 -0.01 0.28 -1.72 0.00 0.00 179.24 178.08 3icl h SER 46 N -0.53 -0.03 0.81 6.45 0.02 -0.61 -3.31 113.55 116.35 3icl h SER 46 Ca -0.00 -0.17 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 3icl h SER 46 Cb 0.49 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.04 3icl h SER 46 CO 0.01 0.15 -0.63 0.18 -1.14 0.00 0.00 176.83 175.39 3icl n LEU 47 N -5.02 0.67 0.00 5.07 4.77 0.71 -5.08 117.00 118.13 3icl n LEU 47 Ca -0.08 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 3icl n LEU 47 Cb 0.12 -0.19 0.00 0.00 -2.33 0.00 0.00 43.42 41.02 3icl n LEU 47 CO 0.33 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 3icl n GLY 48 N 1.35 1.02 0.27 -0.72 0.00 -0.36 -4.48 105.19 102.26 3icl n GLY 48 Ca 0.03 -1.76 0.15 0.00 0.00 0.00 0.00 46.02 44.44 3icl n GLY 48 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 173.32 173.77 3icl h HIS 49 N 0.00 0.00 0.05 1.61 3.86 -1.93 -1.65 115.15 117.09 3icl h HIS 49 Ca 0.00 0.00 -0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3icl h HIS 49 Cb 0.00 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.47 3icl h HIS 49 CO 0.00 0.08 -0.02 -0.07 0.86 0.00 0.00 177.93 178.78 3icl h LEU 50 N 0.00 -0.06 -0.52 2.43 3.38 -1.94 0.83 115.31 119.43 3icl h LEU 50 Ca -0.00 -0.16 -0.14 0.00 0.09 0.00 0.00 57.88 57.67 3icl h LEU 50 Cb 0.44 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 3icl h LEU 50 CO 0.01 0.13 -0.33 0.58 0.09 0.00 0.00 178.44 178.92 3icl h VAL 51 N -0.24 1.28 -0.46 1.22 2.07 -1.75 -2.67 116.25 115.70 3icl h VAL 51 Ca -0.01 -1.49 0.04 0.00 0.82 0.00 0.00 66.70 66.06 3icl h VAL 51 Cb 0.22 1.34 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 3icl h VAL 51 CO 0.01 0.50 0.22 1.23 0.02 0.00 0.00 177.57 179.55 3icl h GLY 52 N 0.89 0.63 1.05 2.17 0.00 -1.12 0.62 103.07 107.31 3icl h GLY 52 Ca 0.07 -0.15 -0.08 0.00 0.00 0.00 0.00 47.33 47.18 3icl h GLY 52 CO 0.08 0.09 0.08 -0.55 0.00 0.00 0.00 176.54 176.24 3icl h ASP 53 N 0.44 0.99 -0.74 0.19 3.32 -0.78 -1.59 116.42 118.24 3icl h ASP 53 Ca 0.20 -0.27 0.00 0.00 0.02 0.00 0.00 57.03 56.98 3icl h ASP 53 Cb 0.12 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 3icl h ASP 53 CO -0.15 1.01 0.48 0.03 -1.72 0.00 0.00 179.24 178.89 3icl h ARG 54 N 0.93 0.99 -0.40 3.56 3.08 -1.07 -1.56 114.38 119.90 3icl h ARG 54 Ca 0.18 -0.07 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 3icl h ARG 54 Cb 0.46 -0.22 -0.02 0.00 0.08 0.00 0.00 29.97 30.27 3icl h ARG 54 CO 0.02 0.67 0.21 1.25 -1.07 0.00 0.00 179.97 181.04 3icl h LEU 55 N 1.01 0.51 -1.13 3.04 5.85 -0.57 -1.25 115.31 122.76 3icl h LEU 55 Ca 0.27 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.89 3icl h LEU 55 Cb -0.09 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 40.77 3icl h LEU 55 CO -0.06 0.47 0.59 -0.07 -0.34 0.00 0.00 178.44 179.03 3icl h LEU 56 N 0.51 1.02 -0.46 2.25 3.38 -0.90 0.49 115.31 121.59 3icl h LEU 56 Ca 0.14 -0.03 -0.17 0.00 0.09 0.00 0.00 57.88 57.91 3icl h LEU 56 Cb 0.09 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.58 3icl h LEU 56 CO -0.02 0.74 -0.58 -0.09 0.09 0.00 0.00 178.44 178.58 3icl h ARG 57 N 1.20 0.59 -0.02 1.13 2.43 -1.01 -1.46 114.38 117.25 3icl h ARG 57 Ca 0.33 -0.39 -0.13 0.00 -0.81 0.00 0.00 59.98 58.97 3icl h ARG 57 Cb -0.14 0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3icl h ARG 57 CO -0.07 1.00 -0.62 0.00 -1.51 0.00 0.00 179.97 178.78 3icl h ALA 58 N 0.91 0.95 -0.17 2.80 0.00 -0.75 -2.46 119.26 120.53 3icl h ALA 58 Ca 0.00 -0.56 -0.16 0.00 0.00 0.00 0.00 54.91 54.19 3icl h ALA 58 Cb 1.14 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3icl h ALA 58 CO 0.11 0.76 -0.53 1.15 0.00 0.00 0.00 179.25 180.74 3icl h THR 59 N 0.04 1.32 -0.80 0.00 2.02 -0.79 -2.42 112.91 112.28 3icl h THR 59 Ca -0.01 -1.77 -0.01 0.00 0.77 0.00 0.00 66.41 65.39 3icl h THR 59 Cb 1.10 1.95 -0.04 0.00 -1.74 0.00 0.00 68.15 69.43 3icl h THR 59 