#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ue6 n ASP 4 N 0.00 1.93 -3.32 1.61 8.00 -1.26 -4.29 116.55 119.21 1ue6 n ASP 4 Ca 0.00 -1.48 -0.10 0.00 0.71 0.00 0.00 54.79 53.92 1ue6 n ASP 4 Cb 0.00 -0.37 -0.07 0.00 -0.02 0.00 0.00 41.12 40.66 1ue6 n ASP 4 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1ue6 s THR 5 N 0.02 -0.60 -0.07 -3.53 2.01 -1.26 -5.08 115.64 107.13 1ue6 s THR 5 Ca 0.00 -0.29 0.02 0.00 0.31 0.00 0.00 61.69 61.73 1ue6 s THR 5 Cb 0.00 -0.97 0.01 0.00 0.01 0.00 0.00 72.50 71.56 1ue6 s THR 5 CO 0.00 -0.29 -0.12 0.42 -0.69 0.00 0.00 174.62 173.94 1ue6 s THR 6 N 2.52 1.16 0.08 -0.82 -4.23 -1.26 -4.10 115.64 108.98 1ue6 s THR 6 Ca 0.10 -0.48 0.05 0.00 -1.18 0.00 0.00 61.69 60.17 1ue6 s THR 6 Cb -0.13 -1.07 -0.03 0.00 1.34 0.00 0.00 72.50 72.61 1ue6 s THR 6 CO -0.29 0.36 -0.13 -0.51 -0.54 0.00 0.00 174.62 173.52 1ue6 s ILE 7 N 0.75 1.04 -0.09 2.99 2.07 -0.08 -5.01 121.20 122.86 1ue6 s ILE 7 Ca -0.13 -1.38 0.01 0.00 -1.41 0.00 0.00 60.65 57.74 1ue6 s ILE 7 Cb -0.16 -1.11 0.02 0.00 0.13 0.00 0.00 42.46 41.34 1ue6 s ILE 7 CO 0.03 -0.32 -0.10 -0.89 -1.91 0.00 0.00 174.94 171.75 1ue6 s THR 8 N -1.57 1.08 0.09 4.00 2.01 -1.26 -1.09 115.64 118.90 1ue6 s THR 8 Ca -0.01 -0.38 0.08 0.00 0.31 0.00 0.00 61.69 61.70 1ue6 s THR 8 Cb -0.08 -1.04 -0.04 0.00 0.01 0.00 0.00 72.50 71.35 1ue6 s THR 8 CO 0.02 0.36 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.50 1ue6 s ILE 9 N 1.19 2.86 -0.05 1.82 1.01 0.22 -4.94 121.20 123.32 1ue6 s ILE 9 Ca -0.05 -1.40 -0.01 0.00 0.00 0.00 0.00 60.65 59.19 1ue6 s ILE 9 Cb -0.14 -2.28 0.03 0.00 0.01 0.00 0.00 42.46 40.08 1ue6 s ILE 9 CO -0.03 0.17 0.02 -0.69 0.00 0.00 0.00 174.94 174.42 1ue6 s VAL 10 N -1.08 0.12 -0.08 2.92 1.01 -1.26 -0.23 120.40 121.79 1ue6 s VAL 10 Ca 0.17 0.23 -0.30 0.00 0.00 0.00 0.00 61.98 62.08 1ue6 s VAL 10 Cb -0.11 -0.29 0.10 0.00 0.00 0.00 0.00 36.38 36.08 1ue6 s VAL 10 CO 0.09 0.19 1.36 -0.83 0.00 0.00 0.00 175.10 175.91 1ue6 s GLY 11 N 1.73 -0.20 0.18 4.51 0.00 -1.16 -4.58 107.32 107.79 1ue6 s GLY 11 Ca 0.00 0.15 -0.01 0.00 0.00 0.00 0.00 44.72 44.86 1ue6 s GLY 11 CO -0.03 6.56 0.37 -1.31 0.00 0.00 0.00 173.10 178.69 1ue6 s ASN 12 N -3.92 6.39 0.00 1.64 0.01 0.06 -1.44 114.94 117.69 1ue6 s ASN 12 Ca 0.32 0.40 0.19 0.00 -0.71 0.00 0.00 52.86 53.06 1ue6 s ASN 12 Cb 0.00 -2.01 1.15 0.00 0.41 0.00 0.00 41.25 40.80 1ue6 s ASN 12 CO -0.03 -0.01 1.56 0.18 -1.51 0.00 0.00 177.10 177.29 1ue6 n LEU 13 N -0.50 0.00 0.00 0.60 4.77 -0.70 0.60 117.00 121.77 1ue6 n LEU 13 Ca -0.05 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.93 1ue6 n LEU 13 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 1ue6 n LEU 13 CO 0.49 0.00 0.00 0.35 -1.33 0.00 0.00 177.39 176.90 1ue6 n THR 14 N -0.96 0.00 -4.37 -5.08 -2.24 -1.25 -4.22 114.28 96.17 1ue6 n THR 14 Ca 0.14 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.74 1ue6 n THR 14 Cb 0.07 0.00 -0.10 0.00 -2.10 0.00 0.00 70.33 68.19 1ue6 n THR 14 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ue6 s ALA 15 N -0.17 2.02 0.40 6.98 0.00 -1.26 -4.15 121.76 125.58 1ue6 s ALA 15 Ca 0.00 -1.80 -0.27 0.00 0.00 0.00 0.00 51.96 49.90 1ue6 s ALA 15 Cb 0.00 0.30 -0.09 0.00 0.00 0.00 0.00 23.12 23.32 1ue6 s ALA 15 CO 0.00 -0.15 1.40 -0.51 0.00 0.00 0.00 175.76 176.51 1ue6 s ASP 16 N -3.35 6.23 0.20 0.00 1.11 -1.26 -4.16 116.67 115.43 1ue6 s ASP 16 Ca 0.28 2.88 -0.31 0.00 0.18 0.00 0.00 52.55 55.57 1ue6 s ASP 16 Cb 0.04 -2.65 -0.10 0.00 1.07 