#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ie5 s LYS 2 N 0.00 1.17 0.40 1.61 -2.85 -1.26 -5.12 119.74 113.69 1ie5 s LYS 2 Ca 0.00 -0.57 -0.10 0.00 -1.00 0.00 0.00 55.97 54.29 1ie5 s LYS 2 Cb 0.00 0.45 -0.06 0.00 -2.06 0.00 0.00 37.83 36.16 1ie5 s LYS 2 CO 0.00 -0.53 0.76 0.34 0.10 0.00 0.00 175.35 176.02 1ie5 s ASP 3 N -2.77 6.53 0.05 0.03 2.15 -1.26 -4.81 116.67 116.58 1ie5 s ASP 3 Ca 0.08 1.12 0.00 0.00 0.43 0.00 0.00 52.55 54.19 1ie5 s ASP 3 Cb -0.02 -2.32 -0.03 0.00 -0.30 0.00 0.00 42.92 40.25 1ie5 s ASP 3 CO -0.03 -0.38 -0.04 -0.63 -0.17 0.00 0.00 175.17 173.92 1ie5 s ILE 4 N -2.34 0.31 0.00 4.11 -1.09 -1.26 -5.06 121.20 115.88 1ie5 s ILE 4 Ca 0.51 -1.40 0.00 0.00 -2.23 0.00 0.00 60.65 57.53 1ie5 s ILE 4 Cb -0.10 -0.96 0.00 0.00 -1.58 0.00 0.00 42.46 39.81 1ie5 s ILE 4 CO 0.30 -0.70 1.62 0.00 -1.23 0.00 0.00 174.94 174.93 1ie5 n GLN 5 N 0.82 0.97 -3.84 2.79 6.02 -1.26 -4.77 117.38 118.12 1ie5 n GLN 5 Ca -0.19 0.00 -0.09 0.00 -0.01 0.00 0.00 57.00 56.71 1ie5 n GLN 5 Cb 0.58 -1.02 -0.07 0.00 1.02 0.00 0.00 30.24 30.75 1ie5 n GLN 5 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1ie5 s VAL 6 N 0.05 0.13 -0.57 5.09 1.01 -1.26 -5.10 120.40 119.76 1ie5 s VAL 6 Ca 0.00 -1.12 -0.26 0.00 0.00 0.00 0.00 61.98 60.60 1ie5 s VAL 6 Cb 0.00 -1.33 -0.07 0.00 0.00 0.00 0.00 36.38 34.97 1ie5 s VAL 6 CO 0.00 -0.61 2.33 -0.63 0.00 0.00 0.00 175.10 176.19 1ie5 s ILE 7 N -3.86 3.06 0.00 2.22 1.01 -1.26 -4.39 121.20 117.98 1ie5 s ILE 7 Ca 0.05 0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.71 1ie5 s ILE 7 Cb 0.05 -3.15 0.00 0.00 0.01 0.00 0.00 42.46 39.36 1ie5 s ILE 7 CO -0.11 -0.15 0.00 0.52 0.00 0.00 0.00 174.94 175.20 1ie5 n VAL 8 N 8.04 0.00 -1.94 2.92 0.31 -1.26 -5.11 118.33 121.30 1ie5 n VAL 8 Ca 0.37 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.39 1ie5 n VAL 8 Cb 0.52 0.00 0.02 0.00 -0.91 0.00 0.00 33.84 33.47 1ie5 n VAL 8 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 1ie5 s ASN 9 N -2.12 6.01 -0.16 4.52 2.20 -1.26 -4.58 114.94 119.54 1ie5 s ASN 9 Ca 0.00 1.29 -0.08 0.00 -0.94 0.00 0.00 52.86 53.13 1ie5 s ASN 9 Cb 0.00 -2.29 0.06 0.00 -2.00 0.00 0.00 41.25 37.02 1ie5 s ASN 9 CO 0.00 -0.98 0.38 -0.69 -2.94 0.00 0.00 177.10 172.88 1ie5 s VAL 10 N -3.19 -0.09 0.91 3.54 1.01 -0.43 -4.91 120.40 117.24 1ie5 s VAL 10 Ca 0.55 0.11 -0.14 0.00 0.00 0.00 0.00 61.98 62.51 1ie5 s VAL 10 Cb -0.11 -0.58 0.01 0.00 0.00 0.00 0.00 36.38 35.70 1ie5 s VAL 10 CO 0.53 0.05 0.34 -2.65 0.00 0.00 0.00 175.10 173.36 