CO 0.08 0.55 0.46 0.00 0.37 0.00 0.00 175.52 176.99 3icl h ALA 60 N 0.56 1.30 -0.21 6.16 0.00 -1.19 -1.15 119.26 124.73 3icl h ALA 60 Ca -0.02 -0.10 -0.21 0.00 0.00 0.00 0.00 54.91 54.58 3icl h ALA 60 Cb 1.15 -0.32 0.01 0.00 0.00 0.00 0.00 17.79 18.62 3icl h ALA 60 CO 0.11 0.58 -0.68 0.93 0.00 0.00 0.00 179.25 180.20 3icl h GLU 61 N 1.11 0.83 -0.13 0.00 5.08 -1.43 -2.43 114.58 117.61 3icl h GLU 61 Ca 0.29 -0.61 -0.07 0.00 -1.00 0.00 0.00 59.36 57.97 3icl h GLU 61 Cb -0.01 0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 3icl h GLU 61 CO -0.05 1.22 -0.26 0.00 -1.00 0.00 0.00 179.01 178.93 3icl h ARG 62 N 0.60 0.23 -0.36 2.33 3.08 -1.15 -1.92 114.38 117.18 3icl h ARG 62 Ca -0.02 -0.08 -0.06 0.00 0.07 0.00 0.00 59.98 59.90 3icl h ARG 62 Cb 1.30 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 31.31 3icl h ARG 62 CO 0.14 0.48 0.00 0.82 -1.07 0.00 0.00 179.97 180.35 3icl h ILE 63 N 0.21 1.26 -0.21 2.04 2.04 -1.12 -2.73 117.51 119.00 3icl h ILE 63 Ca 0.03 -0.97 -0.02 0.00 1.00 0.00 0.00 64.86 64.90 3icl h ILE 63 Cb 0.57 1.17 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 3icl h ILE 63 CO 0.04 0.32 0.04 0.03 0.00 0.00 0.00 178.15 178.59 3icl h ARG 64 N 0.45 0.30 0.00 2.37 3.08 -0.93 -0.96 114.38 118.69 3icl h ARG 64 Ca 0.10 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 3icl h ARG 64 Cb 0.45 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.44 3icl h ARG 64 CO 0.02 0.29 -0.01 1.79 -1.07 0.00 0.00 179.97 180.98 3icl h THR 65 N 0.30 0.03 0.00 2.04 1.35 -1.08 -3.08 112.91 112.47 3icl h THR 65 Ca 0.07 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 65.28 3icl h THR 65 Cb 0.13 1.63 0.00 0.00 -1.73 0.00 0.00 68.15 68.18 3icl h THR 65 CO -0.00 0.01 -0.84 0.00 -0.25 0.00 0.00 175.52 174.44 3icl n ALA 66 N -2.10 4.08 -2.77 6.62 0.00 -0.41 -4.94 120.51 120.99 3icl n ALA 66 Ca 0.01 -0.48 -0.02 0.00 0.00 0.00 0.00 53.44 52.96 3icl n ALA 66 Cb 0.36 -0.93 0.01 0.00 0.00 0.00 0.00 19.45 18.89 3icl n ALA 66 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3icl n VAL 67 N -1.58 0.00 -4.04 0.00 0.24 -0.94 -4.67 118.33 107.34 3icl n VAL 67 Ca 0.04 -0.14 -0.27 0.00 -2.04 0.00 0.00 64.34 61.93 3icl n VAL 67 Cb 0.35 -1.08 -0.05 0.00 -1.47 0.00 0.00 33.84 31.59 3icl n VAL 67 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 3icl s ARG 68 N -2.32 3.03 0.24 7.34 3.00 -1.26 -5.01 118.95 123.97 3icl s ARG 68 Ca 0.05 -0.75 -0.31 0.00 0.00 0.00 0.00 55.73 54.72 3icl s ARG 68 Cb -0.00 -2.75 -0.12 0.00 0.00 0.00 0.00 34.95 32.07 3icl s ARG 68 CO 0.03 0.52 1.65 -3.47 0.00 0.00 0.00 175.30 174.03 3icl n ASP 69 N -0.15 3.82 0.00 0.23 2.03 -1.26 -0.95 116.55 120.27 3icl n ASP 69 Ca -0.08 1.10 0.00 0.00 0.52 0.00 0.00 54.79 56.33 3icl n ASP 69 Cb 0.54 -1.57 0.00 0.00 -0.72 0.00 0.00 41.12 39.37 3icl n ASP 69 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3icl n GLY 70 N 3.10 2.78 3.88 0.27 0.00 -1.26 -5.05 105.19 108.91 3icl n GLY 70 Ca 0.13 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.85 3icl n GLY 70 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3icl s ASP 71 N -1.43 6.26 -0.01 1.61 1.01 -0.12 -4.64 116.67 119.34 3icl s ASP 71 Ca 0.00 1.26 0.07 0.00 0.71 0.00 0.00 52.55 54.59 3icl s ASP 71 Cb 0.00 -2.40 -0.02 0.00 1.01 0.00 0.00 42.92 41.52 3icl s ASP 71 CO 0.00 -0.76 -0.22 -0.89 0.21 0.00 0.00 175.17 173.51 3icl s THR 72 N -3.01 1.73 -0.03 -1.27 2.01 -0.97 -4.96 115.64 109.14 3icl s THR 72 Ca 0.53 -0.95 0.04 0.00 0.31 0.00 0.00 61.69 61.62 3icl s THR 72 Cb -0.11 -1.44 -0.01 0.00 0.01 0.00 0.00 72.50 70.96 3icl s THR 72 CO 0.50 0.47 -0.16 -0.69 -0.69 0.00 0.00 174.62 174.05 3icl s VAL 73 N -0.53 1.31 -0.07 3.82 1.01 -1.26 -0.54 120.40 124.14 3icl s VAL 73 Ca 0.08 -0.68 -0.12 0.00 0.00 0.00 0.00 61.98 61.27 3icl s VAL 73 Cb -0.08 -1.12 0.02 0.00 0.00 0.00 0.00 36.38 35.20 3icl s VAL 73 CO -0.01 0.38 0.29 0.00 0.00 