0.00 0.00 42.92 41.28 1ue6 s ASP 16 CO 0.09 -0.93 1.53 -2.16 1.18 0.00 0.00 175.17 174.88 1ue6 s PRO 17 N -2.21 4.23 -0.29 8.23 0.04 -1.26 -4.89 135.00 138.84 1ue6 s PRO 17 Ca 0.56 2.36 -0.25 0.00 0.04 0.00 0.00 61.00 63.71 1ue6 s PRO 17 Cb -0.43 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 30.98 1ue6 s PRO 17 CO 0.56 -0.55 0.84 -1.21 0.04 0.00 0.00 177.00 176.69 1ue6 s GLU 18 N 0.51 4.04 -0.24 4.56 2.02 -0.68 -4.84 118.70 124.06 1ue6 s GLU 18 Ca 0.66 0.75 -0.14 0.00 0.02 0.00 0.00 54.97 56.27 1ue6 s GLU 18 Cb -0.43 -3.71 -0.04 0.00 0.10 0.00 0.00 34.13 30.05 1ue6 s GLU 18 CO 0.36 -0.67 0.30 -1.17 0.02 0.00 0.00 175.26 174.11 1ue6 s LEU 19 N 3.03 4.09 0.11 1.80 1.98 -1.26 -1.47 118.68 126.96 1ue6 s LEU 19 Ca 0.35 0.27 0.01 0.00 -2.89 0.00 0.00 54.13 51.86 1ue6 s LEU 19 Cb -0.14 -2.33 -0.04 0.00 0.66 0.00 0.00 46.19 44.34 1ue6 s LEU 19 CO 0.11 -0.07 -0.02 -0.60 -1.89 0.00 0.00 176.35 173.88 1ue6 s ARG 20 N 1.56 0.86 0.33 1.98 6.06 0.10 -4.98 118.95 124.86 1ue6 s ARG 20 Ca 0.13 -1.37 0.10 0.00 -2.50 0.00 0.00 55.73 52.08 1ue6 s ARG 20 Cb -0.15 -0.04 -0.06 0.00 0.06 0.00 0.00 34.95 34.77 1ue6 s ARG 20 CO 0.08 -0.11 -0.07 -0.06 -2.50 0.00 0.00 175.30 172.64 1ue6 s PHE 21 N -3.78 2.45 0.13 5.12 0.40 -1.26 0.01 117.98 121.04 1ue6 s PHE 21 Ca 0.16 -0.45 0.02 0.00 -0.60 0.00 0.00 56.93 56.06 1ue6 s PHE 21 Cb 0.07 -1.37 -0.04 0.00 0.51 0.00 0.00 43.02 42.18 1ue6 s PHE 21 CO -0.03 0.57 -0.06 -0.08 0.70 0.00 0.00 175.22 176.32 1ue6 s THR 22 N -2.56 0.81 0.20 0.64 -1.32 -1.23 -4.88 115.64 107.30 1ue6 s THR 22 Ca 0.33 -1.98 0.02 0.00 -1.21 0.00 0.00 61.69 58.85 1ue6 s THR 22 Cb 0.01 -1.83 -0.08 0.00 -1.51 0.00 0.00 72.50 69.08 1ue6 s THR 22 CO 0.17 -0.74 1.48 1.55 -2.21 0.00 0.00 174.62 174.87 1ue6 h PRO 23 N 2.85 0.29 0.03 7.08 0.13 -2.01 -2.90 132.00 137.48 1ue6 h PRO 23 Ca -0.36 -0.23 -0.38 0.00 -0.87 0.00 0.00 66.00 64.16 1ue6 h PRO 23 Cb 1.18 0.05 -0.05 0.00 0.13 0.00 0.00 31.00 32.30 1ue6 h PRO 23 CO 0.64 0.87 -2.28 -1.13 -0.23 0.00 0.00 178.00 175.87 1ue6 n SER 24 N -3.82 2.01 -2.98 1.44 3.41 -1.26 -4.53 113.62 107.89 1ue6 n SER 24 Ca -0.03 0.05 -0.40 0.00 -0.26 0.00 0.00 58.87 58.23 1ue6 n SER 24 Cb 0.68 -0.62 0.04 0.00 -0.26 0.00 0.00 64.21 64.04 1ue6 n SER 24 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1ue6 n GLY 25 N 2.01 5.60 3.47 5.00 0.00 -1.25 -5.03 105.19 114.99 1ue6 n GLY 25 Ca -0.43 -2.50 -0.49 0.00 0.00 0.00 0.00 46.02 42.60 1ue6 n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ue6 n ALA 26 N -0.49 -2.25 -2.18 4.61 0.00 -1.09 -3.48 120.51 115.63 1ue6 n ALA 26 Ca 0.53 0.46 -0.01 0.00 0.00 0.00 0.00 53.44 54.42 1ue6 n ALA 26 Cb 0.25 -1.76 -0.01 0.00 0.00 0.00 0.00 19.45 17.93 1ue6 n ALA 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ue6 n ALA 27 N 0.47 -2.46 -3.69 0.00 0.00 -1.24 -4.05 120.51 109.55 1ue6 n ALA 27 Ca 0.16 0.73 -0.11 0.00 0.00 0.00 0.00 53.44 54.22 1ue6 n ALA 27 Cb 0.24 -1.77 -0.12 0.00 0.00 0.00 0.00 19.45 17.80 1ue6 n ALA 27 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ue6 s VAL 28 N -0.51 -0.26 -0.09 0.00 1.01 0.10 -1.93 120.40 118.72 1ue6 s VAL 28 Ca -0.05 0.17 0.00 0.00 0.00 0.00 0.00 61.98 62.10 1ue6 s VAL 28 Cb 0.00 -0.53 -0.03 0.00 0.00 0.00 0.00 36.38 35.83 1ue6 s VAL 28 CO 0.13 0.07 -0.08 0.00 0.00 0.00 0.00 175.10 175.21 1ue6 s ALA 29 N 1.88 2.88 -0.01 5.51 0.00 -0.65 -0.73 121.76 130.65 1ue6 s ALA 29 Ca -0.05 -0.89 0.08 0.00 0.00 0.00 0.00 51.96 51.10 1ue6 s ALA 29 Cb -0.10 -1.26 -0.02 0.00 0.00 0.00 0.00 23.12 21.74 1ue6 s ALA 29 CO -0.11 0.44 -0.25 -0.80 0.00 0.00 0.00 175.76 175.04 1ue6 s ASN 30 N -0.37 2.97 0.10 0.00 0.01 -0.54 -2.43 114.94 114.69 1ue6 s ASN 30 Ca 0.05 -0.48 -0.25 0.00 -0.71 0.00 0.00 52.86 51.46 1ue6 s ASN 30 Cb -0.12 -0.32 0.08 0.00 0.41 0.00 0.00 41.25 41.30 1ue6 s ASN 30 CO 0.02 0.29 0.79 0.72 -1.51 0.00 0.00 177.10 177.42 1ue6 s PHE 31 N -0.64 -0.35 -0.05 2.20 -0.71 -1.14 -1.69 117.98 115.61 1ue6 s PHE 31 Ca 0.10 0.13 0.06 0.00 -1.04 0.00 0.00 56.93 56.18 1ue6 s PHE 31 Cb -0.10 0.58 -0.01 0.00 -1.21 0.00 0.00 43.02 42.28 1ue6 s PHE 31 CO -0.00 -0.76 -0.24 0.95 -1.34 0.00 0.00 175.22 173.83 1ue6 s THR 32 N -3.43 2.21 -0.18 -4.49 -4.23 -1.26 0.13 115.64 104.39 1ue6 s THR 32 Ca 0.06 -1.02 -0.08 0.00 -1.18 0.00 0.00 61.69 59.47 1ue6 s THR 32 Cb -0.02 -1.80 -0.04 0.00 1.34 0.00 0.00 72.50 71.98 1ue6 s THR 32 CO -0.07 0.57 0.07 -0.69 -0.54 0.00 0.00 174.62 173.97 1ue6 s VAL 33 N -0.32 4.87 -0.26 2.29 1.01 0.85 -3.77 120.40 125.08 1ue6 s VAL 33 Ca 0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 61.98 61.92 1ue6 s VAL 33 Cb -0.13 -3.20 -0.01 0.00 0.00 0.00 0.00 36.38 33.05 1ue6 s VAL 33 CO 0.02 0.46 0.05 0.00 0.00 0.00 0.00 175.10 175.63 1ue6 s ALA 34 N 0.33 3.06 -0.06 5.51 0.00 0.20 -1.59 121.76 129.21 1ue6 s ALA 34 Ca 0.04 -1.24 -0.00 0.00 0.00 0.00 0.00 51.96 50.76 1ue6 s ALA 34 Cb -0.12 -2.02 0.02 0.00 0.00 0.00 0.00 23.12 21.00 1ue6 s ALA 34 CO -0.00 -0.61 -0.03 -1.54 0.00 0.00 0.00 175.76 173.58 1ue6 s SER 35 N 1.55 1.33 0.31 0.00 1.04 -1.00 -0.76 113.70 116.17 1ue6 s SER 35 Ca 0.05 -0.12 -0.04 0.00 0.48 0.00 0.00 55.95 56.32 1ue6 s SER 35 Cb -0.16 -0.48 -0.05 0.00 0.10 0.00 0.00 66.02 65.44 1ue6 s SER 35 CO 0.02 -0.12 0.56 0.42 0.98 0.00 0.00 173.24 175.10 1ue6 s THR 36 N 1.44 5.04 0.00 2.02 -4.23 -1.26 -1.98 115.64 116.67 1ue6 s THR 36 Ca -0.03 -0.03 0.00 0.00 -1.18 0.00 0.00 61.69 60.45 1ue6 s THR 36 Cb -0.13 -3.76 0.00 0.00 1.34 0.00 0.00 72.50 69.95 1ue6 s THR 36 CO -0.03 -0.39 0.00 -0.81 -0.54 0.00 0.00 174.62 172.85 1ue6 n PRO 37 N -1.14 2.76 -0.07 3.99 -0.04 -1.26 -4.91 135.00 134.33 1ue6 n PRO 37 Ca -0.02 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.35 1ue6 n PRO 37 Cb 0.54 0.00 -0.06 0.00 -0.04 0.00 0.00 33.50 33.95 1ue6 n PRO 37 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ue6 h ARG 38 N 0.00 0.00 -4.83 0.54 3.08 -2.04 -3.45 114.38 107.68 1ue6 h ARG 38 Ca 0.00 0.00 -0.66 0.00 0.07 0.00 0.00 59.98 59.39 1ue6 h ARG 38 Cb 0.00 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 29.84 1ue6 h ARG 38 CO 0.00 0.43 -0.56 0.96 -1.07 0.00 0.00 179.97 179.73 1ue6 s ILE 39 N -2.03 4.71 -0.50 2.04 -4.36 -1.26 -5.14 121.20 114.66 1ue6 s ILE 39 Ca -0.14 -0.25 -0.26 0.00 -0.26 0.00 0.00 60.65 59.74 1ue6 s ILE 39 Cb 0.01 -3.33 -0.05 0.00 1.25 0.00 0.00 42.46 40.34 1ue6 s ILE 39 CO 0.33 0.15 2.18 -0.72 0.24 0.00 0.00 174.94 177.12 1ue6 s TYR 40 N 1.65 1.31 -0.95 1.37 -0.85 -1.26 -5.07 117.35 113.55 1ue6 s TYR 40 Ca 0.05 1.19 0.08 0.00 -0.52 0.00 0.00 57.07 57.87 1ue6 s TYR 40 Cb -0.16 -3.80 0.10 0.00 0.38 0.00 0.00 41.96 38.47 1ue6 s TYR 40 CO 0.07 -2.61 0.84 -0.85 -1.52 0.00 0.00 175.55 171.48 1ue6 n GLU 51 N 9.01 0.67 -1.67 -3.49 -0.00 -1.26 -5.07 120.64 118.83 1ue6 n GLU 51 Ca 0.30 -1.16 0.00 0.00 -0.00 0.00 0.00 57.16 56.30 1ue6 n GLU 51 Cb 0.53 -1.16 0.00 0.00 -0.00 0.00 0.00 31.44 30.80 1ue6 n GLU 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ue6 n ALA 52 N 