1ie5 n PRO 11 N 4.39 -0.16 -1.90 2.72 -0.02 -1.26 -1.50 135.00 137.27 1ie5 n PRO 11 Ca -0.22 -0.01 -0.31 0.00 -2.02 0.00 0.00 63.50 60.94 1ie5 n PRO 11 Cb 0.54 -1.79 0.01 0.00 -0.02 0.00 0.00 33.50 32.25 1ie5 n PRO 11 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1ie5 s PRO 12 N -3.36 3.46 -0.40 0.52 0.04 -1.26 -4.52 135.00 129.48 1ie5 s PRO 12 Ca 0.57 0.88 0.10 0.00 0.04 0.00 0.00 61.00 62.59 1ie5 s PRO 12 Cb -0.23 -2.06 0.33 0.00 0.04 0.00 0.00 34.50 32.57 1ie5 s PRO 12 CO 0.67 -0.68 0.80 0.45 0.04 0.00 0.00 177.00 178.28 1ie5 n SER 13 N -2.59 -0.15 -4.72 6.66 2.88 0.24 -4.64 113.62 111.30 1ie5 n SER 13 Ca 0.07 -3.14 -0.41 0.00 -1.33 0.00 0.00 58.87 54.05 1ie5 n SER 13 Cb 0.54 0.07 -0.04 0.00 -0.75 0.00 0.00 64.21 64.03 1ie5 n SER 13 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1ie5 s VAL 14 N -1.52 4.51 0.24 2.46 0.11 -1.26 -3.29 120.40 121.65 1ie5 s VAL 14 Ca 0.35 1.98 0.01 0.00 -2.93 0.00 0.00 61.98 61.39 1ie5 s VAL 14 Cb 0.31 -4.27 -0.05 0.00 -1.53 0.00 0.00 36.38 30.84 1ie5 s VAL 14 CO -0.08 0.25 0.09 -0.13 -3.33 0.00 0.00 175.10 171.89 1ie5 s ARG 15 N 0.32 1.34 -0.34 1.54 0.52 -0.30 -4.24 118.95 117.78 1ie5 s ARG 15 Ca 0.49 -1.71 -0.23 0.00 -0.52 0.00 0.00 55.73 53.76 1ie5 s ARG 15 Cb -0.24 -0.21 0.00 0.00 0.52 0.00 0.00 34.95 35.03 1ie5 s ARG 15 CO 0.30 -0.28 0.77 0.00 0.02 0.00 0.00 175.30 176.11 1ie5 s ALA 16 N -3.78 3.47 0.35 2.13 0.00 -1.26 -1.38 121.76 121.28 1ie5 s ALA 16 Ca 0.36 -0.59 0.18 0.00 0.00 0.00 0.00 51.96 51.91 1ie5 s ALA 16 Cb 0.07 -3.32 0.95 0.00 0.00 0.00 0.00 23.12 20.82 1ie5 s ALA 16 CO 0.12 -1.36 1.89 -0.09 0.00 0.00 0.00 175.76 176.32 1ie5 h ARG 17 N 8.34 0.00 -1.91 0.00 2.43 -1.84 -3.42 114.38 117.99 1ie5 h ARG 17 Ca -0.25 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 58.98 1ie5 h ARG 17 Cb 1.10 0.00 -0.21 0.00 -0.42 0.00 0.00 29.97 30.44 1ie5 h ARG 17 CO 0.89 0.28 -0.01 -1.14 -1.51 0.00 0.00 179.97 178.48 1ie5 s GLN 18 N -4.11 0.61 0.15 0.20 0.74 -1.26 -5.06 119.66 110.92 1ie5 s GLN 18 Ca -0.02 1.27 0.24 0.00 0.05 0.00 0.00 55.36 56.89 1ie5 s GLN 18 Cb 0.13 0.49 0.91 0.00 1.10 0.00 0.00 33.01 35.64 1ie5 s GLN 18 CO 0.67 -0.17 1.72 0.43 -0.55 0.00 0.00 175.29 177.40 1ie5 n SER 19 N 4.84 0.46 -3.65 6.67 7.64 -1.26 -4.59 113.62 123.72 1ie5 n SER 19 Ca -0.16 0.58 -0.12 0.00 1.01 0.00 0.00 58.87 60.18 1ie5 n SER 19 Cb 0.54 -0.69 -0.12 0.00 -1.01 0.00 0.00 64.21 62.93 1ie5 n SER 19 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1ie5 s THR 20 N -3.13 -0.47 0.20 