#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ic0 n ASN 3 N 0.00 -0.30 -4.82 0.26 2.04 -1.26 -4.97 115.26 106.20 1ic0 n ASN 3 Ca 0.00 -1.90 -0.36 0.00 -0.44 0.00 0.00 54.58 51.88 1ic0 n ASN 3 Cb 0.00 0.70 -0.06 0.00 -2.53 0.00 0.00 39.78 37.89 1ic0 n ASN 3 CO 0.00 0.00 0.00 -0.36 -0.44 0.00 0.00 177.26 176.46 1ic0 s PHE 4 N -2.59 3.67 -0.22 -2.53 0.08 -0.70 -4.99 117.98 110.70 1ic0 s PHE 4 Ca 0.16 1.26 0.01 0.00 0.12 0.00 0.00 56.93 58.48 1ic0 s PHE 4 Cb 0.01 -2.51 0.05 0.00 -0.57 0.00 0.00 43.02 40.00 1ic0 s PHE 4 CO 0.12 0.42 -0.10 -0.80 -0.10 0.00 0.00 175.22 174.76 1ic0 s ASN 5 N -1.56 3.79 -0.13 1.36 0.01 -1.26 -0.74 114.94 116.41 1ic0 s ASN 5 Ca 0.38 -1.09 -0.00 0.00 -0.71 0.00 0.00 52.86 51.44 1ic0 s ASN 5 Cb -0.17 -1.32 -0.01 0.00 0.41 0.00 0.00 41.25 40.16 1ic0 s ASN 5 CO 0.20 -0.17 -0.13 -0.69 -1.51 0.00 0.00 177.10 174.80 1ic0 s VAL 6 N 1.31 3.05 -0.15 1.60 1.01 -0.33 -4.25 120.40 122.63 1ic0 s VAL 6 Ca -0.04 -0.66 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 1ic0 s VAL 6 Cb -0.18 -2.28 -0.02 0.00 0.00 0.00 0.00 36.38 33.90 1ic0 s VAL 6 CO -0.07 0.52 -0.08 -0.69 0.00 0.00 0.00 175.10 174.78 1ic0 s VAL 7 N 0.38 3.47 -0.24 2.92 1.01 0.15 -0.72 120.40 127.37 1ic0 s VAL 7 Ca -0.10 -0.51 -0.09 0.00 0.00 0.00 0.00 61.98 61.28 1ic0 s VAL 7 Cb -0.16 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.68 1ic0 s VAL 7 CO 0.05 0.50 0.13 -0.63 0.00 0.00 0.00 175.10 175.15 1ic0 s ILE 8 N 0.45 4.94 0.06 2.22 1.01 -0.22 0.06 121.20 129.71 1ic0 s ILE 8 Ca -0.06 0.04 0.06 0.00 0.00 0.00 0.00 60.65 60.68 1ic0 s ILE 8 Cb -0.15 -3.31 -0.03 0.00 0.01 0.00 0.00 42.46 38.99 1ic0 s ILE 8 CO 0.04 0.33 -0.17 0.20 0.00 0.00 0.00 174.94 175.34 1ic0 s ASN 9 N 1.32 2.07 -0.08 3.58 -0.87 -0.64 -0.16 114.94 120.16 1ic0 s ASN 9 Ca 0.06 -0.54 -0.00 0.00 -1.57 0.00 0.00 52.86 50.80 1ic0 s ASN 9 Cb -0.15 -0.13 -0.03 0.00 -0.02 0.00 0.00 41.25 40.92 1ic0 s ASN 9 CO 0.06 0.06 -0.04 0.00 -2.57 0.00 0.00 177.10 174.61 1ic0 s ALA 10 N -0.95 3.12 -0.16 0.60 0.00 -1.26 -0.24 121.76 122.86 1ic0 s ALA 10 Ca 0.04 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.15 1ic0 s ALA 10 Cb -0.09 -1.35 0.02 0.00 0.00 0.00 0.00 23.12 21.70 1ic0 s ALA 10 CO 0.02 0.57 -0.16 0.71 0.00 0.00 0.00 175.76 176.90 1ic0 s TYR 11 N -0.80 2.37 -0.52 0.00 1.51 0.22 -4.98 117.35 115.15 1ic0 s TYR 11 Ca 0.12 -1.36 -0.05 0.00 -1.01 0.00 0.00 57.07 54.77 1ic0 s TYR 11 Cb -0.11 -1.70 0.14 0.00 -0.11 0.00 0.00 41.96 40.17 1ic0 s TYR 11 CO 0.02 -0.71 0.35 0.34 -1.11 0.00 0.00 175.55 174.44 1ic0 s ASP 12 N 1.41 5.47 -0.20 2.29 -1.08 -1.26 -1.21 116.67 122.09 1ic0 s ASP 12 Ca 0.05 -2.30 -0.01 0.00 -0.52 0.00 0.00 52.55 49.77 1ic0 s ASP 12 Cb -0.13 -1.91 0.01 0.00 -1.46 0.00 0.00 42.92 39.43 1ic0 s ASP 12 CO -0.11 -0.53 -0.13 -0.89 0.52 0.00 0.00 175.17 174.02 1ic0 s THR 13 N 0.76 2.61 -0.10 1.71 2.01 -0.28 -5.03 115.64 117.31 1ic0 s THR 13 Ca 0.11 -0.77 0.01 0.00 0.31 0.00 0.00 61.69 61.34 1ic0 s THR 13 Cb -0.22 -2.15 0.02 0.00 0.01 0.00 0.00 72.50 70.16 1ic0 s THR 13 CO -0.03 0.48 -0.11 -0.89 -0.69 0.00 0.00 174.62 173.37 1ic0 s THR 14 N 1.36 1.19 -0.12 -0.82 2.01 -1.26 -0.85 115.64 117.15 1ic0 s THR 14 Ca 0.05 -0.43 0.01 0.00 0.31 0.00 0.00 61.69 61.63 1ic0 s THR 14 Cb -0.14 -1.14 0.02 0.00 0.01 0.00 0.00 72.50 71.26 1ic0 s THR 14 CO -0.09 0.38 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.47 1ic0 s ILE 15 N 1.29 1.34 1.00 1.82 1.01 0.11 -5.00 121.20 122.77 1ic0 s ILE 15 Ca -0.02 -0.52 -0.12 0.00 0.00 0.00 0.00 60.65 59.99 1ic0 s ILE 15 Cb -0.14 -1.27 0.19 0.00 0.01 0.00 0.00 