0.00 0.00 175.10 175.76 3icl s ALA 74 N -0.12 -0.71 0.38 5.51 0.00 -0.75 -3.85 121.76 122.22 3icl s ALA 74 Ca 0.01 0.56 -0.16 0.00 0.00 0.00 0.00 51.96 52.37 3icl s ALA 74 Cb -0.09 -0.23 -0.09 0.00 0.00 0.00 0.00 23.12 22.71 3icl s ALA 74 CO 0.01 -0.19 0.82 0.50 0.00 0.00 0.00 175.76 176.90 3icl s ARG 75 N -0.52 4.02 -0.02 0.00 3.52 -1.26 -0.17 118.95 124.51 3icl s ARG 75 Ca -0.06 0.78 -0.26 0.00 -0.13 0.00 0.00 55.73 56.06 3icl s ARG 75 Cb -0.04 -2.33 0.06 0.00 -1.56 0.00 0.00 34.95 31.08 3icl s ARG 75 CO 0.02 0.03 0.58 -1.50 -0.81 0.00 0.00 175.30 173.61 3icl s ILE 76 N -2.17 0.02 -1.52 4.11 2.07 0.35 -4.83 121.20 119.23 3icl s ILE 76 Ca 0.56 -0.14 -0.02 0.00 -1.41 0.00 0.00 60.65 59.64 3icl s ILE 76 Cb -0.10 -0.92 0.01 0.00 0.13 0.00 0.00 42.46 41.58 3icl s ILE 76 CO 0.20 -0.08 0.21 0.61 -1.91 0.00 0.00 174.94 173.97 3icl n GLY 77 N 0.87 -0.51 5.00 1.50 0.00 -1.26 -1.30 105.19 109.49 3icl n GLY 77 Ca -0.19 0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3icl n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3icl n GLY 78 N -1.12 1.53 0.42 -0.02 0.00 -1.26 -4.26 105.19 100.48 3icl n GLY 78 Ca -0.17 -0.02 0.07 0.00 0.00 0.00 0.00 46.02 45.90 3icl n GLY 78 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3icl n ASP 79 N 3.50 2.02 -4.51 1.61 5.75 -1.24 -5.03 116.55 118.65 3icl n ASP 79 Ca 0.00 -3.58 -0.24 0.00 -0.01 0.00 0.00 54.79 50.96 3icl n ASP 79 Cb 0.00 -0.50 -0.09 0.00 -1.03 0.00 0.00 41.12 39.50 3icl n ASP 79 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 3icl s LYS 80 N -3.10 1.82 -0.02 0.11 3.01 -0.42 -2.20 119.74 118.95 3icl s LYS 80 Ca 0.36 -1.71 0.01 0.00 -1.01 0.00 0.00 55.97 53.62 3icl s LYS 80 Cb 0.34 -1.85 0.01 0.00 -1.01 0.00 0.00 37.83 35.32 3icl s LYS 80 CO -0.03 0.32 -0.04 -0.06 0.51 0.00 0.00 175.35 176.05 3icl s PHE 81 N -2.48 0.51 -0.23 3.18 0.08 0.17 -0.50 117.98 118.72 3icl s PHE 81 Ca 0.31 -0.10 -0.09 0.00 0.12 0.00 0.00 56.93 57.17 3icl s PHE 81 Cb -0.05 -0.43 -0.04 0.00 -0.57 0.00 0.00 43.02 41.93 3icl s PHE 81 CO 0.16 -0.09 0.12 0.95 -0.10 0.00 0.00 175.22 176.26 3icl s THR 82 N 0.42 4.95 -0.21 0.64 -4.23 0.76 -0.42 115.64 117.54 3icl s THR 82 Ca -0.05 0.04 -0.02 0.00 -1.18 0.00 0.00 61.69 60.48 3icl s THR 82 Cb -0.08 -3.30 0.00 0.00 1.34 0.00 0.00 72.50 70.46 3icl s THR 82 CO -0.00 0.36 -0.09 -0.63 -0.54 0.00 0.00 174.62 173.72 3icl s ILE 83 N 1.11 2.95 -0.27 2.99 1.01 0.16 -1.81 121.20 127.35 3icl s ILE 83 Ca 0.06 -0.66 -0.10 0.00 0.00 0.00 0.00 60.65 59.95 3icl s ILE 83 Cb -0.14 -2.33 -0.05 0.00 0.01 0.00 0.00 42.46 39.95 3icl s ILE 83 CO 0.04 0.44 0.17 -0.22 0.00 0.00 0.00 174.94 175.38 3icl s LEU 84 N 1.41 3.95 -0.48 2.97 2.96 0.29 -0.43 118.68 129.36 3icl s LEU 84 Ca 0.05 -0.02 -0.16 0.00 -0.22 0.00 0.00 54.13 53.78 3icl s LEU 84 Cb -0.14 -2.09 0.07 0.00 0.50 0.00 0.00 46.19 44.53 3icl s LEU 84 CO -0.06 -0.03 0.45 -0.76 -1.32 0.00 0.00 176.35 174.63 3icl s LEU 85 N 1.65 5.46 -1.29 -0.68 1.43 0.48 -2.29 118.68 123.43 3icl s LEU 85 Ca 0.07 -1.22 -0.17 0.00 -1.03 0.00 0.00 54.13 51.78 3icl s LEU 85 Cb -0.16 -2.25 0.01 0.00 0.03 0.00 0.00 46.19 43.82 3icl s LEU 85 CO 0.09 -0.71 2.06 -3.20 0.23 0.00 0.00 176.35 174.82 3icl n ASN 86 N 5.45 3.82 -0.50 2.29 5.15 -1.26 -2.59 115.26 127.62 3icl n ASN 86 Ca -0.11 -2.82 0.00 0.00 -0.60 0.00 0.00 54.58 51.05 3icl n ASN 86 Cb 0.44 -1.59 0.00 0.00 -0.53 0.00 0.00 39.78 38.10 3icl n ASN 86 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3icl n GLY 87 N 4.55 -0.94 1.88 8.20 0.00 -1.22 -4.95 105.19 112.72 3icl n GLY 87 Ca 0.51 -0.64 -0.15 0.00 0.00 0.00 0.00 46.02 45.74 3icl n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3icl n ALA 88 N 0.40 4.67 -1.67 4.61 0.00 0.23 -4.91 120.51 123.83 3icl n ALA 88 Ca 0.00 -2.09 -0.44 0.00 0.00 0.00 0.00 53.44 50.91 3icl n ALA 88 Cb 0.00 -1.31 -0.02 0.00 0.00 0.00 0.00 19.45 18.13 3icl n ALA 88 