0.44 2.01 -1.26 -1.14 115.64 112.28 1ie5 s THR 20 Ca 0.08 0.24 0.11 0.00 0.31 0.00 0.00 61.69 62.43 1ie5 s THR 20 Cb 0.12 -0.51 -0.04 0.00 0.01 0.00 0.00 72.50 72.08 1ie5 s THR 20 CO 0.45 0.10 -0.19 -0.04 -0.69 0.00 0.00 174.62 174.25 1ie5 s MET 21 N 2.47 1.70 0.14 4.92 1.00 0.06 -4.96 119.30 124.63 1ie5 s MET 21 Ca 0.01 -1.48 -0.05 0.00 0.00 0.00 0.00 55.69 54.16 1ie5 s MET 21 Cb -0.12 -1.93 -0.02 0.00 0.00 0.00 0.00 34.83 32.76 1ie5 s MET 21 CO -0.10 0.40 0.16 -0.80 0.00 0.00 0.00 175.02 174.68 1ie5 s ASN 22 N -2.83 0.19 0.02 3.03 -0.87 -1.26 -1.67 114.94 111.54 1ie5 s ASN 22 Ca 0.23 -1.01 -0.28 0.00 -1.57 0.00 0.00 52.86 50.24 1ie5 s ASN 22 Cb -0.08 0.36 0.09 0.00 -0.02 0.00 0.00 41.25 41.60 1ie5 s ASN 22 CO 0.12 -0.79 0.80 0.00 -2.57 0.00 0.00 177.10 174.65 1ie5 s ALA 23 N -3.99 -1.77 -0.30 0.60 0.00 -1.26 -4.97 121.76 110.07 1ie5 s ALA 23 Ca 0.19 0.97 -0.14 0.00 0.00 0.00 0.00 51.96 52.98 1ie5 s ALA 23 Cb 0.05 0.36 -0.03 0.00 0.00 0.00 0.00 23.12 23.51 1ie5 s ALA 23 CO -0.01 -0.63 0.32 0.99 0.00 0.00 0.00 175.76 176.43 1ie5 s THR 24 N -2.83 5.21 0.70 0.00 2.01 -1.26 -0.98 115.64 118.48 1ie5 s THR 24 Ca 0.01 0.23 -0.10 0.00 0.31 0.00 0.00 61.69 62.14 1ie5 s THR 24 Cb -0.01 -3.70 0.03 0.00 0.01 0.00 0.00 72.50 68.82 1ie5 s THR 24 CO -0.07 0.08 1.06 0.00 -0.69 0.00 0.00 174.62 175.00 1ie5 s ALA 25 N 1.95 2.96 0.00 7.40 0.00 -0.34 -4.23 121.76 129.51 1ie5 s ALA 25 Ca 0.11 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.56 1ie5 s ALA 25 Cb -0.16 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.06 1ie5 s ALA 25 CO 0.11 -1.16 0.00 -1.71 0.00 0.00 0.00 175.76 173.00 1ie5 n ASN 26 N -2.96 0.00 -0.18 0.00 2.85 -1.26 -4.72 115.26 108.99 1ie5 n ASN 26 Ca 0.07 0.00 0.11 0.00 -0.11 0.00 0.00 54.58 54.65 1ie5 n ASN 26 Cb 0.58 -0.94 0.07 0.00 1.24 0.00 0.00 39.78 40.73 1ie5 n ASN 26 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1ie5 n LEU 27 N 0.00 1.20 -3.89 1.20 4.77 -1.26 -5.00 117.00 114.02 1ie5 n LEU 27 Ca 0.00 -0.44 -0.28 0.00 -0.03 0.00 0.00 56.01 55.26 1ie5 n LEU 27 Cb 0.00 -0.07 0.02 0.00 -2.33 0.00 0.00 43.42 41.04 1ie5 n LEU 27 CO 0.00 0.25 0.02 -1.20 -1.33 0.00 0.00 177.39 175.13 1ie5 n SER 28 N -0.95 -3.34 -4.75 -1.43 7.64 -1.24 -4.96 113.62 104.59 1ie5 n SER 28 Ca 0.07 -0.83 -0.29 0.00 1.01 0.00 0.00 58.87 58.83 1ie5 n SER 28 Cb 0.37 -3.75 0.14 0.00 -1.01 0.00 0.00 64.21 59.96 1ie5 n SER 28 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 1ie5 s GLN 29 N -6.48 1.03 -0.09 1.43 2.00 -1.25 -3.68 119.66 