#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ic0 s ASN 3 N 0.00 -0.11 0.39 0.26 2.47 -1.26 -4.84 114.94 111.85 1ic0 s ASN 3 Ca 0.00 0.12 -0.25 0.00 0.42 0.00 0.00 52.86 53.15 1ic0 s ASN 3 Cb 0.00 1.11 -0.09 0.00 -1.45 0.00 0.00 41.25 40.82 1ic0 s ASN 3 CO 0.00 -0.02 1.06 -0.36 -3.72 0.00 0.00 177.10 174.06 1ic0 s PHE 4 N 2.42 3.29 -0.19 0.43 0.08 -0.03 -4.93 117.98 119.06 1ic0 s PHE 4 Ca -0.03 1.65 0.01 0.00 0.12 0.00 0.00 56.93 58.68 1ic0 s PHE 4 Cb -0.04 -3.16 0.03 0.00 -0.57 0.00 0.00 43.02 39.28 1ic0 s PHE 4 CO -0.13 -0.65 -0.18 -0.80 -0.10 0.00 0.00 175.22 173.36 1ic0 s ASN 5 N -1.47 3.25 -0.06 1.36 0.01 -1.26 -0.72 114.94 116.05 1ic0 s ASN 5 Ca 0.56 -0.73 0.03 0.00 -0.71 0.00 0.00 52.86 52.02 1ic0 s ASN 5 Cb -0.24 -1.45 0.00 0.00 0.41 0.00 0.00 41.25 39.97 1ic0 s ASN 5 CO 0.30 -0.03 -0.16 -0.69 -1.51 0.00 0.00 177.10 175.01 1ic0 s VAL 6 N 1.29 1.36 -0.09 1.60 1.01 -0.48 -4.36 120.40 120.72 1ic0 s VAL 6 Ca 0.03 -0.64 0.02 0.00 0.00 0.00 0.00 61.98 61.39 1ic0 s VAL 6 Cb -0.14 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.03 1ic0 s VAL 6 CO -0.12 0.40 -0.14 -0.69 0.00 0.00 0.00 175.10 174.55 1ic0 s VAL 7 N 0.33 3.02 -0.24 2.92 1.01 -0.23 -0.48 120.40 126.73 1ic0 s VAL 7 Ca -0.10 -0.71 -0.08 0.00 0.00 0.00 0.00 61.98 61.10 1ic0 s VAL 7 Cb -0.14 -2.22 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 1ic0 s VAL 7 CO 0.04 0.56 0.08 -0.63 0.00 0.00 0.00 175.10 175.14 1ic0 s ILE 8 N -0.23 4.47 0.04 2.22 1.01 -0.22 0.30 121.20 128.78 1ic0 s ILE 8 Ca 0.01 -0.12 0.07 0.00 0.00 0.00 0.00 60.65 60.61 1ic0 s ILE 8 Cb -0.13 -3.08 -0.02 0.00 0.01 0.00 0.00 42.46 39.24 1ic0 s ILE 8 CO 0.03 0.36 -0.20 0.20 0.00 0.00 0.00 174.94 175.32 1ic0 s ASN 9 N 1.37 2.44 -0.07 3.58 0.01 0.08 -1.12 114.94 121.23 1ic0 s ASN 9 Ca 0.05 -0.50 -0.01 0.00 -0.71 0.00 0.00 52.86 51.69 1ic0 s ASN 9 Cb -0.15 -0.21 -0.03 0.00 0.41 0.00 0.00 41.25 41.27 1ic0 s ASN 9 CO 0.04 0.17 -0.01 0.00 -1.51 0.00 0.00 177.10 175.79 1ic0 s ALA 10 N -0.76 3.25 -0.10 0.60 0.00 -1.26 0.50 121.76 123.99 1ic0 s ALA 10 Ca 0.07 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.20 1ic0 s ALA 10 Cb -0.09 -1.42 0.02 0.00 0.00 0.00 0.00 23.12 21.63 1ic0 s ALA 10 CO 0.01 0.60 -0.09 0.71 0.00 0.00 0.00 175.76 176.99 1ic0 s TYR 11 N -0.91 1.48 -0.58 0.00 1.51 0.87 -4.99 117.35 114.72 1ic0 s TYR 11 Ca 0.14 -0.67 -0.02 0.00 -1.01 0.00 0.00 57.07 55.51 1ic0 s TYR 11 Cb -0.11 -1.17 0.15 0.00 -0.11 0.00 0.00 41.96 40.71 1ic0 s TYR 11 CO 0.04 -0.43 0.38 0.34 -1.11 0.00 0.00 175.55 174.77 1ic0 s ASP 12 N 1.30 5.11 -0.23 2.29 -1.08 -1.26 -1.82 116.67 120.97 1ic0 s ASP 12 Ca -0.03 -2.78 -0.06 0.00 -0.52 0.00 0.00 52.55 49.17 1ic0 s ASP 12 Cb -0.14 -1.82 -0.02 0.00 -1.46 0.00 0.00 42.92 39.48 1ic0 s ASP 12 CO -0.04 -0.37 0.03 -0.89 0.52 0.00 0.00 175.17 174.42 1ic0 s THR 13 N 0.05 3.98 -0.09 1.71 2.01 -0.24 -5.03 115.64 118.03 1ic0 s THR 13 Ca 0.16 -0.29 -0.00 0.00 0.31 0.00 0.00 61.69 61.87 1ic0 s THR 13 Cb -0.21 -2.84 0.03 0.00 0.01 0.00 0.00 72.50 69.48 1ic0 s THR 13 CO -0.03 0.38 -0.05 -0.89 -0.69 0.00 0.00 174.62 173.34 1ic0 s THR 14 N 1.50 0.75 -0.32 -0.82 2.01 -1.26 -0.59 115.64 116.91 1ic0 s THR 14 Ca 0.06 -0.13 -0.01 0.00 0.31 0.00 0.00 61.69 61.92 1ic0 s THR 14 Cb -0.15 -0.81 0.10 0.00 0.01 0.00 0.00 72.50 71.65 1ic0 s THR 14 CO 0.01 0.32 0.11 -0.63 -0.69 0.00 0.00 174.62 173.73 1ic0 s ILE 15 N 1.68 0.87 0.11 1.82 -1.09 0.39 -5.00 121.20 119.98 1ic0 s ILE 15 Ca 0.03 -1.44 -0.25 0.00 -2.23 0.00 0.00 60.65 56.76 1ic0 s ILE 15 Cb -0.13 -1.66 -0.08 0.00 -1.58 0.00 0.00 42.46 39.01 1ic0 s ILE 15 CO -0.06 -0.69 1.67 -0.65 -1.23 0.00 0.00 174.94 173.98 1ic0 h PRO 16 N 8.03 -0.30 -1.02 2.79 