0.41 -1.81 -2.81 -1.84 0.00 -1.26 -4.95 120.51 108.25 1ue6 n ALA 52 Ca 0.05 0.41 -0.14 0.00 0.00 0.00 0.00 53.44 53.76 1ue6 n ALA 52 Cb 0.24 -1.31 -0.14 0.00 0.00 0.00 0.00 19.45 18.23 1ue6 n ALA 52 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1ue6 s LEU 53 N -3.08 2.03 -0.19 0.00 0.20 -0.84 -4.92 118.68 111.89 1ue6 s LEU 53 Ca 0.00 -0.11 0.01 0.00 0.69 0.00 0.00 54.13 54.72 1ue6 s LEU 53 Cb 0.00 -0.16 0.03 0.00 -0.43 0.00 0.00 46.19 45.63 1ue6 s LEU 53 CO 0.00 0.01 -0.13 -0.36 -0.29 0.00 0.00 176.35 175.58 1ue6 s PHE 54 N -0.23 2.49 -0.20 5.38 0.40 -1.26 -2.37 117.98 122.18 1ue6 s PHE 54 Ca -0.00 -1.56 0.01 0.00 -0.60 0.00 0.00 56.93 54.78 1ue6 s PHE 54 Cb -0.02 -1.70 0.03 0.00 0.51 0.00 0.00 43.02 41.83 1ue6 s PHE 54 CO -0.00 -0.75 -0.17 -0.51 0.70 0.00 0.00 175.22 174.49 1ue6 s LEU 55 N 1.38 2.50 0.19 -0.37 1.43 -0.62 -4.96 118.68 118.22 1ue6 s LEU 55 Ca 0.01 -0.83 -0.30 0.00 -1.03 0.00 0.00 54.13 51.98 1ue6 s LEU 55 Cb -0.15 -1.51 -0.08 0.00 0.03 0.00 0.00 46.19 44.48 1ue6 s LEU 55 CO -0.10 -0.05 0.98 0.00 0.23 0.00 0.00 176.35 177.41 1ue6 s ARG 56 N 1.25 4.75 0.18 1.70 1.04 -1.26 -0.10 118.95 126.51 1ue6 s ARG 56 Ca 0.02 1.53 0.10 0.00 -1.04 0.00 0.00 55.73 56.33 1ue6 s ARG 56 Cb -0.15 -3.31 -0.04 0.00 -2.04 0.00 0.00 34.95 29.41 1ue6 s ARG 56 CO -0.11 0.33 -0.21 0.00 -0.04 0.00 0.00 175.30 175.28 1ue6 s ASN 58 N -2.64 1.89 -0.01 0.00 0.01 0.35 -2.88 114.94 111.65 1ue6 s ASN 58 Ca 0.18 -0.30 -0.02 0.00 -0.71 0.00 0.00 52.86 52.00 1ue6 s ASN 58 Cb -0.07 -0.40 0.00 0.00 0.41 0.00 0.00 41.25 41.19 1ue6 s ASN 58 CO 0.08 0.16 0.05 -0.51 -1.51 0.00 0.00 177.10 175.37 1ue6 s ILE 59 N -0.10 0.03 0.47 0.60 2.07 -1.02 -1.07 121.20 122.18 1ue6 s ILE 59 Ca 0.00 -0.24 0.05 0.00 -1.41 0.00 0.00 60.65 59.05 1ue6 s ILE 59 Cb -0.09 -0.16 -0.03 0.00 0.13 0.00 0.00 42.46 42.31 1ue6 s ILE 59 CO 0.01 -0.13 0.10 0.26 -1.91 0.00 0.00 174.94 173.27 1ue6 s TRP 60 N -0.39 2.15 0.00 3.50 0.51 -1.26 -1.64 118.94 121.82 1ue6 s TRP 60 Ca -0.04 -0.79 0.00 0.00 -2.12 0.00 0.00 56.10 53.15 1ue6 s TRP 60 Cb -0.03 -1.77 0.00 0.00 -0.81 0.00 0.00 33.47 30.86 1ue6 s TRP 60 CO 0.00 0.17 0.00 0.54 -0.51 0.00 0.00 176.95 177.15 1ue6 n ARG 61 N -1.26 0.00 -0.35 4.98 3.00 -0.81 -2.81 116.66 119.41 1ue6 n ARG 61 Ca -0.09 0.00 0.09 0.00 -0.01 0.00 0.00 57.85 57.84 1ue6 n ARG 61 Cb 0.66 0.00 0.26 0.00 0.00 0.00 0.00 32.46 33.38 1ue6 n ARG 61 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.63 179.12 1ue6 h GLU 62 N 0.00 0.85 -0.89 5.56 4.81 -1.90 -1.52 114.58 121.49 1ue6 h GLU 62 Ca 0.00 -0.05 0.08 0.00 -0.13 0.00 0.00 59.36 59.26 1ue6 h GLU 62 Cb 0.00 -0.19 -0.06 0.00 0.63 0.00 0.00 28.75 29.13 1ue6 h GLU 62 CO 0.00 0.56 0.58 0.00 -0.73 0.00 0.00 179.01 179.42 1ue6 h ALA 63 N 1.57 1.57 0.02 2.92 0.00 -1.96 0.36 119.26 123.74 1ue6 h ALA 63 Ca 0.52 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.42 1ue6 h ALA 63 Cb 0.63 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.17 1ue6 h ALA 63 CO -0.31 0.27 -0.06 0.00 0.00 0.00 0.00 179.25 179.15 1ue6 h ALA 64 N 1.53 -0.08 -0.74 0.00 0.00 -1.10 0.65 119.26 119.52 1ue6 h ALA 64 Ca 0.39 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 55.24 1ue6 h ALA 64 Cb 0.29 0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1ue6 h ALA 64 CO -0.16 -0.56 0.21 0.93 0.00 0.00 0.00 179.25 179.68 1ue6 h GLU 65 N -0.11 1.16 -0.79 0.00 5.08 -1.27 0.90 114.58 119.56 1ue6 h GLU 65 Ca 0.02 -0.26 -0.01 0.00 -1.00 0.00 0.00 59.36 58.10 