42.46 41.25 1ic0 s ILE 15 CO -0.04 0.42 1.08 -2.16 0.00 0.00 0.00 174.94 174.24 1ic0 s PRO 16 N 1.31 0.43 0.42 2.79 0.04 -1.26 -0.52 135.00 138.20 1ic0 s PRO 16 Ca -0.01 0.98 -0.26 0.00 0.04 0.00 0.00 61.00 61.75 1ic0 s PRO 16 Cb -0.14 -1.70 -0.10 0.00 0.04 0.00 0.00 34.50 32.61 1ic0 s PRO 16 CO -0.06 -2.86 1.45 -1.91 0.04 0.00 0.00 177.00 173.67 1ic0 n GLU 17 N -4.33 2.43 -4.34 4.56 2.13 -1.26 -4.54 120.64 115.30 1ic0 n GLU 17 Ca 0.07 0.86 -0.17 0.00 0.66 0.00 0.00 57.16 58.57 1ic0 n GLU 17 Cb 0.54 -2.64 -0.10 0.00 0.27 0.00 0.00 31.44 29.51 1ic0 n GLU 17 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 1ic0 s LEU 18 N -2.38 2.37 -0.25 4.31 1.02 -0.40 -4.94 118.68 118.41 1ic0 s LEU 18 Ca 0.58 -1.15 -0.02 0.00 0.02 0.00 0.00 54.13 53.57 1ic0 s LEU 18 Cb -0.46 -0.41 0.08 0.00 0.02 0.00 0.00 46.19 45.41 1ic0 s LEU 18 CO 0.60 -0.40 0.05 0.21 0.02 0.00 0.00 176.35 176.84 1ic0 s ASN 19 N -3.31 3.50 -0.32 2.29 2.47 -1.26 0.29 114.94 118.60 1ic0 s ASN 19 Ca 0.25 -1.21 -0.05 0.00 0.42 0.00 0.00 52.86 52.27 1ic0 s ASN 19 Cb 0.04 -0.77 0.04 0.00 -1.45 0.00 0.00 41.25 39.11 1ic0 s ASN 19 CO 0.07 -0.35 0.07 0.68 -3.72 0.00 0.00 177.10 173.85 1ic0 s VAL 20 N 1.71 3.57 -1.13 -5.21 -7.23 0.19 -4.64 120.40 107.67 1ic0 s VAL 20 Ca 0.03 -1.11 -0.06 0.00 -1.81 0.00 0.00 61.98 59.02 1ic0 s VAL 20 Cb -0.17 -2.99 -0.04 0.00 0.56 0.00 0.00 36.38 33.74 1ic0 s VAL 20 CO -0.16 -0.10 0.89 1.21 -0.31 0.00 0.00 175.10 176.64 1ic0 n GLU 21 N 4.77 -3.32 0.00 4.82 4.07 -1.26 -1.63 120.64 128.09 1ic0 n GLU 21 Ca -0.13 0.77 0.00 0.00 -0.06 0.00 0.00 57.16 57.74 1ic0 n GLU 21 Cb 0.45 -5.50 0.00 0.00 -0.06 0.00 0.00 31.44 26.33 1ic0 n GLU 21 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1ic0 n GLY 22 N -1.32 1.57 3.64 8.31 0.00 -1.26 -4.92 105.19 111.20 1ic0 n GLY 22 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.58 4.79 0.11 1.61 1.01 -0.65 -5.03 120.40 121.66 1ic0 s VAL 23 Ca 0.00 1.55 -0.27 0.00 0.00 0.00 0.00 61.98 63.26 1ic0 s VAL 23 Cb 0.00 -4.16 -0.06 0.00 0.00 0.00 0.00 36.38 32.15 1ic0 s VAL 23 CO 0.00 -0.15 0.84 -0.89 0.00 0.00 0.00 175.10 174.90 1ic0 s THR 24 N 2.96 4.52 -0.23 3.92 2.01 -1.26 0.53 115.64 128.09 1ic0 s THR 24 Ca 0.36 1.83 0.02 0.00 0.31 0.00 0.00 61.69 64.21 1ic0 s THR 24 Cb -0.15 -4.20 0.05 0.00 0.01 0.00 0.00 72.50 68.21 1ic0 s THR 24 CO 0.09 0.40 -0.13 -0.69 -0.69 0.00 0.00 174.62 173.60 1ic0 s VAL 25 N -0.38 2.04 0.68 3.82 1.01 0.14 -4.95 120.40 122.77 1ic0 s VAL 25 Ca 0.41 -1.36 -0.17 0.00 0.00 0.00 0.00 61.98 60.86 1ic0 s VAL 25 Cb -0.22 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.06 1ic0 s VAL 25 CO 0.27 0.13 0.95 0.29 0.00 0.00 0.00 175.10 176.74 1ic0 n LYS 26 N 4.52 0.64 -1.65 2.72 4.01 -1.26 -1.28 118.16 125.86 1ic0 n LYS 26 Ca -0.16 0.27 -0.40 0.00 -0.51 0.00 0.00 58.31 57.51 1ic0 n LYS 26 Cb 0.45 -2.19 0.02 0.00 -0.51 0.00 0.00 35.03 32.80 1ic0 n LYS 26 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1ic0 n ASN 27 N -1.30 1.69 -4.49 4.39 6.94 -1.26 -4.73 115.26 116.50 1ic0 n ASN 27 Ca 0.13 1.01 -0.31 0.00 -0.02 0.00 0.00 54.58 55.39 1ic0 n ASN 27 Cb 0.49 -1.43 -0.12 0.00 -2.36 0.00 0.00 39.78 36.36 1ic0 n ASN 27 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1ic0 s ILE 28 N -1.30 3.02 -0.23 1.53 1.01 0.32 -4.94 121.20 120.62 1ic0 s ILE 28 Ca 0.66 -1.00 -0.03 0.00 0.00 0.00 0.00 60.65 60.27 1ic0 s ILE 28 Cb -0.50 -2.26 0.10 0.00 0.01 0.00 0.00 42.46 39.81 1ic0 s ILE 28 CO 0.55 0.40 0.22 -0.60 0.00 0.00 0.00 174.94 175.51 1ic0 s ARG 29 N -1.28 0.21 -0.06 2.79 3.00 -1.26 -0.71 118.95 121.64 1ic0 s ARG 29 