0.11 -1.89 0.30 132.00 140.01 1ic0 h PRO 16 Ca -0.13 0.02 0.17 0.00 0.11 0.00 0.00 66.00 66.17 1ic0 h PRO 16 Cb 1.01 0.07 -0.24 0.00 0.11 0.00 0.00 31.00 31.95 1ic0 h PRO 16 CO 0.47 -0.20 0.23 -2.00 -0.21 0.00 0.00 178.00 176.29 1ic0 s GLU 17 N -6.12 0.29 -0.04 1.05 2.12 -1.26 0.26 118.70 115.00 1ic0 s GLU 17 Ca -0.15 0.73 -0.01 0.00 0.36 0.00 0.00 54.97 55.90 1ic0 s GLU 17 Cb 0.08 0.43 0.03 0.00 0.26 0.00 0.00 34.13 34.93 1ic0 s GLU 17 CO 0.66 -0.10 0.03 -1.17 -0.54 0.00 0.00 175.26 174.14 1ic0 s LEU 18 N 2.42 0.59 -0.44 2.70 2.96 0.44 -4.99 118.68 122.36 1ic0 s LEU 18 Ca -0.03 0.01 -0.21 0.00 -0.22 0.00 0.00 54.13 53.69 1ic0 s LEU 18 Cb -0.06 -0.22 0.03 0.00 0.50 0.00 0.00 46.19 46.44 1ic0 s LEU 18 CO -0.17 -0.19 0.67 0.21 -1.32 0.00 0.00 176.35 175.55 1ic0 s ASN 19 N 1.73 6.33 -0.33 3.68 3.84 -1.26 -0.70 114.94 128.23 1ic0 s ASN 19 Ca -0.00 -0.32 -0.08 0.00 0.21 0.00 0.00 52.86 52.66 1ic0 s ASN 19 Cb -0.13 -2.33 0.02 0.00 -0.55 0.00 0.00 41.25 38.26 1ic0 s ASN 19 CO -0.03 -0.81 0.13 -0.69 -2.79 0.00 0.00 177.10 172.91 1ic0 s VAL 20 N 2.91 4.22 -1.47 -5.21 1.01 0.77 -4.58 120.40 118.05 1ic0 s VAL 20 Ca 0.24 -0.75 -0.08 0.00 0.00 0.00 0.00 61.98 61.39 1ic0 s VAL 20 Cb -0.14 -3.25 0.06 0.00 0.00 0.00 0.00 36.38 33.04 1ic0 s VAL 20 CO 0.19 -0.04 0.80 -0.62 0.00 0.00 0.00 175.10 175.43 1ic0 n GLU 21 N 4.91 -4.77 0.00 2.72 1.02 -1.26 -0.92 120.64 122.35 1ic0 n GLU 21 Ca -0.13 0.55 0.00 0.00 -0.02 0.00 0.00 57.16 57.56 1ic0 n GLU 21 Cb 0.47 -5.22 0.00 0.00 -0.02 0.00 0.00 31.44 26.68 1ic0 n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ic0 n GLY 22 N -1.67 2.69 3.69 0.62 0.00 -1.26 -5.01 105.19 104.25 1ic0 n GLY 22 Ca -0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.54 1ic0 n GLY 22 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ic0 s VAL 23 N -2.23 5.27 -0.08 1.61 1.01 -0.09 -5.06 120.40 120.82 1ic0 s VAL 23 Ca 0.00 0.57 -0.26 0.00 0.00 0.00 0.00 61.98 62.29 1ic0 s VAL 23 Cb 0.00 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 1ic0 s VAL 23 CO 0.00 0.32 0.85 0.28 0.00 0.00 0.00 175.10 176.55 1ic0 s THR 24 N 0.93 4.93 -0.38 3.92 -1.32 -1.26 -0.16 115.64 122.29 1ic0 s THR 24 Ca 0.16 1.73 0.01 0.00 -1.21 0.00 0.00 61.69 62.39 1ic0 s THR 24 Cb -0.14 -4.17 0.11 0.00 -1.51 0.00 0.00 72.50 66.78 1ic0 s THR 24 CO 0.06 0.14 0.13 -0.69 -2.21 0.00 0.00 174.62 172.05 1ic0 s VAL 25 N 1.34 2.75 0.11 5.08 1.01 0.12 -4.97 120.40 125.84 1ic0 s VAL 25 Ca 0.43 -2.25 0.11 0.00 0.00 0.00 0.00 61.98 60.26 1ic0 s VAL 25 Cb -0.18 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.20 1ic0 s VAL 25 CO 0.19 -0.65 -0.27 -0.75 0.00 0.00 0.00 175.10 173.63 1ic0 s LYS 26 N 0.96 1.46 -1.36 2.72 2.20 -1.26 -0.42 119.74 124.04 1ic0 s LYS 26 Ca 0.10 -1.30 -0.03 0.00 -0.36 0.00 0.00 55.97 54.38 1ic0 s LYS 26 Cb -0.21 -1.89 0.02 0.00 -1.51 0.00 0.00 37.83 34.23 1ic0 s LYS 26 CO -0.06 0.46 0.72 0.09 -0.36 0.00 0.00 175.35 176.19 1ic0 n ASN 27 N 1.06 -1.71 -4.74 1.43 4.13 0.14 -4.95 115.26 110.62 1ic0 n ASN 27 Ca -0.18 -0.84 -0.38 0.00 1.68 0.00 0.00 54.58 54.87 1ic0 n ASN 27 Cb 0.53 -3.90 -0.06 0.00 -1.54 0.00 0.00 39.78 34.80 1ic0 n ASN 27 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1ic0 s ILE 28 N -3.64 5.19 -0.30 2.41 1.09 0.07 -4.96 121.20 121.06 1ic0 s ILE 28 Ca 0.12 0.84 0.01 0.00 -1.10 0.00 0.00 60.65 60.52 1ic0 s ILE 28 Cb -0.06 -3.75 0.15 0.00 -1.06 0.00 0.00 42.46 37.73 1ic0 s ILE 28 CO 0.82 0.39 0.35 -0.60 -0.10 0.00 0.00 174.94 175.80 1ic0 s ARG 29 N 0.28 0.40 -0.05 2.79 3.00 -1.26 -0.46 118.95 123.66 1ic0 s ARG 29 Ca 0.23 -0.14 0.02 0.00 -1.00 0.00 0.00 55.73 54.84 1ic0 s ARG 29 Cb -0.15 -0.53 0.02 0.00 0.00 0.00 0.00 34.95 34.28 