1ue6 h GLU 65 Cb 0.13 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1ue6 h GLU 65 CO -0.05 1.00 0.44 -0.91 -1.00 0.00 0.00 179.01 178.49 1ue6 h ASN 66 N 1.11 0.98 -0.22 1.42 2.35 0.26 -1.76 115.58 119.72 1ue6 h ASN 66 Ca 0.24 -0.09 -0.16 0.00 -0.55 0.00 0.00 56.30 55.74 1ue6 h ASN 66 Cb 0.33 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.46 1ue6 h ASN 66 CO -0.00 0.79 -0.47 0.58 -1.65 0.00 0.00 177.43 176.68 1ue6 h VAL 67 N 1.09 1.31 -0.64 2.81 2.07 0.96 -1.82 116.25 122.03 1ue6 h VAL 67 Ca 0.28 -1.68 0.08 0.00 0.82 0.00 0.00 66.70 66.20 1ue6 h VAL 67 Cb 0.02 1.81 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 1ue6 h VAL 67 CO -0.05 0.53 0.43 0.00 0.02 0.00 0.00 177.57 178.50 1ue6 h ALA 68 N 0.62 1.86 -0.02 1.67 0.00 0.12 -2.21 119.26 121.31 1ue6 h ALA 68 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1ue6 h ALA 68 Cb 1.07 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1ue6 h ALA 68 CO 0.10 0.01 -0.18 -0.85 0.00 0.00 0.00 179.25 178.33 1ue6 n GLU 69 N -4.48 1.55 -0.09 0.00 0.28 -0.70 -4.55 120.64 112.66 1ue6 n GLU 69 Ca 0.10 -1.18 -0.10 0.00 -0.16 0.00 0.00 57.16 55.83 1ue6 n GLU 69 Cb 0.30 -1.32 -0.13 0.00 1.43 0.00 0.00 31.44 31.72 1ue6 n GLU 69 CO 0.00 0.00 0.00 0.43 -0.16 0.00 0.00 177.13 177.40 1ue6 n SER 70 N 0.42 0.88 -4.48 -1.84 7.64 -0.69 -5.00 113.62 110.55 1ue6 n SER 70 Ca 0.09 -0.02 -0.33 0.00 1.01 0.00 0.00 58.87 59.62 1ue6 n SER 70 Cb 0.40 0.76 -0.13 0.00 -1.01 0.00 0.00 64.21 64.23 1ue6 n SER 70 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1ue6 s LEU 71 N -5.43 2.90 0.56 -3.43 1.43 -0.86 -5.08 118.68 108.77 1ue6 s LEU 71 Ca -0.12 -0.18 0.06 0.00 -1.03 0.00 0.00 54.13 52.87 1ue6 s LEU 71 Cb 0.06 -1.63 0.05 0.00 0.03 0.00 0.00 46.19 44.70 1ue6 s LEU 71 CO 0.69 0.29 0.48 0.42 0.23 0.00 0.00 176.35 178.46 1ue6 s THR 72 N -0.36 1.70 0.54 5.49 -4.23 -1.26 -4.11 115.64 113.42 1ue6 s THR 72 Ca 0.04 -1.41 -0.20 0.00 -1.18 0.00 0.00 61.69 58.95 1ue6 s THR 72 Cb -0.12 -2.11 -0.06 0.00 1.34 0.00 0.00 72.50 71.55 1ue6 s THR 72 CO 0.02 0.00 1.15 0.00 -0.54 0.00 0.00 174.62 175.25 1ue6 s ARG 73 N -4.36 3.32 0.00 3.99 1.04 -1.26 -3.36 118.95 118.32 1ue6 s ARG 73 Ca 0.38 1.67 0.00 0.00 -1.04 0.00 0.00 55.73 56.74 1ue6 s ARG 73 Cb -0.03 -2.03 0.00 0.00 -2.04 0.00 0.00 34.95 30.85 1ue6 s ARG 73 CO 0.24 -0.89 0.00 0.41 -0.04 0.00 0.00 175.30 175.02 1ue6 n GLY 74 N 0.25 0.61 3.72 3.88 0.00 -1.26 -4.91 105.19 107.48 1ue6 n GLY 74 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.73 1ue6 n GLY 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ue6 s ALA 75 N -2.35 3.28 -0.15 4.61 0.00 -1.21 -4.60 121.76 121.34 1ue6 s ALA 75 Ca 0.00 0.28 -0.29 0.00 0.00 0.00 0.00 51.96 51.95 1ue6 s ALA 75 Cb 0.00 -3.09 -0.01 0.00 0.00 0.00 0.00 23.12 20.02 1ue6 s ALA 75 CO 0.00 -0.13 1.15 0.50 0.00 0.00 0.00 175.76 177.29 1ue6 s ARG 76 N 0.77 4.30 0.17 0.00 3.52 -1.26 -1.72 118.95 124.73 1ue6 s ARG 76 Ca 0.42 1.55 0.07 0.00 -0.13 0.00 0.00 55.73 57.64 1ue6 s ARG 76 Cb -0.19 -3.65 -0.04 0.00 -1.56 0.00 0.00 34.95 29.51 1ue6 s ARG 76 CO 0.22 -0.57 -0.14 0.14 -0.81 0.00 0.00 175.30 174.14 1ue6 s VAL 77 N 2.89 1.57 -0.16 7.11 -7.23 -0.52 -0.76 120.40 123.31 1ue6 s VAL 77 Ca 0.51 -2.03 -0.02 0.00 -1.81 0.00 0.00 61.98 58.63 1ue6 s VAL 77 Cb -0.20 -1.86 -0.02 0.00 0.56 0.00 0.00 36.38 34.85 1ue6 s VAL 77 CO 0.15 -0.53 -0.07 -0.63 -0.31 0.00 0.00 175.10 173.70 1ue6 s ILE 78 N -2.68 3.48 -0.05 -0.62 1.01 -0.00 -3.00 121.20 119.34 