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 3icl n LYS 89 N -0.57 1.98 -1.19 0.00 4.81 -1.25 -1.71 118.16 120.23 3icl n LYS 89 Ca 0.42 0.70 -0.07 0.00 -0.87 0.00 0.00 58.31 58.49 3icl n LYS 89 Cb 1.33 -2.29 -0.03 0.00 0.02 0.00 0.00 35.03 34.06 3icl n LYS 89 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 3icl n ASP 90 N 1.46 -4.47 -0.43 3.14 8.00 -1.26 -4.84 116.55 118.14 3icl n ASP 90 Ca 0.08 0.16 0.04 0.00 0.71 0.00 0.00 54.79 55.79 3icl n ASP 90 Cb 0.33 -2.56 0.10 0.00 -0.02 0.00 0.00 41.12 38.97 3icl n ASP 90 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3icl n THR 91 N -2.58 0.81 -3.56 -3.53 -2.24 -0.69 -4.98 114.28 97.50 3icl n THR 91 Ca -0.07 -0.90 -0.21 0.00 -2.27 0.00 0.00 64.05 60.60 3icl n THR 91 Cb 0.33 0.63 0.05 0.00 -2.10 0.00 0.00 70.33 69.24 3icl n THR 91 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3icl n LEU 92 N 0.27 -3.75 -3.72 3.22 4.77 -1.26 -1.63 117.00 114.89 3icl n LEU 92 Ca 0.08 -0.81 -0.26 0.00 -0.03 0.00 0.00 56.01 54.98 3icl n LEU 92 Cb 0.34 -2.79 0.06 0.00 -2.33 0.00 0.00 43.42 38.70 3icl n LEU 92 CO 0.06 0.35 0.17 0.59 -1.33 0.00 0.00 177.39 177.23 3icl n ASN 93 N -3.03 -5.35 0.00 -1.43 4.13 -1.26 -2.06 115.26 106.26 3icl n ASN 93 Ca -0.20 -0.65 0.00 0.00 1.68 0.00 0.00 54.58 55.40 3icl n ASN 93 Cb 0.65 -4.54 0.00 0.00 -1.54 0.00 0.00 39.78 34.35 3icl n ASN 93 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3icl n GLY 94 N -1.83 2.46 0.37 7.41 0.00 -0.90 -4.91 105.19 107.78 3icl n GLY 94 Ca -0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3icl n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3icl h ALA 95 N 0.00 1.36 0.00 4.61 0.00 -0.79 -0.05 119.26 124.40 3icl h ALA 95 Ca 0.00 -0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 3icl h ALA 95 Cb 0.00 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.44 3icl h ALA 95 CO 0.00 0.52 -0.30 -0.07 0.00 0.00 0.00 179.25 179.40 3icl h LEU 96 N 1.25 0.00 0.06 0.00 3.38 -1.55 -1.41 115.31 117.04 3icl h LEU 96 Ca 0.41 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 58.15 3icl h LEU 96 Cb 0.06 0.00 0.02 0.00 0.09 0.00 0.00 40.66 40.83 3icl h LEU 96 CO -0.14 0.30 -0.93 0.58 0.09 0.00 0.00 178.44 178.34 3icl h VAL 97 N 0.00 1.36 -0.73 1.22 2.07 -1.43 -2.49 116.25 116.25 3icl h VAL 97 Ca -0.00 -2.30 -0.00 0.00 0.82 0.00 0.00 66.70 65.22 3icl h VAL 97 Cb 0.73 2.67 -0.04 0.00 -1.52 0.00 0.00 31.29 33.13 3icl h VAL 97 CO 0.04 0.69 0.44 0.00 0.02 0.00 0.00 177.57 178.76 3icl h ALA 98 N 0.29 1.41 -0.31 1.67 0.00 -0.83 -1.27 119.26 120.22 3icl h ALA 98 Ca -0.13 -0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.57 3icl h ALA 98 Cb 1.64 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 3icl h ALA 98 CO 0.18 0.51 -0.33 1.96 0.00 0.00 0.00 179.25 181.57 3icl h GLN 99 N 1.00 0.68 -0.17 0.00 4.20 -1.25 -1.52 115.11 118.04 3icl h GLN 99 Ca 0.26 -0.31 -0.14 0.00 0.06 0.00 0.00 58.65 58.52 3icl h GLN 99 Cb -0.05 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.71 3icl h GLN 99 CO -0.05 0.91 -0.48 -0.22 -0.67 0.00 0.00 178.83 178.33 3icl h LYS 100 N 0.57 0.45 0.04 1.46 3.64 -0.93 -1.03 116.57 120.77 3icl h LYS 100 Ca 0.06 -0.25 -0.00 0.00 -1.27 0.00 0.00 60.65 59.19 3icl h LYS 100 Cb 0.84 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.68 3icl h LYS 100 CO 0.07 0.83 -0.02 0.82 -2.27 0.00 0.00 179.45 178.89 3icl h ILE 101 N 0.36 1.20 -0.68 2.00 2.04 -1.14 -1.90 117.51 119.39 3icl h ILE 101 Ca 0.02 -0.77 0.06 0.00 1.00 0.00 0.00 64.86 65.17 3icl h ILE 101 Cb 0.97 1.71 -0.04 0.00 -0.74 0.00 0.00 36.82 38.72 3icl h ILE 101 CO 0.09 0.19 0.45 -0.07 0.00 0.00 0.00 178.15 178.81 3icl h LEU 102 N -0.39 0.60 -0.55 1.44 3.38 -1.13 0.13 115.31 118.79 3icl h LEU 102 Ca -0.01 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.86 3icl h LEU 102 Cb 0.36 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 40.97 3icl h LEU 102 CO 