1ic0 s ARG 29 CO 0.09 -1.05 -0.09 0.00 0.00 0.00 0.00 175.30 174.25 1ic0 s ALA 30 N 2.31 0.95 -0.12 6.12 0.00 0.24 -5.02 121.76 126.24 1ic0 s ALA 30 Ca 0.10 -0.24 0.02 0.00 0.00 0.00 0.00 51.96 51.84 1ic0 s ALA 30 Cb -0.13 -0.47 0.02 0.00 0.00 0.00 0.00 23.12 22.53 1ic0 s ALA 30 CO -0.28 0.07 -0.16 0.12 0.00 0.00 0.00 175.76 175.50 1ic0 s PHE 31 N 0.70 2.16 0.10 0.00 5.36 -1.26 -1.08 117.98 123.96 1ic0 s PHE 31 Ca -0.12 -1.08 -0.12 0.00 -0.96 0.00 0.00 56.93 54.65 1ic0 s PHE 31 Cb -0.14 -1.54 0.01 0.00 -0.34 0.00 0.00 43.02 41.01 1ic0 s PHE 31 CO 0.02 -0.55 0.27 -0.80 -1.46 0.00 0.00 175.22 172.70 1ic0 s ASN 32 N 1.08 -0.02 -0.06 6.13 0.01 -0.76 -4.78 114.94 116.54 1ic0 s ASN 32 Ca -0.04 -0.51 0.05 0.00 -0.71 0.00 0.00 52.86 51.66 1ic0 s ASN 32 Cb -0.14 0.39 -0.01 0.00 0.41 0.00 0.00 41.25 41.90 1ic0 s ASN 32 CO -0.04 -0.76 -0.22 -0.69 -1.51 0.00 0.00 177.10 173.87 1ic0 s VAL 33 N -3.76 1.86 0.02 1.60 1.01 -0.27 -0.09 120.40 120.78 1ic0 s VAL 33 Ca 0.04 -0.95 0.05 0.00 0.00 0.00 0.00 61.98 61.11 1ic0 s VAL 33 Cb 0.03 -1.59 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 1ic0 s VAL 33 CO -0.11 0.52 -0.14 -0.76 0.00 0.00 0.00 175.10 174.61 1ic0 s LEU 34 N 0.00 2.11 -0.17 3.92 1.43 0.18 -2.62 118.68 123.53 1ic0 s LEU 34 Ca -0.07 -0.37 -0.17 0.00 -1.03 0.00 0.00 54.13 52.50 1ic0 s LEU 34 Cb -0.14 -0.64 -0.04 0.00 0.03 0.00 0.00 46.19 45.40 1ic0 s LEU 34 CO 0.04 0.09 0.45 0.20 0.23 0.00 0.00 176.35 177.36 1ic0 s ASN 35 N -0.79 6.55 -0.28 2.29 -0.87 -1.26 -0.74 114.94 119.83 1ic0 s ASN 35 Ca 0.03 0.65 0.03 0.00 -1.57 0.00 0.00 52.86 52.00 1ic0 s ASN 35 Cb -0.07 -2.26 0.07 0.00 -0.02 0.00 0.00 41.25 38.97 1ic0 s ASN 35 CO 0.01 -0.07 -0.04 -1.61 -2.57 0.00 0.00 177.10 172.81 1ic0 s GLU 36 N 1.15 1.85 0.69 -0.60 2.02 0.15 -2.85 118.70 121.11 1ic0 s GLU 36 Ca 0.22 -1.45 -0.09 0.00 0.02 0.00 0.00 54.97 53.67 1ic0 s GLU 36 Cb -0.15 -2.91 0.03 0.00 0.10 0.00 0.00 34.13 31.21 1ic0 s GLU 36 CO 0.09 -0.71 1.04 -1.25 0.02 0.00 0.00 175.26 174.46 1ic0 s PRO 37 N 1.10 2.60 -0.02 0.39 0.04 -1.26 -1.07 135.00 136.78 1ic0 s PRO 37 Ca -0.02 0.14 0.10 0.00 0.04 0.00 0.00 61.00 61.27 1ic0 s PRO 37 Cb -0.19 -2.10 -0.23 0.00 0.04 0.00 0.00 34.50 32.01 1ic0 s PRO 37 CO -0.07 -1.08 0.76 0.93 0.04 0.00 0.00 177.00 177.58 1ic0 h GLU 38 N -0.59 0.02 -5.46 4.56 5.08 -1.92 -3.47 114.58 112.80 1ic0 h GLU 38 Ca -0.45 -0.04 -0.64 0.00 -1.00 0.00 0.00 59.36 57.23 1ic0 h GLU 38 Cb 1.28 0.01 -0.20 0.00 0.50 0.00 0.00 28.75 30.34 1ic0 h GLU 38 CO 0.63 0.63 -0.66 0.99 -1.00 0.00 0.00 179.01 179.60 1ic0 s THR 39 N -2.62 4.00 -0.12 1.13 2.01 -1.26 -1.81 115.64 116.98 1ic0 s THR 39 Ca -0.05 -0.33 0.02 0.00 0.31 0.00 0.00 61.69 61.64 1ic0 s THR 39 Cb 0.08 -2.74 0.01 0.00 0.01 0.00 0.00 72.50 69.87 1ic0 s THR 39 CO 0.82 0.52 -0.17 -0.76 -0.69 0.00 0.00 174.62 174.34 1ic0 s LEU 40 N 0.09 1.83 -0.24 4.42 1.43 -0.72 -4.99 118.68 120.50 1ic0 s LEU 40 Ca 0.00 -0.48 -0.00 0.00 -1.03 0.00 0.00 54.13 52.62 1ic0 s LEU 40 Cb -0.13 -1.19 0.03 0.00 0.03 0.00 0.00 46.19 44.93 1ic0 s LEU 40 CO 0.02 0.04 -0.09 -0.69 0.23 0.00 0.00 176.35 175.86 1ic0 s VAL 41 N 0.93 2.62 0.49 -1.59 1.01 -1.26 -0.85 120.40 121.74 1ic0 s VAL 41 Ca -0.07 -1.14 0.02 0.00 0.00 0.00 0.00 61.98 60.79 1ic0 s VAL 41 Cb -0.15 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.87 1ic0 s VAL 41 CO -0.01 0.20 0.02 0.68 0.00 0.00 0.00 175.10 175.99 1ic0 s VAL 42 N 1.27 1.12 -0.01 2.92 -7.23 0.01 -4.98 120.40 113.50 1ic0 s VAL 42 Ca -0.01 -2.00 0.04 0.00 -1.81 0.00 0.00 61.98 58.20 1ic0 s VAL 42 Cb -0.17 -2.23 -0.03 0.00 0.56 0.00 0.00 36.38 34.51 1ic0 s VAL 42 CO -0.06 0.00 -0.10 -0.54 -0.31 0.00 0.00 175.10 174.09 1ic0 s LYS 