112.62 1ie5 s GLN 29 Ca 0.44 0.42 0.02 0.00 -2.00 0.00 0.00 55.36 54.25 1ie5 s GLN 29 Cb -0.22 -1.81 -0.02 0.00 0.80 0.00 0.00 33.01 31.75 1ie5 s GLN 29 CO 0.84 -2.30 -0.16 -1.12 -0.50 0.00 0.00 175.29 172.05 1ie5 s SER 30 N -3.81 3.82 -0.10 6.67 0.01 -1.26 -0.86 113.70 118.16 1ie5 s SER 30 Ca 0.64 -0.32 -0.08 0.00 1.31 0.00 0.00 55.95 57.49 1ie5 s SER 30 Cb -0.16 -1.21 0.03 0.00 0.21 0.00 0.00 66.02 64.89 1ie5 s SER 30 CO 0.55 0.24 0.26 -0.69 0.41 0.00 0.00 173.24 174.01 1ie5 s VAL 31 N -0.11 -0.01 -0.02 3.43 1.01 0.14 -5.00 120.40 119.84 1ie5 s VAL 31 Ca -0.02 0.03 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1ie5 s VAL 31 Cb -0.14 -0.38 -0.03 0.00 0.00 0.00 0.00 36.38 35.83 1ie5 s VAL 31 CO 0.04 0.01 -0.03 -0.89 0.00 0.00 0.00 175.10 174.23 1ie5 s THR 32 N 0.38 3.98 0.22 3.92 2.01 -1.26 -0.76 115.64 124.13 1ie5 s THR 32 Ca -0.02 -0.58 -0.18 0.00 0.31 0.00 0.00 61.69 61.22 1ie5 s THR 32 Cb -0.04 -2.73 0.03 0.00 0.01 0.00 0.00 72.50 69.77 1ie5 s THR 32 CO -0.02 0.44 0.57 -1.48 -0.69 0.00 0.00 174.62 173.44 1ie5 s LEU 33 N -1.33 -0.03 -0.14 4.42 0.05 -0.73 -5.01 118.68 115.92 1ie5 s LEU 33 Ca 0.17 -0.52 -0.30 0.00 0.05 0.00 0.00 54.13 53.53 1ie5 s LEU 33 Cb -0.11 2.27 0.11 0.00 -2.05 0.00 0.00 46.19 46.41 1ie5 s LEU 33 CO 0.07 -1.13 0.91 0.00 -0.55 0.00 0.00 176.35 175.65 1ie5 s ALA 34 N -3.89 -1.89 -0.60 1.48 0.00 -1.26 -0.84 121.76 114.76 1ie5 s ALA 34 Ca 0.11 1.54 -0.08 0.00 0.00 0.00 0.00 51.96 53.53 1ie5 s ALA 34 Cb -0.02 -0.58 0.16 0.00 0.00 0.00 0.00 23.12 22.68 1ie5 s ALA 34 CO 0.00 -0.32 0.47 0.00 0.00 0.00 0.00 175.76 175.91 1ie5 s ASP 36 N 1.89 5.74 0.18 0.00 -4.77 -0.48 -4.50 116.67 114.73 1ie5 s ASP 36 Ca 0.12 1.34 0.05 0.00 -3.30 0.00 0.00 52.55 50.77 1ie5 s ASP 36 Cb -0.21 -2.52 -0.04 0.00 -1.09 0.00 0.00 42.92 39.06 1ie5 s ASP 36 CO -0.04 -1.83 0.15 0.00 0.70 0.00 0.00 175.17 174.16 1ie5 s ALA 37 N 7.42 3.57 0.18 2.11 0.00 -1.26 -1.15 121.76 132.63 1ie5 s ALA 37 Ca 0.83 -1.26 -0.23 0.00 0.00 0.00 0.00 51.96 51.31 1ie5 s ALA 37 Cb -0.24 -1.35 0.06 0.00 0.00 0.00 0.00 23.12 21.59 1ie5 s ALA 37 CO 0.33 0.45 0.63 0.34 0.00 0.00 0.00 175.76 177.51 1ie5 s ASP 38 N -3.26 -0.50 0.00 0.00 2.15 -1.21 -4.91 116.67 108.94 1ie5 s ASP 38 Ca 0.31 -0.13 0.00 0.00 0.43 0.00 0.00 52.55 53.17 1ie5 s ASP 38 Cb -0.10 0.62 0.00 0.00 -0.30 0.00 0.00 42.92 43.14 1ie5 s ASP 38 CO 0.24 -1.04 0.00 0.61 -0.17 0.00 0.00 175.17 174.81 1ie5 n GLY 39 N -0.39 2.87 3.09 2.66 0.00 -1.26 -0.59 105.19 111.56 1ie5 n GLY 39 Ca -0.14 -0.89 -0.15 0.00 0.00 0.00 0.00 46.02 44.83 1ie5 n GLY 39 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ie5 s PHE 40 N -2.00 0.84 -1.05 1.61 0.40 -0.56 -3.19 117.98 114.03 1ie5 s PHE 40 Ca 0.00 -0.45 0.16 0.00 -0.60 0.00 0.00 56.93 56.03 1ie5 s PHE 40 Cb 0.00 -0.49 0.68 0.00 0.51 0.00 0.00 43.02 43.72 1ie5 s PHE 40 CO 0.00 -0.03 1.50 -2.30 0.70 0.00 0.00 175.22 175.08 1ie5 n PRO 41 N 1.53 0.03 -3.52 0.24 -0.02 -1.26 -1.31 135.00 130.69 1ie5 n PRO 41 Ca -0.21 0.22 -0.13 0.00 -2.02 0.00 0.00 63.50 61.35 1ie5 n PRO 41 Cb 0.55 -1.50 -0.04 0.00 -0.02 0.00 0.00 33.50 32.49 1ie5 n PRO 41 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 1ie5 s GLU 42 N -2.95 1.13 0.52 -0.52 2.02 -1.24 -4.79 118.70 112.86 1ie5 s GLU 42 Ca 0.08 -0.33 -0.02 0.00 0.02 0.00 0.00 54.97 54.72 1ie5 s GLU 42 Cb 0.10 0.52 0.00 0.00 0.10 0.00 0.00 34.13 34.85 1ie5 s GLU 42 CO 0.28 -0.44 0.78 -1.25 0.02 0.00 0.00 175.26 174.65 1ie5 s PRO 43 N -2.95 2.98 -0.03 0.39 0.04 -1.19 -4.68 135.00 129.56 1ie5 s PRO 43 Ca -0.03 -0.28 -0.01 0.00 0.04 0.00 0.00 61.00 60.72 1ie5 s PRO 43 Cb -0.00 -2.43 0.03 0.00 0.04 0.00 0.00 34.50 32.14 1ie5 s PRO 43 CO -0.06 -0.48 0.06 0.99 0.04 0.00 0.00 177.00 177.56 1ie5 s THR 44 N -2.76 -0.04 0.13 1.26 2.01 -1.26 -4.97 115.64 110.01 1ie5 s THR 44 Ca 0.51 0.16 -0.21 0.00 0.31 0.00 0.00 61.69 62.46 1ie5 s THR 44 Cb -0.10 -0.12 0.06 0.00 0.01 0.00 0.00 72.50 72.35 1ie5 s THR 44 CO 0.41 0.07 0.54 0.00 -0.69 0.00 0.00 174.62 174.94 1ie5 s MET 45 N 0.86 1.19 0.21 4.92 0.23 -1.26 -0.56 119.30 124.89 1ie5 s MET 45 Ca -0.07 -0.50 -0.10 0.00 -1.03 0.00 0.00 55.69 53.99 1ie5 s MET 45 Cb -0.10 0.54 -0.01 0.00 -1.53 0.00 0.00 34.83 33.74 1ie5 s MET 45 CO -0.03 -0.50 0.37 0.95 -2.03 0.00 0.00 175.02 173.78 1ie5 s THR 46 N -3.58 0.03 0.14 3.16 -4.23 -0.36 -4.95 115.64 105.83 1ie5 s THR 46 Ca 0.01 -1.43 -0.21 0.00 -1.18 0.00 0.00 61.69 58.88 1ie5 s THR 46 Cb -0.00 -2.06 0.06 0.00 1.34 0.00 0.00 72.50 71.83 1ie5 s THR 46 CO -0.11 -0.12 0.52 -1.66 -0.54 0.00 0.00 174.62 172.71 1ie5 s TRP 47 N -4.01 -0.41 0.17 3.99 1.48 -1.26 -1.03 118.94 117.86 1ie5 s TRP 47 Ca 0.22 0.19 0.08 0.00 -1.06 0.00 0.00 56.10 55.52 1ie5 s TRP 47 Cb 0.02 0.43 -0.04 0.00 -1.16 0.00 0.00 33.47 32.72 1ie5 s TRP 47 CO 0.05 -0.78 -0.16 0.95 -4.06 0.00 0.00 176.95 172.95 1ie5 s THR 48 N -3.65 1.70 -0.77 0.66 -4.23 -0.28 -0.75 115.64 108.31 1ie5 s THR 48 Ca 0.01 -1.95 -0.03 0.00 -1.18 0.00 0.00 61.69 58.54 1ie5 s THR 48 Cb 0.00 -1.83 0.20 0.00 1.34 0.00 0.00 72.50 