Ca 0.15 0.04 -0.00 0.00 -1.00 0.00 0.00 55.73 54.92 1ic0 s ARG 29 Cb -0.11 -1.14 0.02 0.00 0.00 0.00 0.00 34.95 33.73 1ic0 s ARG 29 CO 0.05 -0.77 -0.03 0.00 0.00 0.00 0.00 175.30 174.55 1ic0 s ALA 30 N 2.30 0.74 -0.19 6.12 0.00 -0.03 -5.03 121.76 125.67 1ic0 s ALA 30 Ca 0.07 -0.13 0.01 0.00 0.00 0.00 0.00 51.96 51.92 1ic0 s ALA 30 Cb -0.15 -0.59 0.03 0.00 0.00 0.00 0.00 23.12 22.41 1ic0 s ALA 30 CO -0.18 -0.22 -0.14 0.12 0.00 0.00 0.00 175.76 175.33 1ic0 s PHE 31 N 1.40 2.61 0.14 0.00 5.36 -1.26 -1.13 117.98 125.10 1ic0 s PHE 31 Ca -0.03 -1.65 -0.03 0.00 -0.96 0.00 0.00 56.93 54.26 1ic0 s PHE 31 Cb -0.13 -1.76 -0.03 0.00 -0.34 0.00 0.00 43.02 40.75 1ic0 s PHE 31 CO -0.03 -0.77 0.12 -0.80 -1.46 0.00 0.00 175.22 172.29 1ic0 s ASN 32 N 1.34 0.23 -0.07 6.13 0.01 -0.35 -4.75 114.94 117.47 1ic0 s ASN 32 Ca 0.01 -1.10 0.02 0.00 -0.71 0.00 0.00 52.86 51.08 1ic0 s ASN 32 Cb -0.15 0.34 0.01 0.00 0.41 0.00 0.00 41.25 41.86 1ic0 s ASN 32 CO -0.10 -0.78 -0.14 -0.69 -1.51 0.00 0.00 177.10 173.89 1ic0 s VAL 33 N -4.02 1.27 0.05 1.60 1.01 -0.33 0.71 120.40 120.68 1ic0 s VAL 33 Ca 0.22 -0.55 0.07 0.00 0.00 0.00 0.00 61.98 61.71 1ic0 s VAL 33 Cb 0.06 -1.15 -0.03 0.00 0.00 0.00 0.00 36.38 35.27 1ic0 s VAL 33 CO 0.01 0.39 -0.19 -0.76 0.00 0.00 0.00 175.10 174.55 1ic0 s LEU 34 N 0.66 2.19 -0.18 3.92 1.43 0.66 -2.56 118.68 124.80 1ic0 s LEU 34 Ca -0.14 -0.53 -0.17 0.00 -1.03 0.00 0.00 54.13 52.26 1ic0 s LEU 34 Cb -0.16 -0.86 -0.04 0.00 0.03 0.00 0.00 46.19 45.16 1ic0 s LEU 34 CO 0.04 0.11 0.43 0.20 0.23 0.00 0.00 176.35 177.36 1ic0 s ASN 35 N -1.26 6.53 -0.22 2.29 -0.87 -1.26 -1.61 114.94 118.53 1ic0 s ASN 35 Ca 0.06 0.62 -0.01 0.00 -1.57 0.00 0.00 52.86 51.96 1ic0 s ASN 35 Cb -0.09 -2.25 0.06 0.00 -0.02 0.00 0.00 41.25 38.95 1ic0 s ASN 35 CO 0.02 -0.06 0.00 -1.61 -2.57 0.00 0.00 177.10 172.88 1ic0 s GLU 36 N 1.12 1.07 0.74 -0.60 2.02 0.11 -2.46 118.70 120.71 1ic0 s GLU 36 Ca 0.22 -0.72 -0.11 0.00 0.02 0.00 0.00 54.97 54.37 1ic0 s GLU 36 Cb -0.15 -2.32 0.04 0.00 0.10 0.00 0.00 34.13 31.80 1ic0 s GLU 36 CO 0.08 -0.65 1.08 -1.25 0.02 0.00 0.00 175.26 174.54 1ic0 s PRO 37 N 1.64 2.53 -0.07 0.39 0.04 -1.26 0.29 135.00 138.56 1ic0 s PRO 37 Ca -0.02 0.85 0.11 0.00 0.04 0.00 0.00 61.00 61.98 1ic0 s PRO 37 Cb -0.18 -1.95 -0.23 0.00 0.04 0.00 0.00 34.50 32.18 1ic0 s PRO 37 CO -0.08 -1.36 0.58 -1.91 0.04 0.00 0.00 177.00 174.26 1ic0 n GLU 38 N -3.29 0.65 -4.85 4.56 2.13 -1.03 -4.83 120.64 113.98 1ic0 n GLU 38 Ca 0.07 0.27 -0.33 0.00 0.66 0.00 0.00 57.16 57.83 1ic0 n GLU 38 Cb 0.55 -1.76 -0.13 0.00 0.27 0.00 0.00 31.44 30.36 1ic0 n GLU 38 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 1ic0 s THR 39 N -2.58 3.11 -0.12 6.31 2.01 -1.26 -1.45 115.64 121.65 1ic0 s THR 39 Ca -0.07 -0.69 -0.00 0.00 0.31 0.00 0.00 61.69 61.24 1ic0 s THR 39 Cb 0.08 -2.24 0.02 0.00 0.01 0.00 0.00 72.50 70.37 1ic0 s THR 39 CO 0.82 0.58 -0.10 -0.76 -0.69 0.00 0.00 174.62 174.47 1ic0 s LEU 40 N -0.52 1.34 -0.29 4.42 1.43 0.24 -4.97 118.68 120.33 1ic0 s LEU 40 Ca 0.07 -0.36 -0.05 0.00 -1.03 0.00 0.00 54.13 52.76 1ic0 s LEU 40 Cb -0.12 -0.95 0.02 0.00 0.03 0.00 0.00 46.19 45.17 1ic0 s LEU 40 CO 0.02 -0.10 0.05 -0.69 0.23 0.00 0.00 176.35 175.86 1ic0 s VAL 41 N 1.64 3.68 0.11 -1.59 1.01 -1.26 0.08 120.40 124.07 1ic0 s VAL 41 Ca 0.05 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.25 1ic0 s VAL 41 Cb -0.13 -2.92 -0.04 0.00 0.00 0.00 0.00 36.38 33.29 1ic0 s VAL 41 CO -0.09 0.06 -0.16 0.68 0.00 0.00 0.00 175.10 175.60 1ic0 s VAL 42 N 1.44 1.40 0.36 2.92 -7.23 0.10 -4.98 120.40 114.42 1ic0 s VAL 42 Ca 