43 N -3.84 2.48 0.09 4.82 1.02 -1.26 -1.02 119.74 122.03 1ic0 s LYS 43 Ca 0.10 -0.75 -0.36 0.00 0.02 0.00 0.00 55.97 54.98 1ic0 s LYS 43 Cb 0.02 -2.44 -0.17 0.00 -0.52 0.00 0.00 37.83 34.73 1ic0 s LYS 43 CO 0.06 0.60 1.26 1.17 -0.92 0.00 0.00 175.35 177.52 1ic0 n LYS 44 N 1.74 1.00 0.00 1.68 4.81 0.27 -2.67 118.16 124.99 1ic0 n LYS 44 Ca -0.16 0.36 0.00 0.00 -0.87 0.00 0.00 58.31 57.64 1ic0 n LYS 44 Cb 0.52 -1.95 0.00 0.00 0.02 0.00 0.00 35.03 33.63 1ic0 n LYS 44 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1ic0 n GLY 45 N 2.29 3.05 3.70 3.14 0.00 0.18 -4.99 105.19 112.56 1ic0 n GLY 45 Ca 0.18 -0.86 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 1ic0 n GLY 45 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ic0 n ASP 46 N 1.26 1.46 -4.62 1.61 5.68 -1.09 -4.46 116.55 116.39 1ic0 n ASP 46 Ca 0.00 0.72 -0.43 0.00 -0.50 0.00 0.00 54.79 54.59 1ic0 n ASP 46 Cb 0.00 -1.52 -0.03 0.00 -1.14 0.00 0.00 41.12 38.43 1ic0 n ASP 46 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1ic0 s ALA 47 N -1.71 3.47 0.06 2.12 0.00 -1.26 -2.48 121.76 121.95 1ic0 s ALA 47 Ca 0.78 -0.32 -0.21 0.00 0.00 0.00 0.00 51.96 52.21 1ic0 s ALA 47 Cb -0.34 -3.52 -0.06 0.00 0.00 0.00 0.00 23.12 19.19 1ic0 s ALA 47 CO 0.45 -1.46 0.62 0.08 0.00 0.00 0.00 175.76 175.46 1ic0 s VAL 48 N 3.39 4.74 -0.14 0.00 1.01 0.15 -4.94 120.40 124.62 1ic0 s VAL 48 Ca 0.39 1.33 0.00 0.00 0.00 0.00 0.00 61.98 63.70 1ic0 s VAL 48 Cb -0.13 -3.96 0.03 0.00 0.00 0.00 0.00 36.38 32.32 1ic0 s VAL 48 CO 0.16 0.49 -0.11 -0.54 0.00 0.00 0.00 175.10 175.10 1ic0 s LYS 49 N -0.70 1.94 -0.26 2.72 -0.14 -1.26 -1.65 119.74 120.39 1ic0 s LYS 49 Ca 0.31 -0.48 0.02 0.00 -1.36 0.00 0.00 55.97 54.47 1ic0 s LYS 49 Cb -0.20 -1.96 0.06 0.00 -1.68 0.00 0.00 37.83 34.06 1ic0 s LYS 49 CO 0.20 -0.28 -0.07 0.08 -0.76 0.00 0.00 175.35 174.51 1ic0 s VAL 50 N 1.57 1.91 -0.51 3.17 1.01 0.18 -0.85 120.40 126.87 1ic0 s VAL 50 Ca 0.04 -1.53 -0.24 0.00 0.00 0.00 0.00 61.98 60.25 1ic0 s VAL 50 Cb -0.13 -2.11 0.04 0.00 0.00 0.00 0.00 36.38 34.17 1ic0 s VAL 50 CO -0.09 -0.11 0.90 -0.69 0.00 0.00 0.00 175.10 175.10 1ic0 s VAL 51 N 1.21 4.47 -0.31 2.92 1.01 0.10 0.46 120.40 130.27 1ic0 s VAL 51 Ca -0.06 0.37 -0.10 0.00 0.00 0.00 0.00 61.98 62.19 1ic0 s VAL 51 Cb -0.19 -4.47 -0.01 0.00 0.00 0.00 0.00 36.38 31.70 1ic0 s VAL 51 CO -0.06 -0.98 0.15 -0.69 0.00 0.00 0.00 175.10 173.53 1ic0 s VAL 52 N 3.75 4.68 -0.29 2.92 1.01 -0.02 -1.39 120.40 131.05 1ic0 s VAL 52 Ca 0.31 -0.34 -0.11 0.00 0.00 0.00 0.00 61.98 61.84 1ic0 s VAL 52 Cb -0.12 -3.36 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 1ic0 s VAL 52 CO 0.21 0.10 0.18 -0.70 0.00 0.00 0.00 175.10 174.89 1ic0 s GLU 53 N 1.63 3.79 -0.61 2.72 2.12 0.37 -0.79 118.70 127.93 1ic0 s GLU 53 Ca 0.05 -0.42 -0.22 0.00 0.36 0.00 0.00 54.97 54.74 1ic0 s GLU 53 Cb -0.17 -3.65 0.07 0.00 0.26 0.00 0.00 34.13 30.65 1ic0 s GLU 53 CO 0.07 -0.25 0.88 1.21 -0.54 0.00 0.00 175.26 176.63 1ic0 s ASN 54 N 1.73 6.21 0.00 -1.70 3.04 0.71 -1.05 114.94 123.87 1ic0 s ASN 54 Ca 0.07 -0.95 0.27 0.00 0.04 0.00 0.00 52.86 52.28 1ic0 s ASN 54 Cb -0.16 -2.39 0.87 0.00 -1.54 0.00 0.00 41.25 38.03 1ic0 s ASN 54 CO 0.10 -1.30 1.64 0.29 -3.04 0.00 0.00 177.10 174.80 1ic0 n LYS 55 N 7.28 1.80 -2.48 0.43 4.76 -0.27 -0.27 118.16 129.41 1ic0 n LYS 55 Ca -0.04 -1.17 -0.34 0.00 -2.87 0.00 0.00 58.31 53.89 1ic0 n LYS 55 Cb 0.45 -1.48 -0.03 0.00 -1.84 0.00 0.00 35.03 32.14 1ic0 n LYS 55 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1ic0 s SER 56 N -2.00 6.24 0.00 4.39 0.15 -1.08 -4.69 113.70 116.71 1ic0 s SER 56 Ca 0.36 1.99 0.27 0.00 0.70 0.00 0.00 55.95 59.27 1ic0 s SER 56 Cb 0.21 -2.57 1.57 0.00 -1.71 