#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ij8 s SER 5 N 1.63 4.73 0.13 0.00 0.15 -1.26 -4.77 113.70 114.31 1ij8 s SER 5 Ca 0.28 -0.02 0.02 0.00 0.70 0.00 0.00 55.95 56.93 1ij8 s SER 5 Cb -0.15 -1.29 -0.13 0.00 -1.71 0.00 0.00 66.02 62.75 1ij8 s SER 5 CO 0.12 0.34 1.29 -0.07 1.20 0.00 0.00 173.24 176.12 1ij8 h LEU 6 N 5.44 0.25 -9.45 3.45 3.38 -1.96 -3.45 115.31 112.96 1ij8 h LEU 6 Ca -0.46 -0.23 -0.59 0.00 0.09 0.00 0.00 57.88 56.69 1ij8 h LEU 6 Cb 1.18 -0.08 0.05 0.00 0.09 0.00 0.00 40.66 41.90 1ij8 h LEU 6 CO 0.54 1.10 0.86 0.41 0.09 0.00 0.00 178.44 181.44 1ij8 n THR 7 N -3.56 0.13 0.00 0.22 -1.04 -1.26 -4.61 114.28 104.16 1ij8 n THR 7 Ca -0.04 -0.02 0.00 0.00 -2.04 0.00 0.00 64.05 61.95 1ij8 n THR 7 Cb 0.89 -1.61 0.00 0.00 -1.82 0.00 0.00 70.33 67.79 1ij8 n THR 7 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ij8 n GLY 8 N 3.63 0.98 3.54 3.41 0.00 -0.18 -4.96 105.19 111.62 1ij8 n GLY 8 Ca 0.18 -1.90 -0.34 0.00 0.00 0.00 0.00 46.02 43.97 1ij8 n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ij8 s LYS 9 N -1.99 3.40 0.16 1.61 1.02 -1.26 -1.22 119.74 121.47 1ij8 s LYS 9 Ca 0.00 -0.51 0.04 0.00 0.02 0.00 0.00 55.97 55.52 1ij8 s LYS 9 Cb 0.00 -2.84 -0.05 0.00 -0.52 0.00 0.00 37.83 34.43 1ij8 s LYS 9 CO 0.00 0.39 -0.08 -1.58 -0.92 0.00 0.00 175.35 173.16 1ij8 s TRP 10 N -0.04 1.33 -0.00 3.18 0.52 0.80 -1.54 118.94 123.18 1ij8 s TRP 10 Ca 0.01 -0.80 -0.07 0.00 0.02 0.00 0.00 56.10 55.27 1ij8 s TRP 10 Cb -0.13 -0.70 0.00 0.00 -1.15 0.00 0.00 33.47 31.49 1ij8 s TRP 10 CO 0.03 0.05 0.14 -0.08 0.02 0.00 0.00 176.95 177.11 1ij8 s THR 11 N -3.35 0.07 0.08 2.01 -1.32 -0.50 -1.03 115.64 111.59 1ij8 s THR 11 Ca 0.19 -0.61 0.00 0.00 -1.21 0.00 0.00 61.69 60.07 1ij8 s THR 11 Cb 0.03 -0.41 0.00 0.00 -1.51 0.00 0.00 72.50 70.62 1ij8 s THR 11 CO 0.02 -0.33 0.03 -0.46 -2.21 0.00 0.00 174.62 171.67 1ij8 n ASN 12 N 1.63 1.76 0.24 8.08 0.23 -0.71 -0.89 115.26 125.60 1ij8 n ASN 12 Ca -0.22 -1.30 0.16 0.00 -0.53 0.00 0.00 54.58 52.69 1ij8 n ASN 12 Cb 0.56 0.03 0.64 0.00 -2.08 0.00 0.00 39.78 38.92 1ij8 n ASN 12 CO 0.00 0.00 0.00 -2.24 -0.93 0.00 0.00 177.26 174.09 1ij8 h ASP 13 N 0.14 0.00 0.41 0.53 2.03 -1.87 -2.77 116.42 114.89 1ij8 h ASP 13 Ca -0.06 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.24 1ij8 h ASP 13 Cb 0.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.68 1ij8 h ASP 13 CO 0.09 0.00 -0.69 0.18 -1.03 0.00 0.00 179.24 177.79 1ij8 n LEU 14 N -2.89 0.63 0.00 0.15 4.32 -1.26 -4.96 117.00 112.99 1ij8 n LEU 14 Ca 0.01 -0.09 0.00 0.00 -0.02 0.00 0.00 56.01 55.91 1ij8 n LEU 14 Cb 0.29 -0.17 0.00 0.00 -1.62 0.00 0.00 43.42 41.92 1ij8 n LEU 14 CO 0.26 0.13 0.00 0.61 -1.22 0.00 0.00 177.39 177.16 1ij8 n GLY 15 N 1.47 0.47 3.81 -0.72 0.00 -1.05 -5.07 105.19 104.10 1ij8 n GLY 15 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1ij8 n GLY 15 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ij8 s SER 16 N -2.90 6.38 0.19 1.61 0.01 -1.26 -4.81 113.70 112.92 1ij8 s SER 16 Ca 0.00 1.84 0.11 0.00 1.31 0.00 0.00 55.95 59.21 1ij8 s SER 16 Cb 0.00 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 1ij8 s SER 16 CO 0.00 -0.75 -0.22 0.20 0.41 0.00 0.00 173.24 172.87 1ij8 s ASN 17 N -2.23 3.52 -0.08 2.44 0.01 0.01 -1.73 114.94 116.88 1ij8 s ASN 17 Ca 0.65 -0.84 -0.07 0.00 -0.71 0.00 0.00 52.86 51.89 1ij8 s ASN 17 Cb -0.14 -0.30 0.02 0.00 0.41 0.00 0.00 41.25 41.23 1ij8 s ASN 17 CO 0.22 0.12 0.21 -0.32 -1.51 0.00 0.00 177.10 175.82 1ij8 s MET 18 N -2.71 0.24 -0.08 -0.60 -2.45 -0.20 0.04 119.30 113.54 1ij8 s MET 18 Ca 0.21 0.29 0.03 0.00 -1.25 0.00 0.00 55.69 54.98 1ij8 s MET 18 Cb -0.08 0.12 0.00 0.00 1.25 0.00 0.00 34.83 36.12 1ij8 s MET 18 CO 0.11 -0.03 -0.18 0.99 1.05 0.00 0.00 175.02 176.95 1ij8 s THR 19 N 0.10 1.60 -0.05 10.11 2.01 -0.40 -0.14 115.64 128.88 1ij8 s THR 19 Ca -0.00 -0.76 0.05 