0.01 0.39 -0.07 0.44 0.09 0.00 0.00 178.44 179.30 3icl h ASP 103 N 0.68 1.01 -0.21 -0.43 3.32 -1.04 -1.53 116.42 118.23 3icl h ASP 103 Ca 0.29 -0.33 -0.20 0.00 0.02 0.00 0.00 57.03 56.81 3icl h ASP 103 Cb 0.27 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3icl h ASP 103 CO -0.09 1.11 -0.64 1.23 -1.72 0.00 0.00 179.24 179.13 3icl h GLY 104 N 0.90 0.91 1.89 2.75 0.00 -0.47 -3.21 103.07 105.85 3icl h GLY 104 Ca 0.15 -1.14 0.00 0.00 0.00 0.00 0.00 47.33 46.34 3icl h GLY 104 CO 0.04 1.02 0.00 1.04 0.00 0.00 0.00 176.54 178.64 3icl n LEU 105 N -3.98 0.00 0.10 3.11 4.77 0.36 -2.88 117.00 118.48 3icl n LEU 105 Ca -0.05 0.45 0.13 0.00 -0.03 0.00 0.00 56.01 56.50 3icl n LEU 105 Cb 0.67 -0.45 0.37 0.00 -2.33 0.00 0.00 43.42 41.69 3icl n LEU 105 CO 0.51 -0.01 0.81 0.00 -1.33 0.00 0.00 177.39 177.37 3icl n ALA 106 N -1.45 2.38 -1.78 -1.18 0.00 -0.58 -4.55 120.51 113.36 3icl n ALA 106 Ca 0.09 -0.06 -0.37 0.00 0.00 0.00 0.00 53.44 53.10 3icl n ALA 106 Cb 0.31 -1.43 -0.04 0.00 0.00 0.00 0.00 19.45 18.29 3icl n ALA 106 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 3icl s GLN 107 N -3.11 4.19 0.74 0.00 -0.21 -1.14 -4.96 119.66 115.17 3icl s GLN 107 Ca 0.10 1.60 -0.14 0.00 0.02 0.00 0.00 55.36 56.94 3icl s GLN 107 Cb 0.13 -2.63 0.04 0.00 1.00 0.00 0.00 33.01 31.55 3icl s GLN 107 CO 0.61 -0.14 1.16 -2.14 -2.12 0.00 0.00 175.29 172.67 3icl s PRO 108 N -2.35 2.17 -0.32 2.91 0.02 -1.26 -4.84 135.00 131.32 3icl s PRO 108 Ca 0.56 1.59 -0.03 0.00 0.02 0.00 0.00 61.00 63.15 3icl s PRO 108 Cb -0.25 -1.85 0.05 0.00 0.02 0.00 0.00 34.50 32.47 3icl s PRO 108 CO 0.31 -1.78 0.03 -0.06 -0.33 0.00 0.00 177.00 175.18 3icl s PHE 109 N -2.24 3.29 -0.31 6.54 0.08 0.58 -4.94 117.98 120.98 3icl s PHE 109 Ca 0.70 -1.86 -0.15 0.00 0.12 0.00 0.00 56.93 55.75 3icl s PHE 109 Cb -0.25 -2.24 -0.02 0.00 -0.57 0.00 0.00 43.02 39.94 3icl s PHE 109 CO 0.47 -0.81 0.35 0.08 -0.10 0.00 0.00 175.22 175.21 3icl s VAL 110 N 1.26 5.18 -0.34 -0.44 1.01 -1.26 -0.97 120.40 124.84 3icl s VAL 110 Ca -0.03 0.23 -0.01 0.00 0.00 0.00 0.00 61.98 62.16 3icl s VAL 110 Cb -0.20 -3.76 0.08 0.00 0.00 0.00 0.00 36.38 32.50 3icl s VAL 110 CO -0.01 0.01 0.07 -0.36 0.00 0.00 0.00 175.10 174.82 3icl s PHE 111 N 2.02 3.46 0.00 5.22 0.08 -0.36 -4.97 117.98 123.43 3icl s PHE 111 Ca 0.12 -2.27 0.00 0.00 0.12 0.00 0.00 56.93 54.90 3icl s PHE 111 Cb -0.16 -2.62 0.00 0.00 -0.57 0.00 0.00 43.02 39.67 3icl s PHE 111 CO 0.11 -0.89 0.00 0.41 -0.10 0.00 0.00 175.22 174.75 3icl n GLY 112 N 4.54 2.80 1.32 4.36 0.00 -1.26 -0.72 105.19 116.24 3icl n GLY 112 Ca -0.07 -0.24 0.11 0.00 0.00 0.00 0.00 46.02 45.82 3icl n GLY 112 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3icl n ALA 113 N 11.49 2.53 -2.51 4.61 0.00 -1.26 -4.88 120.51 130.49 3icl n ALA 113 Ca 0.00 -1.26 -0.41 0.00 0.00 0.00 0.00 53.44 51.77 3icl n ALA 113 Cb 0.00 -0.96 -0.10 0.00 0.00 0.00 0.00 19.45 18.39 3icl n ALA 113 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 3icl s GLN 114 N -1.23 3.35 -0.02 0.00 2.00 0.11 -5.06 119.66 118.81 3icl s GLN 114 Ca 0.46 -0.72 -0.27 0.00 -2.00 0.00 0.00 55.36 52.84 3icl s GLN 114 Cb 0.25 -3.86 -0.04 0.00 0.80 0.00 0.00 33.01 30.17 3icl s GLN 114 CO 0.30 -0.55 0.85 -0.65 -0.50 0.00 0.00 175.29 174.73 3icl s GLN 115 N 1.77 4.51 -0.09 1.67 -1.52 -1.26 -1.22 119.66 123.51 3icl s GLN 115 Ca 0.07 1.17 0.03 0.00 -1.95 0.00 0.00 55.36 54.67 3icl s GLN 115 Cb -0.18 -3.44 0.01 0.00 -0.22 0.00 0.00 33.01 29.18 3icl s GLN 115 CO 0.11 0.04 -0.17 0.42 -0.25 0.00 0.00 175.29 175.44 3icl s ILE 116 N 0.77 1.53 -0.20 1.08 -1.09 -0.14 -4.97 121.20 118.19 3icl s ILE 116 Ca 0.45 -0.70 0.01 0.00 -2.23 0.00 0.00 60.65 58.18 3icl s ILE 116 Cb -0.20 -1.37 0.03 0.00 -1.58 0.00 0.00 42.46 39.34 3icl s ILE 116 CO 0.24 0.44 -0.17 0.54 -1.23 0.00 0.00 174.94 174.76 3icl s VAL 117 N 0.67 2.03 0.27 2.92 0.11 -1.26 -0.31 120.40 124.82 3icl