0.00 0.00 66.02 63.52 1ic0 s SER 56 CO 0.33 -0.85 1.96 -0.81 1.20 0.00 0.00 173.24 175.06 1ic0 n PRO 57 N -0.96 0.76 -4.38 5.44 -0.04 -1.26 -3.54 135.00 131.01 1ic0 n PRO 57 Ca 0.09 0.01 -0.19 0.00 -0.04 0.00 0.00 63.50 63.37 1ic0 n PRO 57 Cb 0.52 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 1ic0 n PRO 57 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 1ic0 s ILE 58 N -2.11 0.92 0.43 0.52 -4.36 -1.26 -4.79 121.20 110.55 1ic0 s ILE 58 Ca 0.38 -2.00 -0.25 0.00 -0.26 0.00 0.00 60.65 58.51 1ic0 s ILE 58 Cb 0.18 -2.67 -0.08 0.00 1.25 0.00 0.00 42.46 41.14 1ic0 s ILE 58 CO 0.33 -0.04 1.32 -0.44 0.24 0.00 0.00 174.94 176.35 1ic0 s SER 59 N -3.40 6.13 0.07 4.36 0.01 -1.26 -3.84 113.70 115.78 1ic0 s SER 59 Ca 0.36 2.68 0.07 0.00 1.31 0.00 0.00 55.95 60.37 1ic0 s SER 59 Cb 0.08 -2.64 -0.03 0.00 0.21 0.00 0.00 66.02 63.64 1ic0 s SER 59 CO 0.14 -0.98 -0.18 -1.61 0.41 0.00 0.00 173.24 171.02 1ic0 s GLU 60 N -2.37 1.05 0.13 12.44 0.41 0.09 -4.94 118.70 125.51 1ic0 s GLU 60 Ca 0.59 -1.00 0.03 0.00 -0.41 0.00 0.00 54.97 54.18 1ic0 s GLU 60 Cb -0.38 -1.18 -0.04 0.00 -1.78 0.00 0.00 34.13 30.75 1ic0 s GLU 60 CO 0.49 0.28 0.19 0.20 -0.49 0.00 0.00 175.26 175.93 1ic0 s GLY 61 N -1.61 1.83 -0.24 -1.39 0.00 -1.26 0.88 107.32 105.52 1ic0 s GLY 61 Ca 0.03 -1.07 -0.04 0.00 0.00 0.00 0.00 44.72 43.65 1ic0 s GLY 61 CO 0.03 -1.06 0.15 -0.12 0.00 0.00 0.00 173.10 172.09 1ic0 s PHE 62 N -1.66 0.11 0.04 1.90 5.36 0.25 -4.18 117.98 119.81 1ic0 s PHE 62 Ca 0.33 -0.47 0.06 0.00 -0.96 0.00 0.00 56.93 55.89 1ic0 s PHE 62 Cb -0.11 -0.71 -0.02 0.00 -0.34 0.00 0.00 43.02 41.83 1ic0 s PHE 62 CO 0.26 -0.70 -0.17 -1.12 -1.46 0.00 0.00 175.22 172.03 1ic0 s SER 63 N 2.17 1.97 -0.34 6.13 0.01 0.15 -1.43 113.70 122.36 1ic0 s SER 63 Ca 0.06 -0.49 0.02 0.00 1.31 0.00 0.00 55.95 56.85 1ic0 s SER 63 Cb -0.16 -0.14 0.15 0.00 0.21 0.00 0.00 66.02 66.08 1ic0 s SER 63 CO -0.24 0.07 0.34 -0.63 0.41 0.00 0.00 173.24 173.20 1ic0 s ILE 64 N -0.85 -0.32 0.18 1.44 1.01 0.34 -1.24 121.20 121.76 1ic0 s ILE 64 Ca 0.04 -0.88 -0.18 0.00 0.00 0.00 0.00 60.65 59.62 1ic0 s ILE 64 Cb -0.08 -0.80 0.13 0.00 0.01 0.00 0.00 42.46 41.72 1ic0 s ILE 64 CO 0.02 -0.57 1.63 0.44 0.00 0.00 0.00 174.94 176.45 1ic0 h ASP 65 N 7.43 -0.72 -0.33 3.58 3.32 -1.80 -2.03 116.42 125.86 1ic0 h ASP 65 Ca -0.01 0.17 0.10 0.00 0.02 0.00 0.00 57.03 57.31 1ic0 h ASP 65 Cb 1.06 0.40 -0.01 0.00 0.22 0.00 0.00 39.33 40.99 1ic0 h ASP 65 CO 0.25 -0.24 0.59 0.00 -1.72 0.00 0.00 179.24 178.11 1ic0 h ALA 66 N 1.22 1.99 0.00 3.45 0.00 -1.95 -0.17 119.26 123.81 1ic0 h ALA 66 Ca 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 1ic0 h ALA 66 Cb 0.45 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.25 1ic0 h ALA 66 CO -0.54 -0.76 -0.24 1.19 0.00 0.00 0.00 179.25 178.90 1ic0 n PHE 67 N -3.25 0.00 -2.27 0.00 3.01 -0.93 -4.98 117.46 109.05 1ic0 n PHE 67 Ca 0.06 -1.06 -0.20 0.00 1.01 0.00 0.00 57.45 57.25 1ic0 n PHE 67 Cb 0.72 -0.17 -0.02 0.00 -0.01 0.00 0.00 39.48 40.00 1ic0 n PHE 67 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ic0 n GLY 68 N -1.15 -0.10 3.58 1.37 0.00 -0.08 -4.95 105.19 103.86 1ic0 n GLY 68 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.76 1ic0 n GLY 68 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ic0 s VAL 69 N -2.96 4.88 -0.28 1.61 1.01 -0.81 -4.98 120.40 118.88 1ic0 s VAL 69 Ca 0.00 0.66 -0.02 0.00 0.00 0.00 0.00 61.98 62.62 1ic0 s VAL 69 Cb 0.00 -4.08 0.12 0.00 0.00 0.00 0.00 36.38 32.42 1ic0 s VAL 69 CO 0.00 -0.30 0.24 -1.58 0.00 0.00 0.00 175.10 173.46 1ic0 s GLN 70 N 2.73 0.27 0.12 2.72 0.74 -1.26 -0.50 119.66 124.48 1ic0 s GLN 70 Ca 0.25 -0.20 0.05 0.00 0.05 0.00 0.00 55.36 55.51 