72.21 1ie5 s THR 48 CO -0.12 -0.41 2.36 1.17 -0.54 0.00 0.00 174.62 177.08 1ie5 n LYS 49 N 0.18 3.15 0.00 3.99 4.81 0.38 -2.75 118.16 127.91 1ie5 n LYS 49 Ca -0.12 -3.16 0.00 0.00 -0.87 0.00 0.00 58.31 54.15 1ie5 n LYS 49 Cb 0.58 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 33.34 1ie5 n LYS 49 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1ie5 n ASP 50 N 0.37 0.00 0.00 3.14 2.03 -1.25 -4.28 116.55 116.56 1ie5 n ASP 50 Ca 0.52 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.83 1ie5 n ASP 50 Cb 0.37 -0.38 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 1ie5 n ASP 50 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ie5 n GLY 51 N -1.62 0.74 3.41 0.27 0.00 -1.26 -5.03 105.19 101.71 1ie5 n GLY 51 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1ie5 n GLY 51 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1ie5 s GLU 52 N 0.00 1.09 0.51 1.61 -1.05 -1.26 -5.15 118.70 114.44 1ie5 s GLU 52 Ca 0.00 -0.22 -0.20 0.00 -0.15 0.00 0.00 54.97 54.40 1ie5 s GLU 52 Cb 0.00 0.50 -0.07 0.00 -0.44 0.00 0.00 34.13 34.12 1ie5 s GLU 52 CO 0.00 -0.41 1.09 -2.14 0.95 0.00 0.00 175.26 174.75 1ie5 s PRO 53 N -2.56 3.60 -0.22 -4.83 0.02 -1.26 -0.47 135.00 129.27 1ie5 s PRO 53 Ca -0.05 1.51 0.14 0.00 0.02 0.00 0.00 61.00 62.62 1ie5 s PRO 53 Cb -0.01 -2.09 0.52 0.00 0.02 0.00 0.00 34.50 32.95 1ie5 s PRO 53 CO -0.03 -0.62 1.44 -0.89 -0.33 0.00 0.00 177.00 176.57 1ie5 n ILE 54 N -1.06 2.39 -0.74 2.83 5.41 0.07 -4.80 119.36 123.45 1ie5 n ILE 54 Ca 0.10 -2.18 -0.13 0.00 1.00 0.00 0.00 62.75 61.54 1ie5 n ILE 54 Cb 0.51 -0.28 -0.11 0.00 -0.71 0.00 0.00 39.64 39.05 1ie5 n ILE 54 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 176.55 174.71 1ie5 n GLU 55 N -0.77 0.00 0.01 0.38 0.28 -1.26 -4.81 120.64 114.48 1ie5 n GLU 55 Ca 0.26 0.00 0.03 0.00 -0.16 0.00 0.00 57.16 57.30 1ie5 n GLU 55 Cb 0.96 -0.54 0.14 0.00 1.43 0.00 0.00 31.44 33.43 1ie5 n GLU 55 CO 0.00 0.00 0.00 1.04 -0.16 0.00 0.00 177.13 178.01 1ie5 n GLN 56 N 2.98 0.01 0.00 3.44 6.02 -1.26 -0.24 117.38 128.33 1ie5 n GLN 56 Ca 0.33 0.41 0.13 0.00 -0.01 0.00 0.00 57.00 57.87 1ie5 n GLN 56 Cb 0.06 -1.52 0.42 0.00 1.02 0.00 0.00 30.24 30.21 1ie5 n GLN 56 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1ie5 n GLU 57 N -1.54 0.69 0.00 -1.09 -0.58 -1.26 -4.62 120.64 112.23 1ie5 n GLU 57 Ca 0.01 -0.37 0.00 0.00 -0.42 0.00 0.00 57.16 56.39 1ie5 n GLU 57 Cb 0.07 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.45 1ie5 n GLU 57 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1ie5 