0.00 0.31 0.00 0.00 61.69 61.29 1ij8 s THR 19 Cb -0.01 -1.40 -0.01 0.00 0.01 0.00 0.00 72.50 71.09 1ij8 s THR 19 CO 0.00 0.46 -0.21 -0.63 -0.69 0.00 0.00 174.62 173.55 1ij8 s ILE 20 N 0.40 1.69 0.00 1.82 1.01 -0.36 -0.77 121.20 125.00 1ij8 s ILE 20 Ca -0.14 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 59.64 1ij8 s ILE 20 Cb -0.16 -1.44 0.00 0.00 0.01 0.00 0.00 42.46 40.87 1ij8 s ILE 20 CO 0.06 0.48 0.00 0.61 0.00 0.00 0.00 174.94 176.08 1ij8 n GLY 21 N 3.02 0.06 3.76 6.18 0.00 -0.31 -1.01 105.19 116.88 1ij8 n GLY 21 Ca -0.18 -1.79 -0.39 0.00 0.00 0.00 0.00 46.02 43.67 1ij8 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ij8 s ALA 22 N -3.32 2.99 -0.25 4.61 0.00 -1.26 -4.27 121.76 120.25 1ij8 s ALA 22 Ca 0.00 1.35 -0.11 0.00 0.00 0.00 0.00 51.96 53.20 1ij8 s ALA 22 Cb 0.00 -3.56 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 1ij8 s ALA 22 CO 0.00 -1.25 0.19 0.14 0.00 0.00 0.00 175.76 174.84 1ij8 s VAL 23 N -1.28 5.32 0.97 0.00 -7.23 -1.26 -4.54 120.40 112.38 1ij8 s VAL 23 Ca 0.67 0.22 -0.16 0.00 -1.81 0.00 0.00 61.98 60.90 1ij8 s VAL 23 Cb -0.41 -3.53 0.21 0.00 0.56 0.00 0.00 36.38 33.20 1ij8 s VAL 23 CO 0.50 0.30 1.33 0.54 -0.31 0.00 0.00 175.10 177.46 1ij8 s ASN 24 N 1.34 3.04 0.56 4.85 2.20 -0.67 -4.86 114.94 121.40 1ij8 s ASN 24 Ca 0.08 0.24 0.27 0.00 -0.94 0.00 0.00 52.86 52.52 1ij8 s ASN 24 Cb -0.15 -0.26 1.47 0.00 -2.00 0.00 0.00 41.25 40.31 1ij8 s ASN 24 CO 0.07 -2.78 1.97 0.77 -2.94 0.00 0.00 177.10 174.20 1ij8 h SER 25 N -1.67 0.00 0.02 3.54 4.64 -1.98 0.14 113.55 118.23 1ij8 h SER 25 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1ij8 h SER 25 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1ij8 h SER 25 CO 0.37 0.00 -0.02 0.54 -0.87 0.00 0.00 176.83 176.84 1ij8 n ARG 26 N -4.10 1.51 -0.58 4.77 1.74 -1.26 -4.92 116.66 113.82 1ij8 n ARG 26 Ca 0.09 -0.81 0.00 0.00 -0.77 0.00 0.00 57.85 56.36 1ij8 n ARG 26 Cb 0.63 -1.48 0.00 0.00 -1.02 0.00 0.00 32.46 30.58 1ij8 n ARG 26 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ij8 n GLY 27 N 1.17 0.88 3.79 -0.13 0.00 0.48 -4.83 105.19 106.55 1ij8 n GLY 27 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.84 1ij8 n GLY 27 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ij8 s GLU 28 N -0.38 4.49 0.09 1.61 2.02 -1.26 0.08 118.70 125.35 1ij8 s GLU 28 Ca 0.00 1.33 -0.14 0.00 0.02 0.00 0.00 54.97 56.18 1ij8 s GLU 28 Cb 0.00 -2.69 0.02 0.00 0.10 0.00 0.00 34.13 31.57 1ij8 s GLU 28 CO 0.00 0.19 0.32 -0.59 0.02 0.00 0.00 175.26 175.20 1ij8 s PHE 29 N -1.70 -0.09 0.28 1.61 -0.12 -0.44 -1.66 117.98 115.87 1ij8 s PHE 29 Ca 0.53 -0.21 0.03 0.00 -0.05 0.00 0.00 56.93 57.22 1ij8 s PHE 29 Cb -0.18 0.13 -0.06 0.00 -0.63 0.00 0.00 43.02 42.29 1ij8 s PHE 29 CO 0.23 -0.61 0.05 0.99 -0.05 0.00 0.00 175.22 175.83 1ij8 s THR 30 N -3.51 0.98 0.00 -4.49 2.01 -1.26 -1.65 115.64 107.72 1ij8 s THR 30 Ca 0.02 -2.01 0.00 0.00 0.31 0.00 0.00 61.69 60.01 1ij8 s THR 30 Cb 0.02 -2.65 0.00 0.00 0.01 0.00 0.00 72.50 69.88 1ij8 s THR 30 CO -0.10 -0.08 0.00 0.61 -0.69 0.00 0.00 174.62 174.37 1ij8 n GLY 31 N -0.56 0.49 3.18 4.40 0.00 -0.69 -1.17 105.19 110.85 1ij8 n GLY 31 Ca -0.02 -0.81 -0.23 0.00 0.00 0.00 0.00 46.02 44.95 1ij8 n GLY 31 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ij8 s THR 32 N -2.06 1.37 -0.19 2.61 2.01 0.06 -1.31 115.64 118.12 1ij8 s THR 32 Ca 0.00 -0.98 0.01 0.00 0.31 0.00 0.00 61.69 61.03 1ij8 s THR 32 Cb 0.00 -1.19 0.02 0.00 0.01 0.00 0.00 72.50 71.34 1ij8 s THR 32 CO 0.00 0.19 -0.19 -0.47 -0.69 0.00 0.00 174.62 173.46 1ij8 s TYR 33 N -0.69 2.80 -0.16 4.92 6.14 0.14 -1.27 117.35 129.24 1ij8 s TYR 33 Ca 0.05 -1.69 -0.03 0.00 0.64 0.00 0.00 57.07 56.04 1ij8 s TYR 33 Cb -0.08 -1.91 -0.03 0.00 0.42 0.00 0.00 41.96 40.36 1ij8 s TYR 33 CO 0.01 -0.81 -0.05 0.99 0.64 0.00 0.00 175.55 176.33 1ij8 s THR 34 N 1.28 3.79 0.01 4.34 