0.01 -1.62 -0.25 0.00 -1.81 0.00 0.00 61.98 58.32 1ic0 s VAL 42 Cb -0.17 -1.46 -0.10 0.00 0.56 0.00 0.00 36.38 35.21 1ic0 s VAL 42 CO 0.01 -0.30 0.99 -0.54 -0.31 0.00 0.00 175.10 174.95 1ic0 s LYS 43 N -2.34 4.39 0.20 4.82 -0.14 -1.26 0.10 119.74 125.51 1ic0 s LYS 43 Ca 0.07 1.40 -0.32 0.00 -1.36 0.00 0.00 55.97 55.76 1ic0 s LYS 43 Cb -0.07 -2.65 -0.12 0.00 -1.68 0.00 0.00 37.83 33.31 1ic0 s LYS 43 CO 0.03 0.08 1.68 0.21 -0.76 0.00 0.00 175.35 176.60 1ic0 s LYS 44 N -2.32 4.14 0.00 1.68 2.20 -1.26 -2.18 119.74 122.00 1ic0 s LYS 44 Ca 0.54 2.56 0.00 0.00 -0.36 0.00 0.00 55.97 58.71 1ic0 s LYS 44 Cb -0.19 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.04 1ic0 s LYS 44 CO 0.25 -0.72 0.00 0.41 -0.36 0.00 0.00 175.35 174.93 1ic0 n GLY 45 N 3.83 0.87 3.81 5.54 0.00 0.49 -4.99 105.19 114.75 1ic0 n GLY 45 Ca 0.15 -0.02 -0.35 0.00 0.00 0.00 0.00 46.02 45.79 1ic0 n GLY 45 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1ic0 s ASP 46 N -2.02 7.06 -1.17 1.61 1.11 -0.93 -4.82 116.67 117.51 1ic0 s ASP 46 Ca 0.00 1.51 -0.07 0.00 0.18 0.00 0.00 52.55 54.17 1ic0 s ASP 46 Cb 0.00 -2.46 0.24 0.00 1.07 0.00 0.00 42.92 41.78 1ic0 s ASP 46 CO 0.00 -0.07 1.61 0.00 1.18 0.00 0.00 175.17 177.89 1ic0 n ALA 47 N 0.38 5.12 -1.66 5.23 0.00 -1.26 -1.15 120.51 127.17 1ic0 n ALA 47 Ca 0.00 -4.58 -0.47 0.00 0.00 0.00 0.00 53.44 48.40 1ic0 n ALA 47 Cb 0.51 -2.64 -0.04 0.00 0.00 0.00 0.00 19.45 17.28 1ic0 n ALA 47 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1ic0 n VAL 48 N 2.37 0.12 -4.40 0.00 0.31 0.23 -4.83 118.33 112.14 1ic0 n VAL 48 Ca 0.32 -0.03 -0.32 0.00 -0.01 0.00 0.00 64.34 64.29 1ic0 n VAL 48 Cb 0.35 -1.43 -0.16 0.00 -0.91 0.00 0.00 33.84 31.69 1ic0 n VAL 48 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1ic0 s LYS 49 N 0.68 2.93 -0.23 5.55 -0.14 -1.26 -2.11 119.74 125.16 1ic0 s LYS 49 Ca 0.78 -0.81 0.00 0.00 -1.36 0.00 0.00 55.97 54.58 1ic0 s LYS 49 Cb -0.71 -2.44 0.06 0.00 -1.68 0.00 0.00 37.83 33.05 1ic0 s LYS 49 CO 0.41 -0.11 -0.05 0.08 -0.76 0.00 0.00 175.35 174.92 1ic0 s VAL 50 N 1.05 1.44 -0.52 3.17 1.01 0.12 -1.72 120.40 124.96 1ic0 s VAL 50 Ca -0.01 -1.13 -0.22 0.00 0.00 0.00 0.00 61.98 60.62 1ic0 s VAL 50 Cb -0.14 -1.71 0.04 0.00 0.00 0.00 0.00 36.38 34.58 1ic0 s VAL 50 CO -0.07 -0.08 0.79 -0.69 0.00 0.00 0.00 175.10 175.06 1ic0 s VAL 51 N 1.44 4.62 -0.33 2.92 1.01 0.08 0.11 120.40 130.24 1ic0 s VAL 51 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.82 1ic0 s VAL 51 Cb -0.18 -4.41 -0.01 0.00 0.00 0.00 0.00 36.38 31.78 1ic0 s VAL 51 CO -0.06 -0.93 0.19 -0.69 0.00 0.00 0.00 175.10 173.61 1ic0 s VAL 52 N 3.34 4.86 -0.31 2.92 1.01 0.17 -1.19 120.40 131.21 1ic0 s VAL 52 Ca 0.24 -0.41 -0.12 0.00 0.00 0.00 0.00 61.98 61.69 1ic0 s VAL 52 Cb -0.15 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.67 1ic0 s VAL 52 CO 0.17 -0.01 0.23 -0.70 0.00 0.00 0.00 175.10 174.79 1ic0 s GLU 53 N 1.65 3.76 -0.57 2.72 2.12 0.10 -0.70 118.70 127.78 1ic0 s GLU 53 Ca 0.05 -0.43 -0.20 0.00 0.36 0.00 0.00 54.97 54.75 1ic0 s GLU 53 Cb -0.17 -3.72 0.08 0.00 0.26 0.00 0.00 34.13 30.57 1ic0 s GLU 53 CO 0.08 -0.30 0.72 1.21 -0.54 0.00 0.00 175.26 176.42 1ic0 s ASN 54 N 1.74 6.20 0.00 -1.70 3.04 -0.32 -1.06 114.94 122.84 1ic0 s ASN 54 Ca 0.07 -1.16 0.26 0.00 0.04 0.00 0.00 52.86 52.07 1ic0 s ASN 54 Cb -0.17 -2.32 0.92 0.00 -1.54 0.00 0.00 41.25 38.15 1ic0 s ASN 54 CO 0.11 -1.09 1.66 0.29 -3.04 0.00 0.00 177.10 175.03 1ic0 n LYS 55 N 6.50 1.72 -2.43 0.43 4.76 0.78 -0.61 118.16 129.31 1ic0 n LYS 55 Ca -0.07 -1.06 -0.35 0.00 -2.87 0.00 0.00 58.31 53.95 1ic0 n