n ASP 58 N -0.84 0.00 -4.74 1.62 2.03 -0.70 -5.10 116.55 108.83 1ie5 n ASP 58 Ca 0.12 0.00 -0.38 0.00 0.52 0.00 0.00 54.79 55.05 1ie5 n ASP 58 Cb 0.33 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.67 1ie5 n ASP 58 CO 0.00 0.00 0.00 0.20 -1.92 0.00 0.00 177.20 175.48 1ie5 s ASN 59 N -0.86 6.70 0.00 1.67 -0.87 0.67 -4.93 114.94 117.32 1ie5 s ASN 59 Ca 0.00 0.83 0.00 0.00 -1.57 0.00 0.00 52.86 52.12 1ie5 s ASN 59 Cb 0.00 -2.28 0.00 0.00 -0.02 0.00 0.00 41.25 38.95 1ie5 s ASN 59 CO 0.00 0.05 0.16 -0.62 -2.57 0.00 0.00 177.10 174.12 1ie5 n GLU 60 N 3.41 0.00 -0.16 -0.60 1.02 -1.26 -4.44 120.64 118.61 1ie5 n GLU 60 Ca -0.08 -0.16 0.11 0.00 -0.02 0.00 0.00 57.16 57.01 1ie5 n GLU 60 Cb 0.52 -0.22 0.20 0.00 -0.02 0.00 0.00 31.44 31.92 1ie5 n GLU 60 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 1ie5 n GLU 61 N 0.00 -0.03 -2.69 3.49 -0.58 -1.26 -1.83 120.64 117.73 1ie5 n GLU 61 Ca 0.00 0.68 -0.06 0.00 -0.42 0.00 0.00 57.16 57.36 1ie5 n GLU 61 Cb 0.43 -1.15 0.11 0.00 -0.57 0.00 0.00 31.44 30.27 1ie5 n GLU 61 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 1ie5 n LYS 62 N -4.33 1.23 -3.51 3.49 2.85 -1.26 -5.12 118.16 111.51 1ie5 n LYS 62 Ca 0.14 -1.91 -0.11 0.00 -1.05 0.00 0.00 58.31 55.38 1ie5 n LYS 62 Cb 0.47 -0.13 -0.03 0.00 -0.65 0.00 0.00 35.03 34.69 1ie5 n LYS 62 CO 0.00 0.00 0.00 1.52 -0.05 0.00 0.00 177.40 178.87 1ie5 s TYR 63 N -0.23 -0.41 0.22 5.58 -0.85 -0.76 -0.97 117.35 119.93 1ie5 s TYR 63 Ca 0.21 0.44 -0.22 0.00 -0.52 0.00 0.00 57.07 56.97 1ie5 s TYR 63 Cb 0.41 0.50 0.04 0.00 0.38 0.00 0.00 41.96 43.30 1ie5 s TYR 63 CO -0.08 -0.54 0.75 -1.54 -1.52 0.00 0.00 175.55 172.61 1ie5 s SER 64 N -2.04 -0.30 0.14 -0.18 1.04 -0.64 -4.55 113.70 107.17 1ie5 s SER 64 Ca 0.01 -0.44 0.01 0.00 0.48 0.00 0.00 55.95 56.01 1ie5 s SER 64 Cb -0.01 0.65 -0.00 0.00 0.10 0.00 0.00 66.02 66.76 1ie5 s SER 64 CO -0.05 -1.17 0.16 2.22 0.98 0.00 0.00 173.24 175.38 1ie5 n PHE 65 N -0.44 -0.61 -4.17 5.02 -1.74 -1.26 -0.72 117.46 113.54 1ie5 n PHE 65 Ca -0.07 -1.08 -0.15 0.00 -0.56 0.00 0.00 57.45 55.59 1ie5 n PHE 65 Cb 0.60 0.18 -0.06 0.00 1.52 0.00 0.00 39.48 41.73 1ie5 n PHE 65 CO 0.00 0.00 0.00 0.27 -0.56 0.00 0.00 176.76 176.47 1ie5 n ASN 66 N -2.18 -0.77 -2.52 5.98 2.04 -1.24 -5.03 115.26 111.53 1ie5 n ASN 66 Ca 0.02 -2.80 -0.25 0.00 -0.44 0.00 0.00 54.58 51.10 1ie5 n ASN 66 Cb 0.25 1.65 -0.01 0.00 -2.53 0.00 0.00 39.78 39.14 1ie5 n ASN 66 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 1ie5 