1ic0 s GLN 70 Cb -0.14 -0.86 -0.04 0.00 1.10 0.00 0.00 33.01 33.06 1ic0 s GLN 70 CO 0.15 -0.98 -0.11 -1.21 -0.55 0.00 0.00 175.29 172.58 1ic0 s GLU 71 N 2.29 0.95 -0.13 1.67 0.41 -0.51 -5.00 118.70 118.37 1ic0 s GLU 71 Ca 0.09 -1.25 0.00 0.00 -0.41 0.00 0.00 54.97 53.41 1ic0 s GLU 71 Cb -0.15 -0.68 0.02 0.00 -1.78 0.00 0.00 34.13 31.54 1ic0 s GLU 71 CO -0.31 0.11 -0.13 0.08 -0.49 0.00 0.00 175.26 174.52 1ic0 s VAL 72 N -2.51 1.42 -0.26 2.63 1.01 -1.26 -0.58 120.40 120.85 1ic0 s VAL 72 Ca 0.09 -0.54 -0.08 0.00 0.00 0.00 0.00 61.98 61.45 1ic0 s VAL 72 Cb -0.02 -1.35 -0.03 0.00 0.00 0.00 0.00 36.38 34.98 1ic0 s VAL 72 CO 0.01 0.43 0.09 -0.63 0.00 0.00 0.00 175.10 175.01 1ic0 s ILE 73 N 1.47 4.44 0.75 2.22 1.09 0.25 -4.91 121.20 126.52 1ic0 s ILE 73 Ca 0.03 -0.17 -0.14 0.00 -1.10 0.00 0.00 60.65 59.27 1ic0 s ILE 73 Cb -0.13 -3.11 0.05 0.00 -1.06 0.00 0.00 42.46 38.21 1ic0 s ILE 73 CO -0.09 0.29 1.20 -0.54 -0.10 0.00 0.00 174.94 175.70 1ic0 s LYS 74 N 1.63 2.02 0.08 2.79 1.02 -1.26 -0.73 119.74 125.29 1ic0 s LYS 74 Ca 0.06 1.72 -0.34 0.00 0.02 0.00 0.00 55.97 57.43 1ic0 s LYS 74 Cb -0.15 -1.82 -0.13 0.00 -0.52 0.00 0.00 37.83 35.21 1ic0 s LYS 74 CO 0.05 -1.92 1.71 0.00 -0.92 0.00 0.00 175.35 174.27 1ic0 n ALA 75 N -2.92 1.37 -0.98 5.17 0.00 -1.25 -1.54 120.51 120.37 1ic0 n ALA 75 Ca 0.13 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.95 1ic0 n ALA 75 Cb 0.50 -2.44 0.00 0.00 0.00 0.00 0.00 19.45 17.52 1ic0 n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ic0 n GLY 76 N 3.85 0.61 3.82 0.00 0.00 0.63 -4.99 105.19 109.11 1ic0 n GLY 76 Ca 0.19 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.99 1ic0 n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ic0 s GLU 77 N -0.16 2.68 -0.06 1.61 2.02 -0.59 -4.83 118.70 119.37 1ic0 s GLU 77 Ca 0.00 -1.31 0.06 0.00 0.02 0.00 0.00 54.97 53.74 1ic0 s GLU 77 Cb 0.00 -2.43 -0.01 0.00 0.10 0.00 0.00 34.13 31.80 1ic0 s GLU 77 CO 0.00 0.16 -0.24 0.99 0.02 0.00 0.00 175.26 176.19 1ic0 s THR 78 N -2.30 1.98 -0.05 3.63 2.01 -1.26 -0.21 115.64 119.44 1ic0 s THR 78 Ca 0.39 -1.02 0.01 0.00 0.31 0.00 0.00 61.69 61.37 1ic0 s THR 78 Cb -0.06 -1.68 0.02 0.00 0.01 0.00 0.00 72.50 70.79 1ic0 s THR 78 CO 0.25 0.55 -0.05 -0.75 -0.69 0.00 0.00 174.62 173.94 1ic0 s LYS 79 N -0.09 0.94 -0.20 4.92 2.20 0.03 -4.96 119.74 122.57 1ic0 s LYS 79 Ca -0.05 -0.12 -0.21 0.00 -0.36 0.00 0.00 55.97 55.23 1ic0 s LYS 79 Cb -0.14 -0.96 -0.02 0.00 -1.51 0.00 0.00 37.83 35.19 1ic0 s LYS 79 CO 0.04 -0.11 0.64 0.99 -0.36 0.00 0.00 175.35 176.55 1ic0 s THR 80 N 1.06 5.01 -0.20 3.43 2.01 -1.26 -0.84 115.64 124.85 1ic0 s THR 80 Ca -0.09 1.19 -0.04 0.00 0.31 0.00 0.00 61.69 63.06 1ic0 s THR 80 Cb -0.14 -3.95 -0.02 0.00 0.01 0.00 0.00 72.50 68.40 1ic0 s THR 80 CO -0.01 0.10 -0.02 -0.63 -0.69 0.00 0.00 174.62 173.38 1ic0 s ILE 81 N 1.97 3.76 0.02 1.82 1.01 0.17 -4.91 121.20 125.05 1ic0 s ILE 81 Ca 0.29 -0.38 0.07 0.00 0.00 0.00 0.00 60.65 60.63 1ic0 s ILE 81 Cb -0.16 -2.70 -0.02 0.00 0.01 0.00 0.00 42.46 39.59 1ic0 s ILE 81 CO 0.10 0.43 -0.22 -0.94 0.00 0.00 0.00 174.94 174.32 1ic0 s SER 82 N 1.07 2.60 0.01 3.58 1.04 -1.26 0.48 113.70 121.22 1ic0 s SER 82 Ca 0.02 -0.48 -0.28 0.00 0.48 0.00 0.00 55.95 55.69 1ic0 s SER 82 Cb -0.14 -0.25 0.10 0.00 0.10 0.00 0.00 66.02 65.82 1ic0 s SER 82 CO 0.01 0.22 0.87 0.72 0.98 0.00 0.00 173.24 176.04 1ic0 s PHE 83 N -0.68 -0.35 -0.21 5.02 -0.71 -0.66 -5.00 117.98 115.41 1ic0 s PHE 83 Ca 0.08 0.20 -0.10 0.00 -1.04 0.00 0.00 56.93 56.07 1ic0 s PHE 83 Cb -0.09 0.55 -0.05 0.00 -1.21 0.00 0.00 43.02 42.22 1ic0 s PHE 83 CO 0.01 -0.58 0.15 0.99 -1.34 0.00 0.00 175.22 174.45 1ic0 s THR 84 N -3.17 5.39 -1.36 -4.49 