2.01 0.11 -1.63 115.64 125.55 1ij8 s THR 34 Ca 0.04 -0.39 -0.02 0.00 0.31 0.00 0.00 61.69 61.63 1ij8 s THR 34 Cb -0.14 -2.66 -0.01 0.00 0.01 0.00 0.00 72.50 69.70 1ij8 s THR 34 CO -0.12 0.49 0.02 0.28 -0.69 0.00 0.00 174.62 174.60 1ij8 s THR 35 N 0.41 0.10 0.30 -0.82 -1.32 -1.09 -0.81 115.64 112.41 1ij8 s THR 35 Ca -0.04 -0.79 0.03 0.00 -1.21 0.00 0.00 61.69 59.67 1ij8 s THR 35 Cb -0.14 -0.30 -0.03 0.00 -1.51 0.00 0.00 72.50 70.52 1ij8 s THR 35 CO 0.03 -0.44 0.46 0.00 -2.21 0.00 0.00 174.62 172.46 1ij8 s ALA 36 N -1.36 3.86 -0.14 11.08 0.00 -1.26 -1.67 121.76 132.29 1ij8 s ALA 36 Ca -0.15 -1.13 0.17 0.00 0.00 0.00 0.00 51.96 50.86 1ij8 s ALA 36 Cb -0.09 -1.89 -0.11 0.00 0.00 0.00 0.00 23.12 21.03 1ij8 s ALA 36 CO -0.00 0.08 0.87 0.28 0.00 0.00 0.00 175.76 177.00 1ij8 h VAL 37 N 0.95 0.46 0.00 0.00 2.07 -0.85 -3.49 116.25 115.39 1ij8 h VAL 37 Ca -0.50 -1.89 0.00 0.00 0.82 0.00 0.00 66.70 65.12 1ij8 h VAL 37 Cb 1.23 1.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.99 1ij8 h VAL 37 CO 0.60 0.26 0.00 1.07 0.02 0.00 0.00 177.57 179.52 1ij8 n THR 38 N -2.88 0.00 0.00 2.57 5.66 -1.26 -5.06 114.28 113.31 1ij8 n THR 38 Ca -0.08 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.92 1ij8 n THR 38 Cb 0.81 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.59 1ij8 n THR 38 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 175.07 168.82 1ij8 n ASN 42 N -0.34 0.00 -0.00 1.09 2.85 -1.26 -5.00 115.26 112.60 1ij8 n ASN 42 Ca 0.00 0.00 -0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1ij8 n ASN 42 Cb 0.00 0.00 -0.00 0.00 1.24 0.00 0.00 39.78 41.02 1ij8 n ASN 42 CO 0.00 0.00 0.00 1.21 -2.11 0.00 0.00 177.26 176.36 1ij8 n GLU 43 N 0.00 0.02 -5.07 1.20 4.07 -1.26 -5.05 120.64 114.55 1ij8 n GLU 43 Ca 0.00 0.01 -0.32 0.00 -0.06 0.00 0.00 57.16 56.79 1ij8 n GLU 43 Cb 0.00 -0.32 -0.14 0.00 -0.06 0.00 0.00 31.44 30.92 1ij8 n GLU 43 CO 0.00 0.00 0.00 0.42 -0.06 0.00 0.00 177.13 177.49 1ij8 s ILE 44 N -1.13 2.58 -0.01 6.31 1.09 -1.26 -0.04 121.20 128.73 1ij8 s ILE 44 Ca -0.01 -0.93 0.03 0.00 -1.10 0.00 0.00 60.65 58.64 1ij8 s ILE 44 Cb 0.00 -1.97 -0.01 0.00 -1.06 0.00 0.00 42.46 39.43 1ij8 s ILE 44 CO 0.02 0.57 -0.11 -0.54 -0.10 0.00 0.00 174.94 174.78 1ij8 s LYS 45 N -0.72 0.96 -0.08 2.79 1.02 -0.67 -5.00 119.74 118.05 1ij8 s LYS 45 Ca 0.11 -0.38 -0.01 0.00 0.02 0.00 0.00 55.97 55.71 1ij8 s LYS 45 Cb -0.10 -0.91 -0.03 0.00 -0.52 0.00 0.00 37.83 36.26 1ij8 s LYS 45 CO 0.00 0.21 -0.03 -1.21 -0.92 0.00 0.00 175.35 173.39 1ij8 s GLU 46 N -0.13 2.89 -0.01 1.68 2.02 -1.26 -2.67 118.70 121.22 1ij8 s GLU 46 Ca 0.02 -0.48 0.00 0.00 0.02 0.00 0.00 54.97 54.53 1ij8 s GLU 46 Cb -0.06 -2.70 0.01 0.00 0.10 0.00 0.00 34.13 31.48 1ij8 s GLU 46 CO -0.00 0.67 -0.01 -1.12 0.02 0.00 0.00 175.26 174.82 1ij8 s SER 47 N -0.80 0.20 0.58 -0.19 0.01 -0.65 -4.65 113.70 108.20 1ij8 s SER 47 Ca 0.12 -0.02 -0.16 0.00 1.31 0.00 0.00 55.95 57.20 1ij8 s SER 47 Cb -0.11 -0.05 -0.04 0.00 0.21 0.00 0.00 66.02 66.02 1ij8 s SER 47 CO 0.02 -0.02 1.05 -2.16 0.41 0.00 0.00 173.24 172.54 1ij8 s PRO 48 N 0.24 3.42 0.04 12.44 0.04 -1.26 0.27 135.00 150.19 1ij8 s PRO 48 Ca -0.02 1.20 0.03 0.00 0.04 0.00 0.00 61.00 62.25 1ij8 s PRO 48 Cb -0.04 -2.05 -0.02 0.00 0.04 0.00 0.00 34.50 32.43 1ij8 s PRO 48 CO -0.01 -0.73 -0.10 -0.48 0.04 0.00 0.00 177.00 175.73 1ij8 s LEU 49 N -4.36 2.23 -0.02 -3.56 -0.00 -0.43 -2.40 118.68 110.14 1ij8 s LEU 49 Ca 0.64 -0.51 0.01 0.00 -0.00 0.00 0.00 54.13 54.26 1ij8 s LEU 49 Cb -0.16 -0.29 0.01 0.00 -0.00 0.00 0.00 46.19 45.76 1ij8 s LEU 49 CO 0.35 -0.13 -0.03 -1.00 -0.00 0.00 0.00 176.35 175.54 1ij8 s HIS 50 N -1.19 0.41 0.16 3.48 3.76 -0.96 -1.70 115.29 119.25 1ij8 s HIS 50 Ca -0.06 -0.07 -0.06 0.00 -0.15 0.00 0.00 55.06 54.72 1ij8 s HIS 50 Cb -0.09 -0.36 0.02 0.00 1.11 0.00 0.00 32.58 33.26 1ij8 s HIS 50 CO 0.01 -0.08 0.33 