LYS 55 Cb 0.44 -1.46 -0.02 0.00 -1.84 0.00 0.00 35.03 32.15 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 -1.86 6.24 0.00 4.39 0.15 -1.02 -4.67 113.70 116.93 1ic0 s SER 56 Ca 0.36 2.07 0.31 0.00 0.70 0.00 0.00 55.95 59.39 1ic0 s SER 56 Cb 0.20 -2.58 1.85 0.00 -1.71 0.00 0.00 66.02 63.79 1ic0 s SER 56 CO 0.31 -0.85 2.19 -0.81 1.20 0.00 0.00 173.24 175.28 1ic0 n PRO 57 N -0.80 1.00 -4.36 5.44 -0.04 -1.26 -3.78 135.00 131.19 1ic0 n PRO 57 Ca 0.09 -0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.36 1ic0 n PRO 57 Cb 0.51 -1.49 -0.10 0.00 -0.04 0.00 0.00 33.50 32.38 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 -2.00 1.02 0.36 0.52 -4.36 -1.26 -4.77 121.20 110.72 1ic0 s ILE 58 Ca 0.47 -2.02 -0.28 0.00 -0.26 0.00 0.00 60.65 58.55 1ic0 s ILE 58 Cb 0.21 -2.52 -0.11 0.00 1.25 0.00 0.00 42.46 41.29 1ic0 s ILE 58 CO 0.36 -0.18 1.46 -0.44 0.24 0.00 0.00 174.94 176.38 1ic0 s SER 59 N -3.36 6.42 0.02 4.36 0.01 -1.26 -3.95 113.70 115.93 1ic0 s SER 59 Ca 0.32 2.98 0.06 0.00 1.31 0.00 0.00 55.95 60.63 1ic0 s SER 59 Cb 0.07 -2.66 -0.02 0.00 0.21 0.00 0.00 66.02 63.61 1ic0 s SER 59 CO 0.12 -0.82 -0.19 -1.61 0.41 0.00 0.00 173.24 171.15 1ic0 s GLU 60 N -1.96 1.38 0.10 12.44 0.41 0.02 -4.96 118.70 126.14 1ic0 s GLU 60 Ca 0.53 -0.80 0.01 0.00 -0.41 0.00 0.00 54.97 54.30 1ic0 s GLU 60 Cb -0.45 -1.41 -0.04 0.00 -1.78 0.00 0.00 34.13 30.45 1ic0 s GLU 60 CO 0.61 0.37 0.25 0.20 -0.49 0.00 0.00 175.26 176.20 1ic0 s GLY 61 N -0.85 1.98 -0.16 -1.39 0.00 -1.26 -0.40 107.32 105.24 1ic0 s GLY 61 Ca 0.07 -0.91 -0.04 0.00 0.00 0.00 0.00 44.72 43.83 1ic0 s GLY 61 CO 0.01 -0.90 0.11 -0.12 0.00 0.00 0.00 173.10 172.20 1ic0 s PHE 62 N -1.62 0.09 0.04 1.90 5.36 -0.55 -4.16 117.98 119.03 1ic0 s PHE 62 Ca 0.35 -0.13 0.02 0.00 -0.96 0.00 0.00 56.93 56.21 1ic0 s PHE 62 Cb -0.12 -0.60 -0.02 0.00 -0.34 0.00 0.00 43.02 41.94 1ic0 s PHE 62 CO 0.28 -0.48 -0.08 -1.12 -1.46 0.00 0.00 175.22 172.36 1ic0 s SER 63 N 2.18 0.83 -0.32 6.13 0.01 0.86 -1.28 113.70 122.10 1ic0 s SER 63 Ca 0.03 -0.54 0.01 0.00 1.31 0.00 0.00 55.95 56.77 1ic0 s SER 63 Cb -0.15 0.04 0.15 0.00 0.21 0.00 0.00 66.02 66.26 1ic0 s SER 63 CO -0.09 -0.20 0.35 -0.63 0.41 0.00 0.00 173.24 173.08 1ic0 s ILE 64 N -1.35 -0.42 0.16 1.44 1.01 -0.19 -1.41 121.20 120.43 1ic0 s ILE 64 Ca -0.10 -0.64 -0.23 0.00 0.00 0.00 0.00 60.65 59.67 1ic0 s ILE 64 Cb -0.10 -0.86 0.04 0.00 0.01 0.00 0.00 42.46 41.56 1ic0 s ILE 64 CO 0.00 -0.48 1.61 0.44 0.00 0.00 0.00 174.94 176.51 1ic0 h ASP 65 N 7.77 -1.01 0.00 3.58 3.32 -1.81 -2.34 116.42 125.94 1ic0 h ASP 65 Ca -0.05 0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.17 1ic0 h ASP 65 Cb 1.08 0.47 0.00 0.00 0.22 0.00 0.00 39.33 41.09 1ic0 h ASP 65 CO 0.27 -0.32 0.55 0.00 -1.72 0.00 0.00 179.24 178.02 1ic0 h ALA 66 N 0.72 1.45 0.00 3.45 0.00 -1.94 -0.87 119.26 122.08 1ic0 h ALA 66 Ca 0.16 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 55.00 1ic0 h ALA 66 Cb 0.53 0.00 -0.15 0.00 0.00 0.00 0.00 17.79 18.17 1ic0 h ALA 66 CO -0.49 -0.45 -0.64 1.19 0.00 0.00 0.00 179.25 178.86 1ic0 n PHE 67 N -2.25 0.00 -0.71 0.00 3.01 -0.91 -4.99 117.46 111.61 1ic0 n PHE 67 Ca -0.01 -0.78 0.00 0.00 1.01 0.00 0.00 57.45 57.68 1ic0 n PHE 67 Cb 0.57 -0.16 0.00 0.00 -0.01 0.00 0.00 39.48 39.87 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 -0.34 0.10 3.68 1.37 0.00 -0.33 -4.93 105.19 104.74 1ic0 n GLY 68 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.29 3.53 -0.34 1.61 1.01 -1.02 -4.94 120.40 118.96 1ic0 s VAL 69 Ca 0.00 0.86 -0.01 0.00 0.00 0.00 0.00 61.98 62.84 1ic0 s VAL 69 Cb 