s VAL 117 Ca -0.13 -1.09 -0.04 0.00 -2.93 0.00 0.00 61.98 57.79 3icl s VAL 117 Cb -0.16 -1.92 -0.05 0.00 -1.53 0.00 0.00 36.38 32.72 3icl s VAL 117 CO 0.04 0.38 0.51 0.27 -3.33 0.00 0.00 175.10 172.97 3icl s ILE 118 N 1.27 5.07 -0.11 7.04 -4.36 -1.26 -5.03 121.20 123.82 3icl s ILE 118 Ca 0.01 -0.06 -0.03 0.00 -0.26 0.00 0.00 60.65 60.32 3icl s ILE 118 Cb -0.15 -3.73 -0.03 0.00 1.25 0.00 0.00 42.46 39.80 3icl s ILE 118 CO -0.11 -0.28 0.01 -0.94 0.24 0.00 0.00 174.94 173.86 3icl s SER 119 N -3.16 5.26 0.02 4.36 1.04 -1.26 -4.86 113.70 115.10 3icl s SER 119 Ca 0.42 0.11 0.05 0.00 0.48 0.00 0.00 55.95 57.02 3icl s SER 119 Cb -0.11 -1.59 -0.02 0.00 0.10 0.00 0.00 66.02 64.41 3icl s SER 119 CO 0.30 0.33 -0.16 -0.69 0.98 0.00 0.00 173.24 174.00 3icl s VAL 120 N -0.59 1.25 -0.05 5.02 1.01 -1.26 -0.86 120.40 124.92 3icl s VAL 120 Ca 0.10 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.20 3icl s VAL 120 Cb -0.12 -1.09 0.01 0.00 0.00 0.00 0.00 36.38 35.19 3icl s VAL 120 CO 0.02 0.18 -0.09 -0.44 0.00 0.00 0.00 175.10 174.77 3icl s SER 121 N -0.83 1.37 -0.07 3.32 0.01 -0.83 0.10 113.70 116.76 3icl s SER 121 Ca 0.04 -0.22 0.04 0.00 1.31 0.00 0.00 55.95 57.12 3icl s SER 121 Cb -0.07 -0.56 0.00 0.00 0.21 0.00 0.00 66.02 65.60 3icl s SER 121 CO 0.01 0.02 -0.19 -0.63 0.41 0.00 0.00 173.24 172.86 3icl s ILE 122 N 0.58 1.62 -0.02 1.44 1.01 0.21 -1.03 121.20 125.02 3icl s ILE 122 Ca -0.10 -0.78 0.01 0.00 0.00 0.00 0.00 60.65 59.77 3icl s ILE 122 Cb -0.13 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.88 3icl s ILE 122 CO 0.02 0.46 0.00 -0.83 0.00 0.00 0.00 174.94 174.59 3icl s GLY 123 N 0.35 1.87 -0.02 6.18 0.00 -0.58 -1.18 107.32 113.93 3icl s GLY 123 Ca -0.13 -0.92 0.05 0.00 0.00 0.00 0.00 44.72 43.71 3icl s GLY 123 CO 0.05 -0.77 -0.17 -0.42 0.00 0.00 0.00 173.10 171.80 3icl s ILE 124 N -1.04 1.35 -0.06 0.90 1.01 -0.06 -1.22 121.20 122.07 3icl s ILE 124 Ca 0.18 -0.71 0.01 0.00 0.00 0.00 0.00 60.65 60.13 3icl s ILE 124 Cb -0.11 -1.14 0.02 0.00 0.01 0.00 0.00 42.46 41.23 3icl s ILE 124 CO 0.09 0.39 -0.06 0.00 0.00 0.00 0.00 174.94 175.35 3icl s ALA 125 N -0.22 0.93 -0.16 9.38 0.00 -0.39 -1.07 121.76 130.23 3icl s ALA 125 Ca 0.02 -0.23 -0.05 0.00 0.00 0.00 0.00 51.96 51.70 3icl s ALA 125 Cb -0.08 -0.59 -0.03 0.00 0.00 0.00 0.00 23.12 22.42 3icl s ALA 125 CO 0.00 -0.12 -0.01 0.08 0.00 0.00 0.00 175.76 175.72 3icl s VAL 126 N 1.14 4.18 0.15 0.00 1.01 -1.26 -1.26 120.40 124.36 3icl s VAL 126 Ca -0.07 -0.26 -0.24 0.00 0.00 0.00 0.00 61.98 61.41 3icl s VAL 126 Cb -0.14 -2.85 -0.08 0.00 0.00 0.00 0.00 36.38 33.32 3icl s VAL 126 CO -0.01 0.49 0.74 -0.55 0.00 0.00 0.00 175.10 175.76 3icl s SER 127 N 0.33 7.32 0.05 3.32 0.15 -0.70 -0.07 113.70 124.10 3icl s SER 127 Ca -0.02 1.57 0.23 0.00 0.70 0.00 0.00 55.95 58.43 3icl s SER 127 Cb -0.14 -2.47 -0.04 0.00 -1.71 0.00 0.00 66.02 61.67 3icl s SER 127 CO 0.02 0.22 0.93 -0.81 1.20 0.00 0.00 173.24 174.80 3icl n PRO 128 N 1.58 0.38 -0.33 5.44 -0.04 -1.26 -4.42 135.00 136.34 3icl n PRO 128 Ca -0.06 -0.02 0.23 0.00 -0.04 0.00 0.00 63.50 63.60 3icl n PRO 128 Cb 0.49 -1.61 0.45 0.00 -0.04 0.00 0.00 33.50 32.80 3icl n PRO 128 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3icl h ALA 129 N 2.40 1.86 -0.54 0.55 0.00 -1.97 0.22 119.26 121.78 3icl h ALA 129 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3icl h ALA 129 Cb 0.80 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3icl h ALA 129 CO 0.00 -0.57 0.00 -0.25 0.00 0.00 0.00 179.25 178.43 3icl n ASP 130 N -5.09 5.26 0.00 0.00 10.43 0.90 -4.95 116.55 123.11 3icl n ASP 130 Ca 0.30 -2.80 0.00 0.00 2.57 0.00 0.00 54.79 54.86 3icl n ASP 130 Cb 0.95 -0.66 0.00 0.00 1.84 0.00 0.00 41.12 43.25 3icl n ASP 130 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3icl n GLY 131 N 0.64 4.50 0.12 0.44 0.00 0.77 -4.18 105.19 107.47 3icl n GLY 131 Ca 0.25 -1.18 -0.24 