0.41 -0.85 0.00 0.00 174.74 174.56 1ij8 n GLY 51 N 3.53 1.56 3.05 -2.22 0.00 -0.66 -1.09 105.19 109.36 1ij8 n GLY 51 Ca -0.20 -1.11 -0.11 0.00 0.00 0.00 0.00 46.02 44.61 1ij8 n GLY 51 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1ij8 s THR 52 N -2.62 0.07 -0.06 2.61 -4.23 -0.59 -1.33 115.64 109.50 1ij8 s THR 52 Ca 0.07 -0.58 -0.02 0.00 -1.18 0.00 0.00 61.69 59.98 1ij8 s THR 52 Cb -0.02 -0.33 -0.04 0.00 1.34 0.00 0.00 72.50 73.46 1ij8 s THR 52 CO 0.05 -0.32 0.05 -0.70 -0.54 0.00 0.00 174.62 173.16 1ij8 s GLU 53 N -1.06 3.06 0.03 3.99 2.12 0.11 -1.97 118.70 124.98 1ij8 s GLU 53 Ca -0.12 -0.41 -0.29 0.00 0.36 0.00 0.00 54.97 54.51 1ij8 s GLU 53 Cb -0.07 -2.86 -0.04 0.00 0.26 0.00 0.00 34.13 31.42 1ij8 s GLU 53 CO 0.01 0.69 0.94 1.21 -0.54 0.00 0.00 175.26 177.57 1ij8 s ASN 54 N -1.23 7.37 0.00 -1.70 3.84 -0.19 -4.60 114.94 118.43 1ij8 s ASN 54 Ca 0.17 1.65 0.10 0.00 0.21 0.00 0.00 52.86 54.99 1ij8 s ASN 54 Cb -0.12 -2.56 0.27 0.00 -0.55 0.00 0.00 41.25 38.30 1ij8 s ASN 54 CO 0.07 -0.18 1.21 0.35 -2.79 0.00 0.00 177.10 175.76 1ij8 n THR 55 N 3.52 0.91 -1.94 -5.21 -2.24 -1.26 -4.54 114.28 103.52 1ij8 n THR 55 Ca 0.04 -0.95 -0.42 0.00 -2.27 0.00 0.00 64.05 60.44 1ij8 n THR 55 Cb 0.50 0.57 -0.03 0.00 -2.10 0.00 0.00 70.33 69.27 1ij8 n THR 55 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1ij8 s ILE 56 N -0.99 3.34 -0.26 2.28 -1.09 -1.26 -1.69 121.20 121.53 1ij8 s ILE 56 Ca 0.21 0.55 0.00 0.00 -2.23 0.00 0.00 60.65 59.19 1ij8 s ILE 56 Cb 0.11 -3.36 0.00 0.00 -1.58 0.00 0.00 42.46 37.64 1ij8 s ILE 56 CO 0.15 -0.03 0.00 0.59 -1.23 0.00 0.00 174.94 174.42 1ij8 n ASN 57 N 6.68 -3.96 -4.15 3.58 3.02 -1.26 -4.00 115.26 115.16 1ij8 n ASN 57 Ca 0.17 0.06 -0.29 0.00 -0.03 0.00 0.00 54.58 54.49 1ij8 n ASN 57 Cb 0.42 -1.68 -0.09 0.00 -0.61 0.00 0.00 39.78 37.82 1ij8 n ASN 57 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1ij8 n LYS 58 N -2.04 -0.92 -1.75 3.52 4.76 -0.68 -4.84 118.16 116.19 1ij8 n LYS 58 Ca -0.02 0.09 -0.37 0.00 -2.87 0.00 0.00 58.31 55.13 1ij8 n LYS 58 Cb 0.19 -3.33 0.06 0.00 -1.84 0.00 0.00 35.03 30.11 1ij8 n LYS 58 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1ij8 s ARG 59 N -6.91 2.69 0.19 1.97 1.81 -1.26 -4.90 118.95 112.56 1ij8 s ARG 59 Ca 0.08 2.11 0.25 0.00 -1.72 0.00 0.00 55.73 56.45 1ij8 s ARG 59 Cb -0.05 -1.94 0.65 0.00 -0.45 0.00 0.00 34.95 33.16 1ij8 s ARG 59 CO 0.90 -1.50 1.64 1.79 -0.68 0.00 0.00 175.30 177.45 1ij8 h THR 60 N 0.76 0.00 -2.37 0.02 1.35 -1.95 -3.34 112.91 107.38 1ij8 h THR 60 Ca -0.51 -0.51 -0.59 0.00 -0.55 0.00 0.00 66.41 64.25 1ij8 h THR 60 Cb 1.33 1.39 -0.41 0.00 -1.73 0.00 0.00 68.15 68.73 1ij8 h THR 60 CO 0.54 0.00 -0.76 0.00 -0.25 0.00 0.00 175.52 175.05 1ij8 n GLN 61 N -2.26 1.63 -1.81 4.72 6.02 -1.26 -1.38 117.38 123.03 1ij8 n GLN 61 Ca 0.05 -4.09 -0.32 0.00 -0.01 0.00 0.00 57.00 52.63 1ij8 n GLN 61 Cb 0.44 -1.93 0.03 0.00 1.02 0.00 0.00 30.24 29.79 1ij8 n GLN 61 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1ij8 s PRO 62 N -1.61 3.15 0.44 -1.09 0.04 -1.26 -4.65 135.00 130.02 1ij8 s PRO 62 Ca 0.35 1.06 -0.02 0.00 0.04 0.00 0.00 61.00 62.42 1ij8 s PRO 62 Cb 0.10 -2.02 -0.02 0.00 0.04 0.00 0.00 34.50 32.60 1ij8 s PRO 62 CO -0.10 -0.93 0.69 0.95 0.04 0.00 0.00 177.00 177.65 1ij8 s THR 63 N -2.78 4.62 0.30 1.26 -4.23 -1.26 -2.08 115.64 111.47 1ij8 s THR 63 Ca 0.60 -0.21 -0.19 0.00 -1.18 0.00 0.00 61.69 60.71 1ij8 s THR 63 Cb -0.15 -3.73 0.02 0.00 1.34 0.00 0.00 72.50 69.99 1ij8 s THR 63 CO 0.46 -0.59 0.71 0.72 -0.54 0.00 0.00 174.62 175.39 1ij8 s PHE 64 N -2.58 -0.08 -0.07 3.99 -0.12 -0.57 -1.02 117.98 117.53 1ij8 s PHE 64 Ca 0.46 -0.41 -0.25 0.00 -0.05 0.00 0.00 56.93 56.68 1ij8 s PHE 64 Cb -0.10 0.69 0.06 0.00 -0.63 0.00 0.00 43.02 43.03 1ij8 s PHE 64 CO 0.40 -1.28 0.57 0.20 -0.05 0.00 0.00 175.22 175.05 1ij8 s GLY 65 N -2.96 -0.44 0.11 1.99 