1ue6 s ILE 78 Ca 0.17 -0.50 0.04 0.00 0.00 0.00 0.00 60.65 60.36 1ue6 s ILE 78 Cb -0.02 -2.51 -0.00 0.00 0.01 0.00 0.00 42.46 39.94 1ue6 s ILE 78 CO 0.05 0.49 -0.16 -0.69 0.00 0.00 0.00 174.94 174.63 1ue6 s VAL 79 N 0.53 1.36 -0.12 2.92 1.01 0.68 -1.95 120.40 124.83 1ue6 s VAL 79 Ca -0.05 -0.67 0.02 0.00 0.00 0.00 0.00 61.98 61.28 1ue6 s VAL 79 Cb -0.15 -1.18 0.01 0.00 0.00 0.00 0.00 36.38 35.07 1ue6 s VAL 79 CO 0.03 0.40 -0.18 -0.55 0.00 0.00 0.00 175.10 174.80 1ue6 s SER 80 N 0.13 2.72 0.00 3.32 0.15 -0.28 0.73 113.70 120.46 1ue6 s SER 80 Ca -0.05 -0.50 0.00 0.00 0.70 0.00 0.00 55.95 56.10 1ue6 s SER 80 Cb -0.12 -1.23 0.00 0.00 -1.71 0.00 0.00 66.02 62.96 1ue6 s SER 80 CO 0.02 0.04 0.00 0.61 1.20 0.00 0.00 173.24 175.11 1ue6 n GLY 81 N 4.18 2.14 3.29 9.45 0.00 -0.25 0.96 105.19 124.95 1ue6 n GLY 81 Ca -0.19 -0.70 -0.18 0.00 0.00 0.00 0.00 46.02 44.95 1ue6 n GLY 81 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ue6 s ARG 82 N 0.98 1.16 0.14 1.61 1.70 -0.15 -0.91 118.95 123.49 1ue6 s ARG 82 Ca 0.00 -1.43 -0.08 0.00 -0.47 0.00 0.00 55.73 53.75 1ue6 s ARG 82 Cb 0.00 -0.95 -0.06 0.00 -0.57 0.00 0.00 34.95 33.37 1ue6 s ARG 82 CO 0.00 0.16 0.43 -0.51 -1.08 0.00 0.00 175.30 174.30 1ue6 s LEU 83 N -2.95 4.27 -0.00 -1.89 1.43 -1.26 -0.26 118.68 118.01 1ue6 s LEU 83 Ca 0.16 0.74 -0.23 0.00 -1.03 0.00 0.00 54.13 53.77 1ue6 s LEU 83 Cb -0.02 -3.30 0.05 0.00 0.03 0.00 0.00 46.19 42.95 1ue6 s LEU 83 CO 0.04 0.06 0.51 -1.59 0.23 0.00 0.00 176.35 175.60 1ue6 s LYS 84 N -2.45 0.93 0.44 1.70 -2.85 -0.70 -4.91 119.74 111.90 1ue6 s LYS 84 Ca 0.40 -0.06 0.08 0.00 -1.00 0.00 0.00 55.97 55.39 1ue6 s LYS 84 Cb -0.12 0.43 -0.00 0.00 -2.06 0.00 0.00 37.83 36.07 1ue6 s LYS 84 CO 0.22 -0.30 0.42 -0.65 0.10 0.00 0.00 175.35 175.14 1ue6 s GLN 85 N -1.69 2.50 -0.23 1.78 -0.21 -1.26 -0.61 119.66 119.95 1ue6 s GLN 85 Ca -0.10 -1.58 -0.28 0.00 0.02 0.00 0.00 55.36 53.42 1ue6 s GLN 85 Cb -0.02 -2.39 0.15 0.00 1.00 0.00 0.00 33.01 31.75 1ue6 s GLN 85 CO 0.04 -0.30 1.13 -0.98 -2.12 0.00 0.00 175.29 173.06 1ue6 s ARG 86 N -4.20 0.40 -0.15 2.91 1.70 -1.12 -4.97 118.95 113.52 1ue6 s ARG 86 Ca 0.48 0.21 -0.05 0.00 -0.47 0.00 0.00 55.73 55.90 1ue6 s ARG 86 Cb -0.04 0.19 -0.04 0.00 -0.57 0.00 0.00 34.95 34.50 1ue6 s ARG 86 CO 0.28 -0.10 0.04 -1.12 -1.08 0.00 0.00 175.30 173.32 1ue6 s SER 87 N -0.65 5.46 0.05 -2.89 0.01 -1.26 -1.57 113.70 112.85 1ue6 s SER 87 Ca 0.03 0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.39 1ue6 s SER 87 Cb -0.02 -1.82 0.00 0.00 0.21 0.00 0.00 66.02 64.39 1ue6 s SER 87 CO -0.04 0.25 0.00 2.22 0.41 0.00 0.00 173.24 176.08 1ue6 n PHE 88 N 3.02 -0.74 0.08 2.43 -1.74 -0.13 -4.93 117.46 115.44 1ue6 n PHE 88 Ca -0.18 0.00 0.00 0.00 -0.56 0.00 0.00 57.45 56.71 1ue6 n PHE 88 Cb 0.53 0.00 0.00 0.00 1.52 0.00 0.00 39.48 41.53 1ue6 n PHE 88 CO 0.00 0.00 0.00 0.39 -0.56 0.00 0.00 176.76 176.59 1ue6 n GLU 89 N -0.23 0.00 0.00 3.97 4.71 -1.26 -4.28 120.64 123.55 1ue6 n GLU 89 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.15 1ue6 n GLU 89 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 31.44 30.43 1ue6 n GLU 89 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1ue6 n THR 90 N -2.90 0.00 1.08 2.62 -2.24 -1.26 -4.60 114.28 106.98 1ue6 n THR 90 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 1ue6 n THR 90 Cb 0.00 0.00 0.63 0.00 -2.10 0.00 0.00 70.33 68.86 1ue6 n THR 90 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1ue6 n ARG 91 N 