2.01 -1.26 0.35 115.64 113.11 1ic0 s THR 84 Ca 0.05 0.22 -0.12 0.00 0.31 0.00 0.00 61.69 62.15 1ic0 s THR 84 Cb -0.01 -3.49 0.11 0.00 0.01 0.00 0.00 72.50 69.12 1ic0 s THR 84 CO -0.09 0.42 2.00 0.00 -0.69 0.00 0.00 174.62 176.26 1ic0 n ALA 85 N 3.69 5.29 0.87 7.40 0.00 -1.04 -4.75 120.51 131.98 1ic0 n ALA 85 Ca -0.15 -4.10 0.08 0.00 0.00 0.00 0.00 53.44 49.27 1ic0 n ALA 85 Cb 0.52 -3.26 0.45 0.00 0.00 0.00 0.00 19.45 17.16 1ic0 n ALA 85 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ic0 n ASP 86 N 5.13 0.00 -4.00 0.00 5.75 -1.26 0.49 116.55 122.66 1ic0 n ASP 86 Ca 0.45 -0.10 -0.15 0.00 -0.01 0.00 0.00 54.79 54.99 1ic0 n ASP 86 Cb 0.38 -0.22 -0.13 0.00 -1.03 0.00 0.00 41.12 40.12 1ic0 n ASP 86 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1ic0 s LYS 87 N -2.43 0.47 0.56 0.11 1.02 -1.26 -4.76 119.74 113.45 1ic0 s LYS 87 Ca 0.19 -0.41 -0.07 0.00 0.02 0.00 0.00 55.97 55.70 1ic0 s LYS 87 Cb 0.12 -0.38 -0.02 0.00 -0.52 0.00 0.00 37.83 37.03 1ic0 s LYS 87 CO 0.25 0.09 0.90 0.00 -0.92 0.00 0.00 175.35 175.67 1ic0 s ALA 88 N -0.60 3.26 0.00 5.17 0.00 -1.26 -4.71 121.76 123.62 1ic0 s ALA 88 Ca -0.02 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.48 1ic0 s ALA 88 Cb -0.05 -2.73 0.00 0.00 0.00 0.00 0.00 23.12 20.33 1ic0 s ALA 88 CO 0.00 -0.62 0.00 0.41 0.00 0.00 0.00 175.76 175.55 1ic0 n GLY 89 N -2.52 0.72 2.98 0.00 0.00 0.26 -4.92 105.19 101.71 1ic0 n GLY 89 Ca 0.03 -2.06 -0.29 0.00 0.00 0.00 0.00 46.02 43.70 1ic0 n GLY 89 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ic0 s ALA 90 N -1.39 1.74 -0.04 4.61 0.00 -1.26 -0.41 121.76 125.01 1ic0 s ALA 90 Ca 0.00 -0.88 0.06 0.00 0.00 0.00 0.00 51.96 51.14 1ic0 s ALA 90 Cb 0.00 -1.08 -0.01 0.00 0.00 0.00 0.00 23.12 22.03 1ic0 s ALA 90 CO 0.00 -0.51 -0.23 -0.06 0.00 0.00 0.00 175.76 174.96 1ic0 s PHE 91 N 1.53 2.16 0.26 0.00 0.40 0.67 -4.95 117.98 118.06 1ic0 s PHE 91 Ca 0.03 -0.55 -0.29 0.00 -0.60 0.00 0.00 56.93 55.52 1ic0 s PHE 91 Cb -0.14 -1.41 -0.10 0.00 0.51 0.00 0.00 43.02 41.88 1ic0 s PHE 91 CO -0.09 -0.13 1.29 0.99 0.70 0.00 0.00 175.22 177.97 1ic0 s THR 92 N -0.28 3.02 -0.25 0.64 2.01 -1.26 0.81 115.64 120.32 1ic0 s THR 92 Ca 0.02 0.93 -0.07 0.00 0.31 0.00 0.00 61.69 62.88 1ic0 s THR 92 Cb -0.11 -3.59 -0.02 0.00 0.01 0.00 0.00 72.50 68.78 1ic0 s THR 92 CO 0.02 0.18 0.06 -0.63 -0.69 0.00 0.00 174.62 173.56 1ic0 s ILE 93 N -0.55 4.13 0.16 1.82 1.01 -0.74 -4.41 121.20 122.62 1ic0 s ILE 93 Ca 0.52 -0.31 -0.05 0.00 0.00 0.00 0.00 60.65 60.82 1ic0 s ILE 93 Cb -0.37 -2.96 -0.03 0.00 0.01 0.00 0.00 42.46 39.11 1ic0 s ILE 93 CO 0.45 0.30 0.17 -1.66 0.00 0.00 0.00 174.94 174.20 1ic0 s TRP 94 N 1.58 0.70 -0.22 3.97 1.48 -0.37 -0.29 118.94 125.79 1ic0 s TRP 94 Ca 0.06 -1.05 -0.11 0.00 -1.06 0.00 0.00 56.10 53.93 1ic0 s TRP 94 Cb -0.15 -0.30 -0.05 0.00 -1.16 0.00 0.00 33.47 31.81 1ic0 s TRP 94 CO 0.02 -0.63 0.19 0.00 -4.06 0.00 0.00 176.95 172.48 1ic0 n GLN 96 N 4.08 1.59 -0.09 0.00 0.00 -1.26 -4.04 117.38 117.66 1ic0 n GLN 96 Ca -0.14 -0.87 -0.08 0.00 0.00 0.00 0.00 57.00 55.91 1ic0 n GLN 96 Cb 0.52 -1.43 -0.16 0.00 0.00 0.00 0.00 30.24 29.18 1ic0 n GLN 96 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.06 178.34 1ic0 n LEU 97 N 0.07 0.00 -4.46 2.61 4.77 -1.26 -5.04 117.00 113.70 1ic0 n LEU 97 Ca 0.18 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.93 1ic0 n LEU 97 Cb 0.30 0.44 -0.10 0.00 -2.33 0.00 0.00 43.42 41.73 1ic0 n LEU 97 CO 0.14 0.44 -0.37 -1.00 -1.33 0.00 0.00 177.39 175.28 1ic0 s HIS 98 N -2.56 2.06 0.24 -1.77 3.76 -1.26 -5.10 115.29 110.67 1ic0 s HIS 98 Ca -0.09 -0.65 -0.31 0.00 -0.15 0.00 0.00 55.06 53.85 1ic0 s HIS 98 Cb 0.06 -1.18 -0.13 0.00 1.11 0.00 0.00 