0.00 -0.83 -1.96 107.32 103.22 1ij8 s GLY 65 Ca 0.13 1.11 -0.15 0.00 0.00 0.00 0.00 44.72 45.80 1ij8 s GLY 65 CO 0.08 0.81 0.37 -0.11 0.00 0.00 0.00 173.10 174.25 1ij8 s PHE 66 N -0.98 -0.16 -0.08 1.90 -0.71 0.08 -1.54 117.98 116.50 1ij8 s PHE 66 Ca -0.10 -0.13 0.03 0.00 -1.04 0.00 0.00 56.93 55.69 1ij8 s PHE 66 Cb -0.02 0.20 -0.02 0.00 -1.21 0.00 0.00 43.02 41.97 1ij8 s PHE 66 CO 0.07 -0.65 -0.16 0.99 -1.34 0.00 0.00 175.22 174.13 1ij8 s THR 67 N -3.58 2.87 -0.24 -4.49 2.01 -0.25 -0.60 115.64 111.37 1ij8 s THR 67 Ca 0.02 -0.77 -0.06 0.00 0.31 0.00 0.00 61.69 61.19 1ij8 s THR 67 Cb 0.02 -2.14 -0.02 0.00 0.01 0.00 0.00 72.50 70.36 1ij8 s THR 67 CO -0.10 0.56 0.04 -0.69 -0.69 0.00 0.00 174.62 173.74 1ij8 s VAL 68 N -0.25 4.11 -1.02 3.82 1.01 0.10 -2.27 120.40 125.90 1ij8 s VAL 68 Ca 0.01 -0.24 -0.14 0.00 0.00 0.00 0.00 61.98 61.61 1ij8 s VAL 68 Cb -0.13 -2.91 0.21 0.00 0.00 0.00 0.00 36.38 33.55 1ij8 s VAL 68 CO 0.03 0.36 1.09 0.21 0.00 0.00 0.00 175.10 176.79 1ij8 s ASN 69 N 1.52 6.97 0.05 3.32 3.04 -1.01 -2.59 114.94 126.24 1ij8 s ASN 69 Ca 0.06 -2.89 -0.35 0.00 0.04 0.00 0.00 52.86 49.71 1ij8 s ASN 69 Cb -0.15 -2.29 -0.14 0.00 -1.54 0.00 0.00 41.25 37.13 1ij8 s ASN 69 CO 0.02 -0.63 1.59 0.79 -3.04 0.00 0.00 177.10 175.83 1ij8 n TRP 70 N 4.50 2.06 1.29 0.43 7.02 -1.25 -4.28 117.44 127.20 1ij8 n TRP 70 Ca 0.24 0.34 0.13 0.00 -1.02 0.00 0.00 57.50 57.19 1ij8 n TRP 70 Cb 0.44 -2.50 0.38 0.00 -2.42 0.00 0.00 31.31 27.22 1ij8 n TRP 70 CO 0.00 0.00 0.00 1.63 -2.02 0.00 0.00 177.69 177.30 1ij8 n LYS 71 N 3.97 1.89 -0.01 -0.99 4.01 -1.26 -4.08 118.16 121.68 1ij8 n LYS 71 Ca 0.19 -1.29 0.01 0.00 -0.51 0.00 0.00 58.31 56.71 1ij8 n LYS 71 Cb 0.25 -1.47 0.01 0.00 -0.51 0.00 0.00 35.03 33.31 1ij8 n LYS 71 CO 0.00 0.00 0.00 1.97 -1.11 0.00 0.00 177.40 178.26 1ij8 n PHE 72 N 0.56 0.00 -3.88 2.13 1.16 -1.26 -5.06 117.46 111.11 1ij8 n PHE 72 Ca 0.17 -0.48 -0.08 0.00 -1.87 0.00 0.00 57.45 55.19 1ij8 n PHE 72 Cb 0.43 -0.05 -0.01 0.00 -1.61 0.00 0.00 39.48 38.23 1ij8 n PHE 72 CO 0.00 0.00 0.00 -1.54 -1.87 0.00 0.00 176.76 173.35 1ij8 s SER 73 N -1.06 -0.09 0.00 5.98 1.04 -1.26 -5.03 113.70 113.28 1ij8 s SER 73 Ca 0.03 -0.86 0.23 0.00 0.48 0.00 0.00 55.95 55.83 1ij8 s SER 73 Cb 0.03 0.74 0.77 0.00 0.10 0.00 0.00 66.02 67.65 1ij8 s SER 73 CO 0.00 -1.41 1.57 -0.62 0.98 0.00 0.00 173.24 173.77 1ij8 n GLU 74 N -0.47 1.83 -2.07 4.02 1.02 -1.26 -4.76 120.64 118.94 1ij8 n GLU 74 Ca -0.04 -1.23 -0.29 0.00 -0.02 0.00 0.00 57.16 55.58 1ij8 n GLU 74 Cb 0.60 -1.43 0.03 0.00 -0.02 0.00 0.00 31.44 30.62 1ij8 n GLU 74 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1ij8 s SER 75 N -1.71 5.69 0.01 1.62 0.01 -1.26 -4.47 113.70 113.59 1ij8 s SER 75 Ca 0.34 1.06 0.01 0.00 1.31 0.00 0.00 55.95 58.68 1ij8 s SER 75 Cb 0.19 -1.99 -0.01 0.00 0.21 0.00 0.00 66.02 64.42 1ij8 s SER 75 CO 0.29 -1.12 -0.05 -0.89 0.41 0.00 0.00 173.24 171.88 1ij8 s THR 76 N -3.18 0.34 -0.03 1.44 2.01 -0.71 -3.88 115.64 111.64 1ij8 s THR 76 Ca 0.56 -0.45 0.04 0.00 0.31 0.00 0.00 61.69 62.15 1ij8 s THR 76 Cb -0.11 -0.34 -0.00 0.00 0.01 0.00 0.00 72.50 72.05 1ij8 s THR 76 CO 0.50 -0.07 -0.14 -0.89 -0.69 0.00 0.00 174.62 173.32 1ij8 s THR 77 N -0.51 1.18 -0.03 -0.82 2.01 -1.07 -0.14 115.64 116.25 1ij8 s THR 77 Ca -0.03 -0.60 0.07 0.00 0.31 0.00 0.00 61.69 61.45 1ij8 s THR 77 Cb -0.04 -1.01 -0.02 0.00 0.01 0.00 0.00 72.50 71.44 1ij8 s THR 77 CO -0.00 0.34 -0.25 0.68 -0.69 0.00 0.00 174.62 174.71 1ij8 s VAL 78 N -0.05 1.97 0.02 3.82 -7.23 -0.60 0.01 120.40 118.34 1ij8 s VAL 78 Ca -0.00 -1.05 0.09 0.00 -1.81 0.00 0.00 61.98 59.20 1ij8 s VAL 78 Cb -0.09 -1.65 -0.02 0.00 0.56 0.00 0.00 36.38 35.18 1ij8 s VAL 78 CO 0.01 0.55 -0.26 -0.36 -0.31 0.00 0.00 175.10 174.73 1ij8 s PHE 79 N -0.42 2.33 0.01 2.82 0.40 0.24 -1.45 117.98 121.91 1ij8 s PHE 79 Ca 0.05 -0.42 -0.01 0.00 -0.60 