0.00 -3.55 0.19 0.00 0.00 0.00 0.00 36.38 33.01 1ic0 s VAL 69 CO 0.00 -0.03 0.80 -1.58 0.00 0.00 0.00 175.10 174.30 1ic0 s GLN 70 N 2.95 0.46 0.21 2.72 0.74 -1.24 -1.02 119.66 124.47 1ic0 s GLN 70 Ca 0.68 0.08 0.10 0.00 0.05 0.00 0.00 55.36 56.27 1ic0 s GLN 70 Cb -0.33 0.11 -0.05 0.00 1.10 0.00 0.00 33.01 33.84 1ic0 s GLN 70 CO 0.28 -0.74 -0.18 -1.21 -0.55 0.00 0.00 175.29 172.88 1ic0 s GLU 71 N 2.36 1.45 -0.17 1.67 0.41 -0.41 -4.99 118.70 119.02 1ic0 s GLU 71 Ca 0.17 -1.58 0.01 0.00 -0.41 0.00 0.00 54.97 53.15 1ic0 s GLU 71 Cb -0.03 -1.47 0.02 0.00 -1.78 0.00 0.00 34.13 30.86 1ic0 s GLU 71 CO -0.17 0.28 -0.19 0.08 -0.49 0.00 0.00 175.26 174.77 1ic0 s VAL 72 N -2.40 2.00 -0.22 2.63 1.01 -1.26 -1.48 120.40 120.68 1ic0 s VAL 72 Ca 0.23 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.25 1ic0 s VAL 72 Cb -0.04 -1.81 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 1ic0 s VAL 72 CO 0.10 0.53 -0.01 -0.63 0.00 0.00 0.00 175.10 175.09 1ic0 s ILE 73 N 1.29 3.75 0.73 2.22 1.01 0.46 -4.95 121.20 125.72 1ic0 s ILE 73 Ca 0.05 -0.37 -0.13 0.00 0.00 0.00 0.00 60.65 60.19 1ic0 s ILE 73 Cb -0.13 -2.71 0.04 0.00 0.01 0.00 0.00 42.46 39.66 1ic0 s ILE 73 CO -0.12 0.41 1.13 -0.54 0.00 0.00 0.00 174.94 175.81 1ic0 s LYS 74 N 1.35 2.34 -0.01 2.79 1.02 -1.26 -0.80 119.74 125.18 1ic0 s LYS 74 Ca 0.04 1.41 -0.33 0.00 0.02 0.00 0.00 55.97 57.11 1ic0 s LYS 74 Cb -0.15 -1.89 -0.12 0.00 -0.52 0.00 0.00 37.83 35.16 1ic0 s LYS 74 CO 0.00 -1.61 1.84 0.00 -0.92 0.00 0.00 175.35 174.66 1ic0 n ALA 75 N -2.97 1.19 -0.74 5.17 0.00 -1.25 -1.55 120.51 120.35 1ic0 n ALA 75 Ca 0.11 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1ic0 n ALA 75 Cb 0.52 -2.51 0.00 0.00 0.00 0.00 0.00 19.45 17.46 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 4.25 0.84 3.96 0.00 0.00 0.22 -4.99 105.19 109.47 1ic0 n GLY 76 Ca 0.21 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.26 3.42 -0.15 1.61 2.02 -0.59 -4.84 118.70 119.90 1ic0 s GLU 77 Ca 0.00 -0.77 0.02 0.00 0.02 0.00 0.00 54.97 54.24 1ic0 s GLU 77 Cb 0.00 -2.88 0.01 0.00 0.10 0.00 0.00 34.13 31.37 1ic0 s GLU 77 CO 0.00 0.43 -0.21 0.99 0.02 0.00 0.00 175.26 176.49 1ic0 s THR 78 N -1.98 1.99 -0.03 3.63 2.01 -1.26 -1.18 115.64 118.82 1ic0 s THR 78 Ca 0.34 -0.92 0.06 0.00 0.31 0.00 0.00 61.69 61.48 1ic0 s THR 78 Cb -0.09 -1.77 -0.01 0.00 0.01 0.00 0.00 72.50 70.63 1ic0 s THR 78 CO 0.29 0.53 -0.22 -0.75 -0.69 0.00 0.00 174.62 173.78 1ic0 s LYS 79 N 0.99 2.00 -0.26 4.92 2.20 0.12 -4.94 119.74 124.77 1ic0 s LYS 79 Ca -0.03 -0.80 -0.10 0.00 -0.36 0.00 0.00 55.97 54.67 1ic0 s LYS 79 Cb -0.15 -1.84 -0.05 0.00 -1.51 0.00 0.00 37.83 34.29 1ic0 s LYS 79 CO -0.05 0.42 0.16 0.99 -0.36 0.00 0.00 175.35 176.51 1ic0 s THR 80 N -0.35 5.11 -0.17 3.43 2.01 -1.26 0.46 115.64 124.87 1ic0 s THR 80 Ca 0.04 0.10 -0.12 0.00 0.31 0.00 0.00 61.69 62.01 1ic0 s THR 80 Cb -0.10 -3.41 -0.05 0.00 0.01 0.00 0.00 72.50 68.95 1ic0 s THR 80 CO 0.01 0.30 0.23 -0.63 -0.69 0.00 0.00 174.62 173.84 1ic0 s ILE 81 N 1.51 5.34 -0.07 1.82 -1.09 0.30 -4.89 121.20 124.11 1ic0 s ILE 81 Ca 0.07 0.42 0.02 0.00 -2.23 0.00 0.00 60.65 58.92 1ic0 s ILE 81 Cb -0.15 -3.57 0.02 0.00 -1.58 0.00 0.00 42.46 37.17 1ic0 s ILE 81 CO 0.08 0.41 -0.10 -0.44 -1.23 0.00 0.00 174.94 173.65 1ic0 s SER 82 N 0.39 1.80 0.29 3.58 0.01 -1.26 0.15 113.70 118.66 1ic0 s SER 82 Ca 0.14 -0.28 -0.20 0.00 1.31 0.00 0.00 55.95 56.91 1ic0 s SER 82 Cb -0.12 -0.80 0.03 0.00 0.21 0.00 0.00 66.02 65.34 1ic0 s SER 82 CO 0.02 -0.01 0.74 0.72 0.41 0.00 0.00 173.24 175.12 1ic0 s PHE 83 N 0.93 -0.14 -0.12 2.43 -0.71 -0.90 -5.04 117.98 114.43 1ic0 s PHE 83 Ca -0.10 -0.35 0.02 0.00 -1.04 0.00 0.00 56.93 55.46 1ic0 s PHE 83 Cb -0.15 0.73 -0.00 0.00 -1.21 0.00 0.00 43.02 42.38 1ic0 s PHE 83 CO 0.01 -1.28 -0.18 0.99 -1.34 0.00 0.00 175.22 173.42 1ic0 s THR 84 N -3.63 2.53 -1.26 -4.49 2.01 -1.26 -0.60 115.64 108.95 1ic0 s THR 84 Ca 0.12 -0.84 -0.19 0.00 0.31 0.00 0.00 61.69 61.09 1ic0 s THR 84 Cb -0.06 -2.03 0.07 0.00 0.01 0.00 0.00 72.50 70.49 1ic0 s THR 84 CO 0.08 0.54 1.69 0.00 -0.69 0.00 0.00 174.62 176.23 1ic0 s ALA 85 N 0.48 3.23 -1.47 7.40 0.00 -0.30 -4.75 121.76 126.35 1ic0 s ALA 85 Ca -0.12 -2.82 0.30 0.00 0.00 0.00 0.00 51.96 49.31 1ic0 s ALA 85 Cb -0.17 -4.63 1.43 0.00 0.00 0.00 0.00 23.12 19.76 1ic0 s ALA 85 CO 0.05 -3.34 1.99 -0.40 0.00 0.00 0.00 175.76 174.06 1ic0 n ASP 86 N 8.45 0.13 -4.08 0.00 5.68 -1.26 0.18 116.55 125.65 1ic0 n ASP 86 Ca 0.46 -0.24 -0.22 0.00 -0.50 0.00 0.00 54.79 54.29 1ic0 n ASP 86 Cb 0.47 -0.22 -0.15 0.00 -1.14 0.00 0.00 41.12 40.07 1ic0 n ASP 86 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 1ic0 s LYS 87 N -2.56 1.16 0.33 0.11 1.02 -1.26 -4.78 119.74 113.76 1ic0 s LYS 87 Ca 0.28 -0.46 -0.15 0.00 0.02 0.00 0.00 55.97 55.67 1ic0 s LYS 87 Cb 0.20 -1.09 -0.09 0.00 -0.52 0.00 0.00 37.83 36.33 1ic0 s LYS 87 CO 0.47 0.24 0.74 0.00 -0.92 0.00 0.00 175.35 175.89 1ic0 s ALA 88 N -0.15 3.32 0.00 5.17 0.00 -1.26 -4.70 121.76 124.14 1ic0 s ALA 88 Ca 0.02 0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.00 1ic0 s ALA 88 Cb -0.07 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.28 1ic0 s ALA 88 CO 0.00 0.29 0.00 0.41 0.00 0.00 0.00 175.76 176.46 1ic0 n GLY 89 N -0.48 0.74 2.97 0.00 0.00 -0.69 -4.93 105.19 102.79 1ic0 n GLY 89 Ca 0.03 -1.76 -0.29 0.00 0.00 0.00 0.00 46.02 44.01 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 -1.00 1.67 -0.06 4.61 0.00 -1.26 -0.49 121.76 125.23 1ic0 s ALA 90 Ca 0.00 -0.83 0.05 0.00 0.00 0.00 0.00 51.96 51.18 1ic0 s ALA 90 Cb 0.00 -1.05 -0.00 0.00 0.00 0.00 0.00 23.12 22.07 1ic0 s ALA 90 CO 0.00 -0.50 -0.20 -0.06 0.00 0.00 0.00 175.76 175.00 1ic0 s PHE 91 N 1.56 2.02 0.14 0.00 0.40 0.53 -4.96 117.98 117.68 1ic0 s PHE 91 Ca 0.04 -0.65 -0.31 0.00 -0.60 0.00 0.00 56.93 55.41 1ic0 s PHE 91 Cb -0.13 -1.36 -0.09 0.00 0.51 0.00 0.00 43.02 41.95 1ic0 s PHE 91 CO -0.09 -0.23 1.43 0.99 0.70 0.00 0.00 175.22 178.02 1ic0 s THR 92 N 0.09 3.07 -0.34 0.64 2.01 -1.26 0.74 115.64 120.59 1ic0 s THR 92 Ca -0.07 0.79 -0.14 0.00 0.31 0.00 0.00 61.69 62.57 1ic0 s THR 92 Cb -0.14 -3.50 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1ic0 s THR 92 CO 0.04 0.07 0.31 -0.63 -0.69 0.00 0.00 174.62 173.71 1ic0 s ILE 93 N 0.96 5.22 0.13 1.82 -1.09 -0.67 -4.40 121.20 123.18 1ic0 s ILE 93 Ca 0.65 -0.04 -0.00 0.00 -2.23 0.00 0.00 60.65 59.03 1ic0 s ILE 93 Cb -0.39 -3.76 -0.04 0.00 -1.58 0.00 0.00 42.46 36.69 1ic0 s ILE 93 CO 0.32 -0.04 0.03 -1.66 -1.23 0.00 0.00 174.94 172.36 1ic0 s TRP 94 N 1.89 0.92 -0.24 3.97 1.48 -0.50 0.05 118.94 126.51 1ic0 s TRP 94 Ca 0.09 -1.16 -0.09 0.00 -1.06 0.00 0.00 56.10 53.89 1ic0 s TRP 94 Cb -0.17 -0.53 -0.04 0.00 -1.16 0.00 0.00 33.47 31.57 1ic0 s TRP 94 CO 0.11 -0.42 0.11 0.00 -4.06 0.00 0.00 176.95 172.69 1ic0 n GLN 96 N 4.49 1.56 -0.08 0.00 3.00 -1.26 -3.92 117.38 121.17 1ic0 n GLN 96 Ca -0.16 -0.86 -0.07 0.00 -0.01 0.00 0.00 57.00 55.91 1ic0 n GLN 96 Cb 0.52 -1.29 -0.15 0.00 0.00 0.00 0.00 30.24 29.31 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 0.13 0.00 -4.44 1.08 4.77 -1.26 -5.03 117.00 112.24 1ic0 n LEU 97 Ca 0.12 0.00 -0.22 0.00 -0.03 0.00 0.00 56.01 55.88 1ic0 