32.58 32.45 1ic0 s HIS 98 CO 0.81 0.35 1.56 -2.30 -0.85 0.00 0.00 174.74 174.32 1ic0 n PRO 99 N -0.63 2.44 0.33 8.40 -0.02 -1.26 -4.79 135.00 139.47 1ic0 n PRO 99 Ca -0.05 0.87 0.21 0.00 -2.02 0.00 0.00 63.50 62.51 1ic0 n PRO 99 Cb 0.63 -2.63 1.13 0.00 -0.02 0.00 0.00 33.50 32.62 1ic0 n PRO 99 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 1ic0 h LYS 100 N 5.16 0.00 -0.63 -0.52 1.57 -1.89 -0.03 116.57 120.23 1ic0 h LYS 100 Ca -0.45 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1ic0 h LYS 100 Cb 1.24 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1ic0 h LYS 100 CO 0.83 0.00 0.00 0.27 -0.57 0.00 0.00 179.45 179.98 1ic0 n ASN 101 N -3.02 3.76 -0.07 0.86 6.94 -1.26 -3.52 115.26 118.95 1ic0 n ASN 101 Ca -0.03 -1.99 -0.15 0.00 -0.02 0.00 0.00 54.58 52.39 1ic0 n ASN 101 Cb 0.13 -0.42 -0.05 0.00 -2.36 0.00 0.00 39.78 37.09 1ic0 n ASN 101 CO 0.00 0.00 0.00 -0.38 -1.03 0.00 0.00 177.26 175.85 1ic0 n ILE 102 N 1.53 0.98 -3.41 1.53 2.08 -0.17 -4.75 119.36 117.15 1ic0 n ILE 102 Ca 0.22 -0.13 -0.45 0.00 0.56 0.00 0.00 62.75 62.96 1ic0 n ILE 102 Cb 0.60 -1.78 -0.04 0.00 -0.75 0.00 0.00 39.64 37.67 1ic0 n ILE 102 CO 0.00 0.00 0.00 -2.28 0.56 0.00 0.00 176.55 174.83 1ic0 s HIS 103 N -2.34 3.58 0.29 1.39 2.46 -0.33 -1.11 115.29 119.23 1ic0 s HIS 103 Ca -0.21 -1.98 -0.30 0.00 0.47 0.00 0.00 55.06 53.04 1ic0 s HIS 103 Cb 0.07 -3.69 -0.11 0.00 -0.13 0.00 0.00 32.58 28.73 1ic0 s HIS 103 CO 0.28 -0.97 1.54 -0.51 -2.47 0.00 0.00 174.74 172.60 1ic0 s LEU 104 N 0.50 4.35 0.77 8.88 1.43 -1.08 -4.47 118.68 129.07 1ic0 s LEU 104 Ca 0.14 2.88 -0.12 0.00 -1.03 0.00 0.00 54.13 56.01 1ic0 s LEU 104 Cb -0.17 -3.64 0.06 0.00 0.03 0.00 0.00 46.19 42.47 1ic0 s LEU 104 CO -0.05 -0.85 1.11 -2.16 0.23 0.00 0.00 176.35 174.63 1ic0 s PRO 105 N -0.64 2.29 0.00 1.29 0.04 -1.26 -4.57 135.00 132.15 1ic0 s PRO 105 Ca 0.61 0.46 0.00 0.00 0.04 0.00 0.00 61.00 62.11 1ic0 s PRO 105 Cb -0.46 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.12 1ic0 s PRO 105 CO 0.48 -1.44 0.00 0.41 0.04 0.00 0.00 177.00 176.49 1ic0 n GLY 106 N -2.63 7.00 3.11 0.56 0.00 0.61 -4.95 105.19 108.88 1ic0 n GLY 106 Ca 0.07 -1.85 -0.13 0.00 0.00 0.00 0.00 46.02 44.12 1ic0 n GLY 106 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ic0 s THR 107 N 0.53 0.00 -0.26 2.61 2.01 -0.75 -1.79 115.64 118.00 1ic0 s THR 107 Ca 0.00 -0.03 -0.06 0.00 0.31 0.00 0.00 61.69 61.91 1ic0 s THR 107 Cb 0.00 -0.33 -0.01 0.00 0.01 0.00 0.00 72.50 72.17 1ic0 s THR 107 CO 0.00 -0.02 0.05 -0.22 -0.69 0.00 0.00 174.62 173.74 1ic0 s LEU 108 N 0.05 3.46 -0.31 4.42 2.96 0.24 -1.75 118.68 127.75 1ic0 s LEU 108 Ca -0.01 -0.44 -0.07 0.00 -0.22 0.00 0.00 54.13 53.39 1ic0 s LEU 108 Cb -0.02 -1.86 0.01 0.00 0.50 0.00 0.00 46.19 44.82 1ic0 s LEU 108 CO 0.00 -0.09 0.09 0.20 -1.32 0.00 0.00 176.35 175.24 1ic0 s ASN 109 N 1.54 5.21 -0.38 3.68 0.01 -0.03 -0.24 114.94 124.73 1ic0 s ASN 109 Ca 0.05 -0.79 -0.13 0.00 -0.71 0.00 0.00 52.86 51.29 1ic0 s ASN 109 Cb -0.16 -1.89 0.02 0.00 0.41 0.00 0.00 41.25 39.63 1ic0 s ASN 109 CO 0.01 -0.22 0.24 -0.69 -1.51 0.00 0.00 177.10 174.93 1ic0 s VAL 110 N 1.49 4.88 0.05 1.60 1.01 0.46 -0.81 120.40 129.08 1ic0 s VAL 110 Ca 0.02 -0.72 -0.00 0.00 0.00 0.00 0.00 61.98 61.27 1ic0 s VAL 110 Cb -0.18 -3.69 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 1ic0 s VAL 110 CO 0.03 -0.23 0.20 -0.69 0.00 0.00 0.00 175.10 174.41 1ic0 s VAL 111 N 1.61 5.39 -1.01 2.92 1.01 -0.19 -0.58 120.40 129.56 1ic0 s VAL 111 Ca 0.04 -0.36 0.00 0.00 0.00 0.00 0.00 61.98 61.65 1ic0 s VAL 111 Cb -0.19 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.58 1ic0 s VAL 111 CO 0.08 0.17 0.25 -0.62 0.00 0.00 0.00 175.10 174.98