0.00 0.00 56.93 55.95 1ij8 s PHE 79 Cb -0.11 -1.44 -0.01 0.00 0.51 0.00 0.00 43.02 41.96 1ij8 s PHE 79 CO 0.01 0.06 0.00 -0.08 0.70 0.00 0.00 175.22 175.91 1ij8 s THR 80 N -0.72 0.09 0.00 0.64 -1.32 -0.65 -0.74 115.64 112.94 1ij8 s THR 80 Ca 0.11 -0.71 0.00 0.00 -1.21 0.00 0.00 61.69 59.88 1ij8 s THR 80 Cb -0.10 -0.24 0.00 0.00 -1.51 0.00 0.00 72.50 70.65 1ij8 s THR 80 CO 0.01 -0.39 0.00 0.61 -2.21 0.00 0.00 174.62 172.64 1ij8 n GLY 81 N 1.86 0.68 3.00 6.08 0.00 -0.83 -1.45 105.19 114.53 1ij8 n GLY 81 Ca -0.22 -0.68 -0.16 0.00 0.00 0.00 0.00 46.02 44.97 1ij8 n GLY 81 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ij8 s GLN 82 N -0.16 0.50 -0.53 1.61 0.74 -0.97 -1.51 119.66 119.33 1ij8 s GLN 82 Ca 0.00 -0.35 -0.23 0.00 0.05 0.00 0.00 55.36 54.83 1ij8 s GLN 82 Cb 0.00 -0.44 0.04 0.00 1.10 0.00 0.00 33.01 33.72 1ij8 s GLN 82 CO 0.00 0.11 0.86 0.00 -0.55 0.00 0.00 175.29 175.72 1ij8 s PHE 84 N 3.62 2.95 -0.23 0.00 0.08 0.43 -4.23 117.98 120.61 1ij8 s PHE 84 Ca 0.27 -0.31 0.01 0.00 0.12 0.00 0.00 56.93 57.02 1ij8 s PHE 84 Cb -0.14 -2.01 0.06 0.00 -0.57 0.00 0.00 43.02 40.35 1ij8 s PHE 84 CO 0.18 -0.03 -0.06 0.42 -0.10 0.00 0.00 175.22 175.63 1ij8 s ILE 85 N -2.28 1.60 0.49 0.64 -1.09 -1.26 -1.10 121.20 118.19 1ij8 s ILE 85 Ca 0.46 -1.23 -0.08 0.00 -2.23 0.00 0.00 60.65 57.56 1ij8 s ILE 85 Cb -0.08 -1.83 0.12 0.00 -1.58 0.00 0.00 42.46 39.09 1ij8 s ILE 85 CO 0.30 -0.07 0.53 -0.90 -1.23 0.00 0.00 174.94 173.57 1ij8 n ASP 86 N 4.65 -0.77 0.29 3.58 3.85 -0.21 -4.87 116.55 123.08 1ij8 n ASP 86 Ca -0.12 -0.99 0.18 0.00 -0.71 0.00 0.00 54.79 53.15 1ij8 n ASP 86 Cb 0.44 -0.44 0.82 0.00 -1.35 0.00 0.00 41.12 40.58 1ij8 n ASP 86 CO 0.00 0.00 0.00 0.03 -1.01 0.00 0.00 177.20 176.22 1ij8 h ARG 87 N 0.00 0.00 0.00 0.11 3.08 -2.01 -2.43 114.38 113.14 1ij8 h ARG 87 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.87 1ij8 h ARG 87 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1ij8 h ARG 87 CO 0.13 0.02 -0.52 0.09 -1.07 0.00 0.00 179.97 178.61 1ij8 n ASN 88 N -3.14 0.61 0.00 7.04 5.03 -1.26 -4.92 115.26 118.62 1ij8 n ASN 88 Ca -0.00 0.08 0.00 0.00 0.87 0.00 0.00 54.58 55.52 1ij8 n ASN 88 Cb 0.25 0.09 0.00 0.00 -1.02 0.00 0.00 39.78 39.10 1ij8 n ASN 88 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ij8 n GLY 89 N 1.39 0.73 3.82 7.41 0.00 -0.91 -5.07 105.19 112.55 1ij8 n GLY 89 Ca 0.04 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.71 1ij8 n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ij8 s LYS 90 N -0.84 4.25 0.07 1.61 1.02 -1.26 -4.80 119.74 119.80 1ij8 s LYS 90 Ca 0.00 0.95 -0.22 0.00 0.02 0.00 0.00 55.97 56.72 1ij8 s LYS 90 Cb 0.00 -2.64 -0.07 0.00 -0.52 0.00 0.00 37.83 34.61 1ij8 s LYS 90 CO 0.00 0.24 0.65 -1.21 -0.92 0.00 0.00 175.35 174.12 1ij8 s GLU 91 N -2.44 4.36 -0.03 1.68 2.02 -1.26 -1.04 118.70 121.99 1ij8 s GLU 91 Ca 0.50 0.89 -0.02 0.00 0.02 0.00 0.00 54.97 56.36 1ij8 s GLU 91 Cb -0.14 -3.29 0.01 0.00 0.10 0.00 0.00 34.13 30.82 1ij8 s GLU 91 CO 0.19 0.51 0.07 0.54 0.02 0.00 0.00 175.26 176.60 1ij8 s VAL 92 N -0.75 -0.01 -0.31 2.63 0.11 -0.26 -4.27 120.40 117.53 1ij8 s VAL 92 Ca 0.32 0.05 -0.08 0.00 -2.93 0.00 0.00 61.98 59.35 1ij8 s VAL 92 Cb -0.20 -0.12 0.01 0.00 -1.53 0.00 0.00 36.38 34.53 1ij8 s VAL 92 CO 0.21 0.02 0.12 -0.76 -3.33 0.00 0.00 175.10 171.36 1ij8 s LEU 93 N 0.33 4.06 -0.34 2.54 1.43 -0.28 -0.42 118.68 126.00 1ij8 s LEU 93 Ca -0.02 -0.70 -0.15 0.00 -1.03 0.00 0.00 54.13 52.22 1ij8 s LEU 93 Cb -0.04 -1.94 -0.01 0.00 0.03 0.00 0.00 46.19 44.23 1ij8 s LEU 93 CO -0.01 -0.22 0.35 -0.54 0.23 0.00 0.00 176.35 176.16 1ij8 s LYS 94 N 1.54 3.58 0.19 1.70 -0.14 -1.07 -0.91 119.74 124.64 1ij8 s LYS 94 Ca 0.03 -0.41 0.04 0.00 -1.36 0.00 0.00 55.97 54.28 1ij8 s LYS 94 Cb -0.17 -3.80 -0.05 0.00 -1.68 0.00 0.00 37.83 32.13 1ij8 s LYS 94 CO 0.04 -0.51 -0.07 0.95 -0.76 0.00 0.00 