n LEU 97 Cb 0.24 0.41 -0.10 0.00 -2.33 0.00 0.00 43.42 41.64 1ic0 n LEU 97 CO 0.09 0.41 -0.42 -1.00 -1.33 0.00 0.00 177.39 175.15 1ic0 s HIS 98 N -2.59 2.07 0.31 -1.77 3.76 -1.25 -5.09 115.29 110.72 1ic0 s HIS 98 Ca -0.09 -0.54 -0.30 0.00 -0.15 0.00 0.00 55.06 53.99 1ic0 s HIS 98 Cb 0.07 -1.06 -0.12 0.00 1.11 0.00 0.00 32.58 32.58 1ic0 s HIS 98 CO 0.79 0.47 1.55 -2.30 -0.85 0.00 0.00 174.74 174.41 1ic0 n PRO 99 N -0.59 2.63 0.22 8.40 -0.02 -1.26 -4.81 135.00 139.57 1ic0 n PRO 99 Ca -0.06 0.93 0.15 0.00 -2.02 0.00 0.00 63.50 62.50 1ic0 n PRO 99 Cb 0.62 -2.69 0.78 0.00 -0.02 0.00 0.00 33.50 32.19 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 4.33 0.00 -0.40 -0.52 1.57 -1.88 -1.59 116.57 118.08 1ic0 h LYS 100 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 1ic0 h LYS 100 Cb 1.23 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1ic0 h LYS 100 CO 0.76 0.00 0.00 0.27 -0.57 0.00 0.00 179.45 179.91 1ic0 n ASN 101 N -2.51 3.49 -0.09 0.86 6.94 -1.26 -3.69 115.26 119.01 1ic0 n ASN 101 Ca -0.02 -1.99 -0.13 0.00 -0.02 0.00 0.00 54.58 52.42 1ic0 n ASN 101 Cb 0.05 -0.26 -0.04 0.00 -2.36 0.00 0.00 39.78 37.18 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 1.51 1.46 -3.28 1.53 2.08 -0.66 -4.73 119.36 117.27 1ic0 n ILE 102 Ca 0.19 0.05 -0.46 0.00 0.56 0.00 0.00 62.75 63.09 1ic0 n ILE 102 Cb 0.61 -2.19 -0.03 0.00 -0.75 0.00 0.00 39.64 37.28 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 -2.76 3.49 0.28 1.39 2.46 -0.85 -1.19 115.29 118.11 1ic0 s HIS 103 Ca -0.29 -1.63 -0.30 0.00 0.47 0.00 0.00 55.06 53.31 1ic0 s HIS 103 Cb 0.06 -3.85 -0.11 0.00 -0.13 0.00 0.00 32.58 28.54 1ic0 s HIS 103 CO 0.41 -1.05 1.61 -0.51 -2.47 0.00 0.00 174.74 172.72 1ic0 s LEU 104 N 1.00 4.35 0.85 8.88 1.43 -1.06 -4.51 118.68 129.62 1ic0 s LEU 104 Ca 0.13 2.92 -0.11 0.00 -1.03 0.00 0.00 54.13 56.04 1ic0 s LEU 104 Cb -0.18 -3.63 0.10 0.00 0.03 0.00 0.00 46.19 42.51 1ic0 s LEU 104 CO -0.04 -0.91 1.10 -2.84 0.23 0.00 0.00 176.35 173.89 1ic0 s PRO 105 N -0.21 1.62 0.00 1.29 0.02 -1.26 -4.58 135.00 131.88 1ic0 s PRO 105 Ca 0.65 1.11 0.00 0.00 0.02 0.00 0.00 61.00 62.78 1ic0 s PRO 105 Cb -0.48 -1.83 0.00 0.00 0.02 0.00 0.00 34.50 32.21 1ic0 s PRO 105 CO 0.45 -2.07 0.00 0.41 -0.33 0.00 0.00 177.00 175.46 1ic0 n GLY 106 N -0.87 6.45 3.04 0.52 0.00 0.11 -4.94 105.19 109.50 1ic0 n GLY 106 Ca 0.09 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.09 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 0.04 -0.02 -0.32 2.61 2.01 -0.53 -1.66 115.64 117.77 1ic0 s THR 107 Ca 0.00 0.08 -0.08 0.00 0.31 0.00 0.00 61.69 62.00 1ic0 s THR 107 Cb 0.00 -0.30 0.02 0.00 0.01 0.00 0.00 72.50 72.23 1ic0 s THR 107 CO 0.00 0.03 0.11 -0.22 -0.69 0.00 0.00 174.62 173.85 1ic0 s LEU 108 N 0.63 4.08 -0.23 4.42 2.96 0.23 -0.59 118.68 130.17 1ic0 s LEU 108 Ca -0.04 -0.81 -0.08 0.00 -0.22 0.00 0.00 54.13 52.98 1ic0 s LEU 108 Cb -0.06 -1.91 -0.03 0.00 0.50 0.00 0.00 46.19 44.69 1ic0 s LEU 108 CO -0.03 -0.24 0.08 0.20 -1.32 0.00 0.00 176.35 175.03 1ic0 s ASN 109 N 1.50 5.33 -0.34 3.68 0.01 0.11 -0.35 114.94 124.88 1ic0 s ASN 109 Ca 0.02 -0.11 -0.10 0.00 -0.71 0.00 0.00 52.86 51.96 1ic0 s ASN 109 Cb -0.18 -1.95 0.02 0.00 0.41 0.00 0.00 41.25 39.55 1ic0 s ASN 109 CO 0.03 0.02 0.17 -0.69 -1.51 0.00 0.00 177.10 175.13 1ic0 s VAL 110 N 1.28 4.45 0.00 1.60 1.01 0.35 0.03 120.40 129.13 1ic0 s VAL 110 Ca 0.05 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.30 1ic0 s VAL 110 Cb -0.15 -3.40 0.00 0.00 0.00 0.00 0.00 36.38 32.83 1ic0 s VAL 110 CO 0.04 -0.11 0.00 1.33 0.00 0.00 0.00 175.10 176.36