13.39 0.14 0.00 -0.78 0.00 -1.26 -5.23 116.66 122.91 1ue6 n ARG 91 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 1ue6 n ARG 91 Cb 0.00 -1.50 0.00 0.00 -0.00 0.00 0.00 32.46 30.96 1ue6 n ARG 91 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.63 177.99 1ue6 n LYS 95 N -1.43 0.00 -1.62 2.89 -0.00 -1.26 -5.24 118.16 111.49 1ue6 n LYS 95 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.40 1ue6 n LYS 95 Cb 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.32 1ue6 n LYS 95 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.40 175.27 1ue6 n ARG 96 N -0.00 2.35 -3.65 -1.58 0.00 -1.26 -4.84 116.66 107.67 1ue6 n ARG 96 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 57.85 57.61 1ue6 n ARG 96 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1ue6 n ARG 96 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.63 178.58 1ue6 s THR 97 N -0.61 1.93 0.05 5.15 -4.23 -1.26 -0.96 115.64 115.71 1ue6 s THR 97 Ca 0.00 -1.36 -0.03 0.00 -1.18 0.00 0.00 61.69 59.12 1ue6 s THR 97 Cb 0.00 -2.29 -0.03 0.00 1.34 0.00 0.00 72.50 71.52 1ue6 s THR 97 CO 0.00 0.00 0.02 -0.69 -0.54 0.00 0.00 174.62 173.41 1ue6 s VAL 98 N -2.70 0.19 -0.23 2.29 1.01 -0.61 -4.94 120.40 115.41 1ue6 s VAL 98 Ca 0.42 -1.56 -0.08 0.00 0.00 0.00 0.00 61.98 60.76 1ue6 s VAL 98 Cb -0.03 -1.33 -0.04 0.00 0.00 0.00 0.00 36.38 34.98 1ue6 s VAL 98 CO 0.26 -0.86 0.10 -0.63 0.00 0.00 0.00 175.10 173.97 1ue6 s ILE 99 N -3.59 4.80 0.40 2.22 1.01 -1.26 -2.81 121.20 121.96 1ue6 s ILE 99 Ca 0.04 -0.02 0.02 0.00 0.00 0.00 0.00 60.65 60.69 1ue6 s ILE 99 Cb 0.05 -3.22 -0.01 0.00 0.01 0.00 0.00 42.46 39.30 1ue6 s ILE 99 CO -0.09 0.37 0.06 -0.62 0.00 0.00 0.00 174.94 174.67 1ue6 n GLU 100 N 4.30 0.79 -4.78 2.79 1.02 0.22 -4.68 120.64 120.30 1ue6 n GLU 100 Ca -0.16 -3.10 -0.32 0.00 -0.02 0.00 0.00 57.16 53.56 1ue6 n GLU 100 Cb 0.52 1.24 -0.16 0.00 -0.02 0.00 0.00 31.44 33.01 1ue6 n GLU 100 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1ue6 s VAL 101 N -2.73 2.11 -0.42 2.62 1.01 -0.37 -1.72 120.40 120.89 1ue6 s VAL 101 Ca 0.09 -0.97 -0.17 0.00 0.00 0.00 0.00 61.98 60.92 1ue6 s VAL 101 Cb 0.00 -1.84 0.02 0.00 0.00 0.00 0.00 36.38 34.57 1ue6 s VAL 101 CO 0.06 0.55 0.44 -1.61 0.00 0.00 0.00 175.10 174.54 1ue6 s GLU 102 N 0.71 3.10 0.14 2.72 0.41 0.64 -0.49 118.70 125.93 1ue6 s GLU 102 Ca -0.09 -0.75 -0.30 0.00 -0.41 0.00 0.00 54.97 53.42 1ue6 s GLU 102 Cb -0.16 -3.97 -0.07 0.00 -1.78 0.00 0.00 34.13 28.16 1ue6 s GLU 102 CO 0.00 -0.85 1.01 0.08 -0.49 0.00 0.00 175.26 175.01 1ue6 s VAL 103 N 2.14 4.27 -0.21 2.63 1.01 -0.24 -0.97 120.40 129.03 1ue6 s VAL 103 Ca 0.12 1.92 -0.16 0.00 0.00 0.00 0.00 61.98 63.86 1ue6 s VAL 103 Cb -0.17 -4.22 -0.09 0.00 0.00 0.00 0.00 36.38 31.89 1ue6 s VAL 103 CO 0.14 0.31 -0.27 0.47 0.00 0.00 0.00 175.10 175.75 1ue6 n ASP 104 N 2.61 1.92 -4.08 3.32 8.00 0.27 -4.79 116.55 123.80 1ue6 n ASP 104 Ca 0.02 0.38 -0.20 0.00 0.71 0.00 0.00 54.79 55.71 1ue6 n ASP 104 Cb 0.48 -0.81 -0.15 0.00 -0.02 0.00 0.00 41.12 40.62 1ue6 n ASP 104 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 1ue6 s GLU 105 N -2.61 0.93 0.06 -1.24 0.41 -0.96 -5.01 118.70 110.27 1ue6 s GLU 105 Ca -0.31 -0.49 0.01 0.00 -0.41 0.00 0.00 54.97 53.78 1ue6 s GLU 105 Cb 0.08 -0.90 -0.03 0.00 -1.78 0.00 0.00 34.13 31.50 1ue6 s GLU 105 CO 0.44 0.24 -0.06 -1.50 -0.49 0.00 0.00 175.26 173.89 1ue6 s ILE 106 N -0.40 0.51 -0.18 -1.63 2.07 -1.26 -1.13 121.20 119.17 1ue6 s ILE 106 Ca 0.04 -1.45 -0.29 0.00 -1.41 0.00 0.00 60.65 57.54 1ue6 s ILE 106 Cb -0.05 -1.05 0.12 0.00 0.13 0.00 0.00 42.46 41.61 1ue6 s ILE 106 CO -0.00 -0.64 0.98 -0.83 -1.91 0.00 0.00 174.94 172.54 1ue6 s GLY 107 N -2.23 -0.27 0.03 1.50 0.00 -0.82 -4.98 107.32 100.55 1ue6 s GLY 107 Ca -0.01 2.13 -0.30 0.00 0.00 0.00 0.00 44.72 46.54 1ue6 s GLY 107 CO -0.03 1.23 1.18 2.56 0.00 0.00 0.00 173.10 178.04 1ue6 s PRO 108 N -0.76 4.43 0.54 2.90 0.04 -1.26 -0.82 135.00 140.07 1ue6 s PRO 108 Ca -0.01 1.72 -0.20 0.00 0.04 0.00 0.00 61.00 62.54 1ue6 s PRO 108 Cb -0.02 -3.40 -0.05 0.00 0.04 0.00 0.00 34.50 31.07 1ue6 s PRO 108 CO 0.00 -0.27 1.20 0.45 0.04 0.00 0.00 177.00 178.42 1ue6 s SER 109 N 1.14 5.56 -0.27 6.66 0.15 0.06 -4.87 113.70 122.13 1ue6 s SER 109 Ca 0.58 2.38 0.11 0.00 0.70 0.00 0.00 55.95 59.71 1ue6 s SER 109 Cb -0.28 -2.60 0.58 0.00 -1.71 0.00 0.00 66.02 62.02 1ue6 s SER 109 CO 0.28 -1.34 1.57 0.18 1.20 0.00 0.00 173.24 175.12 1ue6 n LEU 110 N -1.17 4.70 0.04 3.45 4.77 -1.26 -4.21 117.00 123.33 1ue6 n LEU 110 Ca 0.11 -3.38 -0.20 0.00 -0.03 0.00 0.00 56.01 52.52 1ue6 n LEU 110 Cb 0.49 -0.65 -0.12 0.00 -2.33 0.00 0.00 43.42 40.81 1ue6 n LEU 110 CO 0.46 0.94 0.10 -0.09 -1.33 0.00 0.00 177.39 177.46 1ue6 h ARG 111 N 1.65 0.51 0.00 3.23 2.43 -1.96 -3.38 114.38 116.87 1ue6 h ARG 111 Ca 0.19 -0.63 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 1ue6 h ARG 111 Cb 1.84 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 31.59 1ue6 h ARG 111 CO 0.47 1.25 0.00 0.66 -1.51 0.00 0.00 179.97 180.84 1ue6 n TYR 112 N -4.01 0.00 -4.43 2.20 0.53 -1.26 -5.05 117.16 105.14 1ue6 n TYR 112 Ca -0.12 -0.05 -0.21 0.00 -1.02 0.00 0.00 57.90 56.50 1ue6 n TYR 112 Cb 0.83 -0.00 -0.11 0.00 -1.03 0.00 0.00 39.34 39.03 1ue6 n TYR 112 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 1ue6 s ALA 113 N -0.10 2.28 0.24 -0.72 0.00 -1.26 -5.16 121.76 117.04 1ue6 s ALA 113 Ca 0.00 -1.99 0.08 0.00 0.00 0.00 0.00 51.96 50.05 1ue6 s ALA 113 Cb 0.00 0.55 -0.05 0.00 0.00 0.00 0.00 23.12 23.62 1ue6 s ALA 113 CO 0.00 -0.26 -0.13 -0.08 0.00 0.00 0.00 175.76 175.30 1ue6 s THR 114 N -3.26 1.81 -0.04 0.00 -1.32 -1.26 -4.44 115.64 107.13 1ue6 s THR 114 Ca 0.34 -2.21 -0.16 0.00 -1.21 0.00 0.00 61.69 58.45 1ue6 s THR 114 Cb 0.07 -2.20 0.03 0.00 -1.51 0.00 0.00 72.50 68.90 1ue6 s THR 114 CO 0.14 -0.48 0.35 0.00 -2.21 0.00 0.00 174.62 172.42 1ue6 s ALA 115 N -2.92 -0.90 -0.39 11.08 0.00 -1.26 -5.06 121.76 122.31 1ue6 s ALA 115 Ca 0.25 0.54 -0.00 0.00 0.00 0.00 0.00 51.96 52.75 1ue6 s ALA 115 Cb 0.00 -0.05 0.11 0.00 0.00 0.00 0.00 23.12 23.18 1ue6 s ALA 115 CO 0.09 -0.26 0.15 -1.59 0.00 0.00 0.00 175.76 174.16 1ue6 s LYS 116 N -1.05 1.81 0.13 0.00 -2.85 -1.26 -5.10 119.74 111.42 1ue6 s LYS 116 Ca -0.11 -1.85 -0.17 0.00 -1.00 0.00 0.00 55.97 52.84 1ue6 s LYS 116 Cb -0.04 -3.44 -0.07 0.00 -2.06 0.00 0.00 37.83 32.21 1ue6 s LYS 116 CO 0.04 -1.02 0.58 0.14 0.10 0.00 0.00 175.35 175.19 1ue6 s VAL 117 N 1.03 4.78 -0.29 1.79 -7.23 -1.26 -5.07 120.40 114.15 1ue6 s VAL 117 Ca 0.09 1.03 0.01 0.00 -1.81 0.00 0.00 61.98 61.30 1ue6 s VAL 117 Cb -0.21 -3.81 0.09 0.00 0.56 0.00 0.00 36.38 33.00 1ue6 s VAL 117 CO -0.06 0.35 0.04 0.20 -0.31 0.00 0.00 175.10 175.32 1ue6 s ASN 118 N -1.49 4.10 0.00 4.85 -0.87 -1.26 -5.35 114.94 114.91 1ue6 s ASN 118 Ca 0.35 -1.59 0.31 0.00 -1.57 0.00 0.00 52.86 50.36 1ue6 s ASN 118 Cb -0.17 -1.14 1.63 0.00 -0.02 0.00 0.00 41.25 41.56 1ue6 s ASN 118 CO 0.19 -0.35 2.07 2.29 -2.57 0.00 0.00 177.10 178.74