175.35 175.01 1ij8 s THR 95 N 2.00 1.18 0.04 2.17 -4.23 -0.19 -2.29 115.64 114.32 1ij8 s THR 95 Ca 0.12 -2.07 0.04 0.00 -1.18 0.00 0.00 61.69 58.60 1ij8 s THR 95 Cb -0.17 -2.08 -0.02 0.00 1.34 0.00 0.00 72.50 71.58 1ij8 s THR 95 CO 0.12 -0.56 -0.12 -0.04 -0.54 0.00 0.00 174.62 173.48 1ij8 s MET 96 N -3.78 0.75 0.08 3.99 -1.94 -0.53 -1.86 119.30 116.01 1ij8 s MET 96 Ca 0.22 -0.74 0.01 0.00 -1.71 0.00 0.00 55.69 53.47 1ij8 s MET 96 Cb 0.03 -0.70 -0.04 0.00 2.01 0.00 0.00 34.83 36.13 1ij8 s MET 96 CO 0.05 0.16 -0.06 1.67 -0.01 0.00 0.00 175.02 176.83 1ij8 s TRP 97 N -1.00 0.79 -0.09 -0.03 1.48 -0.21 -1.63 118.94 118.24 1ij8 s TRP 97 Ca -0.02 -0.93 0.04 0.00 -1.06 0.00 0.00 56.10 54.13 1ij8 s TRP 97 Cb -0.08 -0.48 0.00 0.00 -1.16 0.00 0.00 33.47 31.75 1ij8 s TRP 97 CO 0.01 -0.20 -0.22 -0.51 -4.06 0.00 0.00 176.95 171.97 1ij8 s LEU 98 N -2.92 2.02 -0.30 -4.66 1.43 -0.53 -2.18 118.68 111.54 1ij8 s LEU 98 Ca 0.09 -0.52 -0.05 0.00 -1.03 0.00 0.00 54.13 52.63 1ij8 s LEU 98 Cb 0.05 -1.31 0.02 0.00 0.03 0.00 0.00 46.19 44.98 1ij8 s LEU 98 CO -0.06 0.14 0.05 -0.22 0.23 0.00 0.00 176.35 176.49 1ij8 s LEU 99 N 0.38 3.82 -0.27 1.79 2.96 0.15 -1.55 118.68 125.96 1ij8 s LEU 99 Ca -0.18 -0.91 -0.13 0.00 -0.22 0.00 0.00 54.13 52.69 1ij8 s LEU 99 Cb -0.18 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.66 1ij8 s LEU 99 CO 0.08 -0.22 0.28 -0.60 -1.32 0.00 0.00 176.35 174.57 1ij8 s ARG 100 N 1.41 3.99 0.36 1.98 6.06 0.80 -1.33 118.95 132.22 1ij8 s ARG 100 Ca 0.00 -0.14 -0.02 0.00 -2.50 0.00 0.00 55.73 53.08 1ij8 s ARG 100 Cb -0.18 -3.65 -0.04 0.00 0.06 0.00 0.00 34.95 31.14 1ij8 s ARG 100 CO 0.01 -0.21 0.60 -1.12 -2.50 0.00 0.00 175.30 172.08 1ij8 s SER 101 N 1.65 6.32 -0.14 -2.12 0.01 0.14 -1.73 113.70 117.84 1ij8 s SER 101 Ca 0.11 0.61 -0.17 0.00 1.31 0.00 0.00 55.95 57.81 1ij8 s SER 101 Cb -0.16 -2.10 -0.04 0.00 0.21 0.00 0.00 66.02 63.93 1ij8 s SER 101 CO 0.10 -0.33 0.42 -0.55 0.41 0.00 0.00 173.24 173.29 1ij8 s SER 102 N -3.87 6.59 0.18 2.44 0.15 -1.26 -4.88 113.70 113.05 1ij8 s SER 102 Ca 0.42 0.70 0.09 0.00 0.70 0.00 0.00 55.95 57.86 1ij8 s SER 102 Cb -0.10 -2.25 -0.04 0.00 -1.71 0.00 0.00 66.02 61.92 1ij8 s SER 102 CO 0.37 0.01 -0.10 0.68 1.20 0.00 0.00 173.24 175.40 1ij8 s VAL 103 N 0.68 3.16 -0.73 4.45 -7.23 -1.26 -5.04 120.40 114.43 1ij8 s VAL 103 Ca 0.23 -1.68 0.25 0.00 -1.81 0.00 0.00 61.98 58.97 1ij8 s VAL 103 Cb -0.14 -2.56 0.09 0.00 0.56 0.00 0.00 36.38 34.32 1ij8 s VAL 103 CO 0.08 -0.12 1.45 0.59 -0.31 0.00 0.00 175.10 176.80 1ij8 n ASN 104 N 0.03 0.64 -3.94 4.85 3.02 -1.26 -4.87 115.26 113.74 1ij8 n ASN 104 Ca -0.11 0.17 -0.16 0.00 -0.03 0.00 0.00 54.58 54.45 1ij8 n ASN 104 Cb 0.56 -0.03 -0.15 0.00 -0.61 0.00 0.00 39.78 39.55 1ij8 n ASN 104 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1ij8 s ASP 105 N -4.01 0.62 0.65 6.41 -1.08 -1.26 -5.02 116.67 112.99 1ij8 s ASP 105 Ca 0.08 -0.09 0.38 0.00 -0.52 0.00 0.00 52.55 52.40 1ij8 s ASP 105 Cb 0.14 -0.11 2.09 0.00 -1.46 0.00 0.00 42.92 43.58 1ij8 s ASP 105 CO 0.68 0.04 2.22 -0.29 0.52 0.00 0.00 175.17 178.35 1ij8 h ILE 106 N 5.20 0.11 0.00 4.11 2.10 -2.02 -0.09 117.51 126.92 1ij8 h ILE 106 Ca -0.30 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.64 1ij8 h ILE 106 Cb 1.18 0.90 0.00 0.00 -1.09 0.00 0.00 36.82 37.81 1ij8 h ILE 106 CO 0.50 0.00 0.00 1.23 -1.08 0.00 0.00 178.15 178.80 1ij8 h GLY 107 N 0.00 0.00 -2.09 8.18 0.00 -2.00 -2.69 103.07 104.48 1ij8 h GLY 107 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1ij8 h GLY 107 CO -0.00 0.00 0.00 1.22 0.00 0.00 0.00 176.54 177.76 1ij8 n ASP 108 N -2.92 3.19 -0.32 0.19 8.00 -0.05 -4.53 116.55 120.12 1ij8 n ASP 108 Ca 0.01 -1.96 0.12 0.00 0.71 0.00 0.00 54.79 53.67 1ij8 n ASP 108 Cb 0.28 -0.21 0.34 0.00 -0.02 0.00 0.00 41.12 41.52 1ij8 n ASP 108 CO 0.00 0.00 0.00 -0.78 -0.39 0.00 0.00 177.20 176.03 