0.00 0.00 0.00 0.00 46.02 44.85 3icl n GLY 131 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3icl n GLU 132 N -1.45 0.57 0.00 1.61 -0.58 -1.26 -4.36 120.64 115.17 3icl n GLU 132 Ca 0.00 0.40 0.00 0.00 -0.42 0.00 0.00 57.16 57.14 3icl n GLU 132 Cb 0.00 -1.60 0.00 0.00 -0.57 0.00 0.00 31.44 29.27 3icl n GLU 132 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 3icl n THR 133 N -4.36 0.00 0.00 2.62 -2.24 -1.26 -4.91 114.28 104.14 3icl n THR 133 Ca -0.41 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.37 3icl n THR 133 Cb 0.75 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 3icl n THR 133 CO 0.00 0.00 0.00 1.21 -0.57 0.00 0.00 175.07 175.71 3icl n GLU 135 N 0.00 0.00 -0.15 -0.78 2.13 -1.26 -1.56 120.64 119.03 3icl n GLU 135 Ca 0.00 0.00 -0.11 0.00 0.66 0.00 0.00 57.16 57.71 3icl n GLU 135 Cb 0.00 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.70 3icl n GLU 135 CO 0.00 0.00 0.00 1.96 -0.41 0.00 0.00 177.13 178.68 3icl h GLN 136 N 0.00 0.87 -0.12 5.31 4.20 -1.94 -1.55 115.11 121.89 3icl h GLN 136 Ca 0.00 -0.36 -0.00 0.00 0.06 0.00 0.00 58.65 58.35 3icl h GLN 136 Cb 0.00 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 27.74 3icl h GLN 136 CO 0.00 1.01 0.06 1.25 -0.67 0.00 0.00 178.83 180.48 3icl h LEU 137 N 0.70 0.15 -0.11 1.46 5.85 -1.45 -0.28 115.31 121.64 3icl h LEU 137 Ca 0.10 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.73 3icl h LEU 137 Cb 0.72 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.70 3icl h LEU 137 CO 0.05 0.20 0.06 -0.07 -0.34 0.00 0.00 178.44 178.34 3icl h LEU 138 N 0.09 0.14 -1.21 2.25 3.38 -1.81 0.16 115.31 118.30 3icl h LEU 138 Ca 0.04 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 3icl h LEU 138 Cb 0.09 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 3icl h LEU 138 CO -0.01 0.19 0.45 0.03 0.09 0.00 0.00 178.44 179.19 3icl h ARG 139 N 0.07 0.98 -0.16 1.13 3.08 -1.21 0.18 114.38 118.45 3icl h ARG 139 Ca 0.04 -0.08 -0.21 0.00 0.07 0.00 0.00 59.98 59.80 3icl h ARG 139 Cb 0.09 -0.21 0.00 0.00 0.08 0.00 0.00 29.97 29.93 3icl h ARG 139 CO -0.01 0.68 -0.72 -0.91 -1.07 0.00 0.00 179.97 177.94 3icl h ASN 140 N 1.00 0.83 -0.12 7.04 -0.26 -0.78 -0.47 115.58 122.83 3icl h ASN 140 Ca 0.26 -0.53 -0.10 0.00 -0.56 0.00 0.00 56.30 55.38 3icl h ASN 140 Cb -0.05 -0.24 -0.01 0.00 -1.06 0.00 0.00 38.32 36.95 3icl h ASN 140 CO -0.05 1.31 -0.23 0.00 -1.06 0.00 0.00 177.43 177.40 3icl h ALA 141 N 0.68 1.07 -0.42 -0.83 0.00 -0.55 -1.29 119.26 117.93 3icl h ALA 141 Ca -0.04 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.49 3icl h ALA 141 Cb 1.33 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 3icl h ALA 141 CO 0.14 0.57 0.10 0.22 0.00 0.00 0.00 179.25 180.29 3icl h ASP 142 N 0.49 0.63 -0.55 0.00 3.58 -0.46 -2.89 116.42 117.22 3icl h ASP 142 Ca 0.07 -0.23 -0.03 0.00 0.42 0.00 0.00 57.03 57.26 3icl h ASP 142 Cb 0.66 -0.17 -0.02 0.00 1.72 0.00 0.00 39.33 41.52 3icl h ASP 142 CO 0.05 0.70 0.21 0.74 -2.88 0.00 0.00 179.24 178.06 3icl h THR 143 N 0.54 1.22 0.00 2.25 2.02 -0.81 -1.86 112.91 116.28 3icl h THR 143 Ca 0.13 -0.71 0.00 0.00 0.77 0.00 0.00 66.41 66.60 3icl h THR 143 Cb 0.31 0.66 0.00 0.00 -1.74 0.00 0.00 68.15 67.38 3icl h THR 143 CO 0.00 0.27 0.00 0.00 0.37 0.00 0.00 175.52 176.16 3icl n ALA 144 N -2.36 1.54 0.00 6.16 0.00 -0.51 -1.63 120.51 123.71 3icl n ALA 144 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3icl n ALA 144 Cb 0.17 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.62 3icl n ALA 144 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3icl n TYR 146 N 0.85 0.00 -0.09 0.00 4.01 -0.70 -1.18 117.16 120.05 3icl n TYR 146 Ca 0.00 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.64 3icl n TYR 146 Cb 0.06 0.00 -0.03 0.00 -0.31 0.00 0.00 39.34 39.05 3icl n TYR 146 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3icl h HIS 147 N 0.00 0.47 