1ij8 h ASP 109 N 4.22 0.74 -0.66 -2.24 3.58 -1.55 -2.69 116.42 117.82 1ij8 h ASP 109 Ca 0.00 0.06 0.19 0.00 0.42 0.00 0.00 57.03 57.70 1ij8 h ASP 109 Cb 0.93 -0.08 -0.03 0.00 1.72 0.00 0.00 39.33 41.87 1ij8 h ASP 109 CO 0.00 0.34 0.50 4.11 -2.88 0.00 0.00 179.24 181.31 1ij8 h TRP 110 N 0.76 0.00 -0.44 0.28 5.08 -1.83 -2.26 115.95 117.54 1ij8 h TRP 110 Ca 0.51 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.48 1ij8 h TRP 110 Cb 0.78 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.94 1ij8 h TRP 110 CO -0.00 0.00 0.00 0.36 -1.28 0.00 0.00 178.44 177.52 1ij8 n LYS 111 N -4.21 3.34 0.00 0.12 2.85 -1.01 -4.59 118.16 114.66 1ij8 n LYS 111 Ca 0.13 -2.69 0.14 0.00 -1.05 0.00 0.00 58.31 54.84 1ij8 n LYS 111 Cb 0.76 -1.75 0.49 0.00 -0.65 0.00 0.00 35.03 33.88 1ij8 n LYS 111 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1ij8 n ALA 112 N 0.38 2.71 -3.90 0.58 0.00 -0.85 -4.87 120.51 114.56 1ij8 n ALA 112 Ca 0.21 -0.43 -0.31 0.00 0.00 0.00 0.00 53.44 52.91 1ij8 n ALA 112 Cb 0.80 -1.16 -0.16 0.00 0.00 0.00 0.00 19.45 18.93 1ij8 n ALA 112 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1ij8 s THR 113 N -2.14 1.79 0.17 0.00 2.01 -1.26 -0.68 115.64 115.53 1ij8 s THR 113 Ca 0.34 -0.79 0.05 0.00 0.31 0.00 0.00 61.69 61.60 1ij8 s THR 113 Cb 0.20 -1.63 -0.04 0.00 0.01 0.00 0.00 72.50 71.05 1ij8 s THR 113 CO 0.39 0.50 0.16 -0.13 -0.69 0.00 0.00 174.62 174.84 1ij8 s ARG 114 N 1.20 2.96 0.05 4.92 0.52 -0.44 -4.94 118.95 123.22 1ij8 s ARG 114 Ca 0.00 -0.87 0.04 0.00 -0.52 0.00 0.00 55.73 54.38 1ij8 s ARG 114 Cb -0.14 -2.67 -0.03 0.00 0.52 0.00 0.00 34.95 32.64 1ij8 s ARG 114 CO -0.08 0.48 -0.11 0.54 0.02 0.00 0.00 175.30 176.15 1ij8 s VAL 115 N -1.80 0.80 0.04 3.52 0.11 -1.26 -0.67 120.40 121.14 1ij8 s VAL 115 Ca 0.32 -1.18 -0.08 0.00 -2.93 0.00 0.00 61.98 58.11 1ij8 s VAL 115 Cb -0.10 -0.82 0.03 0.00 -1.53 0.00 0.00 36.38 33.96 1ij8 s VAL 115 CO 0.24 -0.31 0.38 0.61 -3.33 0.00 0.00 175.10 172.69 1ij8 n GLY 116 N 1.39 0.91 3.43 6.54 0.00 -0.93 -5.00 105.19 111.53 1ij8 n GLY 116 Ca -0.22 -0.97 -0.21 0.00 0.00 0.00 0.00 46.02 44.62 1ij8 n GLY 116 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1ij8 s ILE 117 N -2.32 1.39 -0.26 -0.61 -4.36 -1.26 -1.04 121.20 112.74 1ij8 s ILE 117 Ca 0.09 -2.05 -0.18 0.00 -0.26 0.00 0.00 60.65 58.24 1ij8 s ILE 117 Cb -0.01 -2.59 0.07 0.00 1.25 0.00 0.00 42.46 41.18 1ij8 s ILE 117 CO 0.01 -0.18 0.65 0.20 0.24 0.00 0.00 174.94 175.86 1ij8 s ASN 118 N -3.45 -0.80 -0.15 4.36 0.02 -0.78 -4.93 114.94 109.20 1ij8 s ASN 118 Ca 0.32 1.38 -0.00 0.00 -1.02 0.00 0.00 52.86 53.54 1ij8 s ASN 118 Cb 0.06 1.30 -0.00 0.00 0.02 0.00 0.00 41.25 42.63 1ij8 s ASN 118 CO 0.13 -0.23 -0.14 -0.63 0.02 0.00 0.00 177.10 176.25 1ij8 s ILE 119 N 1.15 2.79 -0.05 0.60 1.01 -1.26 -1.02 121.20 124.41 1ij8 s ILE 119 Ca -0.06 -0.73 0.01 0.00 0.00 0.00 0.00 60.65 59.87 1ij8 s ILE 119 Cb -0.05 -2.18 -0.03 0.00 0.01 0.00 0.00 42.46 40.20 1ij8 s ILE 119 CO -0.12 0.51 -0.06 -0.36 0.00 0.00 0.00 174.94 174.91 1ij8 s PHE 120 N 0.77 2.95 0.18 3.97 0.40 -0.08 -2.86 117.98 123.30 1ij8 s PHE 120 Ca -0.06 0.03 0.07 0.00 -0.60 0.00 0.00 56.93 56.37 1ij8 s PHE 120 Cb -0.15 -1.69 -0.04 0.00 0.51 0.00 0.00 43.02 41.64 1ij8 s PHE 120 CO 0.01 0.36 -0.14 0.95 0.70 0.00 0.00 175.22 177.09 1ij8 s THR 121 N -0.86 1.61 0.29 0.64 -4.23 -0.07 -1.12 115.64 111.90 1ij8 s THR 121 Ca 0.14 -2.08 -0.29 0.00 -1.18 0.00 0.00 61.69 58.27 1ij8 s THR 121 Cb -0.11 -1.92 -0.11 0.00 1.34 0.00 0.00 72.50 71.71 1ij8 s THR 121 CO 0.03 -0.56 1.46 -0.13 -0.54 0.00 0.00 174.62 174.89 1ij8 s ARG 122 N -3.41 4.22 0.00 3.99 1.81 -1.26 -1.42 118.95 122.88 1ij8 s ARG 122 Ca 0.19 2.40 0.25 0.00 -1.72 0.00 0.00 55.73 56.85 1ij8 s ARG 122 Cb -0.02 -3.06 0.48 0.00 -0.45 0.00 0.00 34.95 31.91 1ij8 s ARG 122 CO 0.05 -0.45 1.42 -0.11 -0.68 0.00 0.00 175.30 175.53