0.11 -0.72 3.86 -1.57 -1.49 115.15 115.81 3icl h HIS 147 Ca 0.00 -0.06 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 3icl h HIS 147 Cb 0.00 -0.13 -0.01 0.00 1.06 0.00 0.00 27.41 28.33 3icl h HIS 147 CO 0.00 0.53 -0.10 0.00 0.86 0.00 0.00 177.93 179.22 3icl h ALA 148 N 0.89 -0.20 -0.68 2.45 0.00 -1.42 -2.29 119.26 118.02 3icl h ALA 148 Ca 0.09 -0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.12 3icl h ALA 148 Cb 0.29 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 18.18 3icl h ALA 148 CO 0.00 -0.63 0.46 -0.22 0.00 0.00 0.00 179.25 178.87 3icl h LYS 149 N -0.23 0.28 0.00 0.00 3.64 -1.70 -0.62 116.57 117.94 3icl h LYS 149 Ca 0.00 -0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3icl h LYS 149 Cb 0.21 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3icl h LYS 149 CO -0.02 0.19 -0.18 0.66 -2.27 0.00 0.00 179.45 177.83 3icl h SER 150 N 0.29 0.00 -0.02 4.20 4.64 -0.69 -3.23 113.55 118.74 3icl h SER 150 Ca 0.33 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.65 3icl h SER 150 Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 3icl h SER 150 CO -0.08 0.18 -0.27 -2.11 -0.87 0.00 0.00 176.83 173.68 3icl n ARG 151 N -3.24 1.59 -3.56 4.77 1.85 -0.28 -5.07 116.66 112.72 3icl n ARG 151 Ca 0.01 -1.20 0.00 0.00 -1.00 0.00 0.00 57.85 55.67 3icl n ARG 151 Cb 0.47 -1.39 0.00 0.00 -1.05 0.00 0.00 32.46 30.49 3icl n ARG 151 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3icl n GLY 152 N 1.25 -0.92 3.28 2.89 0.00 -0.97 -5.10 105.19 105.62 3icl n GLY 152 Ca 0.09 -1.28 -0.15 0.00 0.00 0.00 0.00 46.02 44.68 3icl n GLY 152 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3icl s LYS 153 N -2.00 1.21 -1.38 1.61 -2.85 -1.26 -4.23 119.74 110.84 3icl s LYS 153 Ca 0.00 -1.59 -0.04 0.00 -1.00 0.00 0.00 55.97 53.34 3icl s LYS 153 Cb 0.00 -0.45 0.02 0.00 -2.06 0.00 0.00 37.83 35.35 3icl s LYS 153 CO 0.00 -0.10 0.77 0.09 0.10 0.00 0.00 175.35 176.21 3icl n ASN 154 N -0.32 -2.22 -3.97 0.03 3.02 0.28 -4.91 115.26 107.18 3icl n ASN 154 Ca -0.06 -0.81 -0.17 0.00 -0.03 0.00 0.00 54.58 53.51 3icl n ASN 154 Cb 0.63 -3.98 -0.09 0.00 -0.61 0.00 0.00 39.78 35.73 3icl n ASN 154 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3icl s ASN 155 N -4.05 1.15 0.08 6.41 4.22 -0.86 -4.97 114.94 116.92 3icl s ASN 155 Ca 0.20 -1.53 -0.09 0.00 -2.14 0.00 0.00 52.86 49.29 3icl s ASN 155 Cb -0.10 0.39 0.00 0.00 1.28 0.00 0.00 41.25 42.83 3icl s ASN 155 CO 0.82 -0.89 0.20 -0.72 -2.04 0.00 0.00 177.10 174.47 3icl s TYR 156 N -3.74 0.11 -0.11 1.54 -0.85 -1.26 -0.62 117.35 112.42 3icl s TYR 156 Ca 0.38 -0.48 -0.30 0.00 -0.52 0.00 0.00 57.07 56.15 3icl s TYR 156 Cb 0.05 -0.03 0.07 0.00 0.38 0.00 0.00 41.96 42.43 3icl s TYR 156 CO 0.17 -0.53 0.71 1.14 -1.52 0.00 0.00 175.55 175.53 3icl s GLN 157 N -3.56 0.98 0.38 -3.49 -2.07 -0.33 -4.95 119.66 106.63 3icl s GLN 157 Ca 0.03 0.43 -0.15 0.00 -1.82 0.00 0.00 55.36 53.84 3icl s GLN 157 Cb 0.03 0.47 -0.08 0.00 -1.09 0.00 0.00 33.01 32.34 3icl s GLN 157 CO -0.09 -0.27 0.80 -0.06 -1.32 0.00 0.00 175.29 174.35 3icl s PHE 158 N -0.81 3.40 0.37 9.60 0.40 -1.26 -0.88 117.98 128.80 3icl s PHE 158 Ca -0.08 1.25 -0.27 0.00 -0.60 0.00 0.00 56.93 57.23 3icl s PHE 158 Cb -0.01 -2.58 -0.10 0.00 0.51 0.00 0.00 43.02 40.84 3icl s PHE 158 CO 0.07 -0.04 1.33 0.12 0.70 0.00 0.00 175.22 177.40 3icl s PHE 159 N -2.19 2.88 -0.28 0.36 2.19 -0.23 -4.84 117.98 115.88 3icl s PHE 159 Ca 0.55 1.38 0.01 0.00 0.33 0.00 0.00 56.93 59.20 3icl s PHE 159 Cb -0.10 -3.72 0.05 0.00 -1.31 0.00 0.00 43.02 37.94 3icl s PHE 159 CO 0.22 -2.11 -0.06 -1.12 1.83 0.00 0.00 175.22 173.98 3icl s SER 160 N -0.57 4.62 0.00 6.13 0.01 -1.26 -5.00 113.70 117.63 3icl s SER 160 Ca 0.53 -1.30 0.00 0.00 1.31 0.00 0.00 55.95 56.49 3icl s SER 160 Cb -0.40 -1.63 0.00 0.00 0.21 0.00 0.00 66.02 64.21 3icl s SER 160 CO 0.52 -0.21 0.22 -2.65 0.41 0.00 0.00 173.24 171.53