n TYR 67 N -0.53 -0.96 0.00 -2.53 0.18 -1.26 -1.99 117.16 110.07 1ie5 n TYR 67 Ca 0.05 0.42 0.00 0.00 1.88 0.00 0.00 57.90 60.25 1ie5 n TYR 67 Cb 0.51 -1.07 0.00 0.00 -0.38 0.00 0.00 39.34 38.41 1ie5 n TYR 67 CO 0.00 0.00 0.00 -0.25 -2.08 0.00 0.00 176.86 174.53 1ie5 n ASP 68 N 1.31 0.00 0.00 9.48 8.00 -1.26 -4.22 116.55 129.86 1ie5 n ASP 68 Ca 0.08 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.58 1ie5 n ASP 68 Cb 0.21 -0.58 0.00 0.00 -0.02 0.00 0.00 41.12 40.72 1ie5 n ASP 68 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ie5 n GLY 69 N -1.98 0.68 0.13 0.44 0.00 -0.84 -4.45 105.19 99.17 1ie5 n GLY 69 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1ie5 n GLY 69 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1ie5 n SER 70 N -0.05 2.01 -4.51 1.61 3.41 -1.26 -4.88 113.62 109.95 1ie5 n SER 70 Ca 0.00 -0.06 -0.42 0.00 -0.26 0.00 0.00 58.87 58.13 1ie5 n SER 70 Cb 0.03 -0.51 -0.03 0.00 -0.26 0.00 0.00 64.21 63.43 1ie5 n SER 70 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1ie5 s GLU 71 N -2.53 3.37 -0.34 4.33 2.02 -1.26 -3.38 118.70 120.91 1ie5 s GLU 71 Ca -0.32 -0.94 -0.24 0.00 0.02 0.00 0.00 54.97 53.49 1ie5 s GLU 71 Cb 0.08 -4.68 0.01 0.00 0.10 0.00 0.00 34.13 29.64 1ie5 s GLU 71 CO 0.64 -2.02 0.83 -1.17 0.02 0.00 0.00 175.26 173.56 1ie5 s LEU 72 N 4.53 4.08 -0.26 1.80 2.96 -0.02 -3.71 118.68 128.05 1ie5 s LEU 72 Ca 0.35 0.56 -0.11 0.00 -0.22 0.00 0.00 54.13 54.70 1ie5 s LEU 72 Cb -0.07 -3.12 -0.05 0.00 0.50 0.00 0.00 46.19 43.45 1ie5 s LEU 72 CO 0.02 -0.71 0.20 -0.63 -1.32 0.00 0.00 176.35 173.91 1ie5 s ILE 73 N 3.14 5.31 -0.02 6.68 1.01 0.10 -1.78 121.20 135.64 1ie5 s ILE 73 Ca 0.34 0.23 0.02 0.00 0.00 0.00 0.00 60.65 61.23 1ie5 s ILE 73 Cb -0.13 -3.54 -0.03 0.00 0.01 0.00 0.00 42.46 38.76 1ie5 s ILE 73 CO 0.15 0.28 -0.03 -0.63 0.00 0.00 0.00 174.94 174.71 1ie5 s ILE 74 N 1.52 3.97 0.21 2.92 1.01 0.06 -1.63 121.20 129.27 1ie5 s ILE 74 Ca 0.08 -0.59 0.10 0.00 0.00 0.00 0.00 60.65 60.24 1ie5 s ILE 74 Cb -0.15 -2.73 -0.05 0.00 0.01 0.00 0.00 42.46 39.54 1ie5 s ILE 74 CO 0.08 0.43 -0.20 -1.59 0.00 0.00 0.00 174.94 173.67 1ie5 s LYS 75 N -1.35 1.49 -0.97 2.79 -2.85 -0.14 -0.69 119.74 118.02 1ie5 s LYS 75 Ca 0.17 -1.58 -0.04 0.00 -1.00 0.00 0.00 55.97 53.52 1ie5 s LYS 75 Cb -0.11 -1.62 0.00 0.00 -2.06 0.00 0.00 37.83 34.04 1ie5 s LYS 75 CO 0.07 0.32 0.83 1.63 0.10 0.00 0.00 175.35 178.31 1ie5 n LYS 76 N -0.07 -5.57 -2.07 1.78 5.02 -0.30 -4.82 118.16 112.13 1ie5 n LYS 76 Ca -0.10 0.62 -0.41 0.00 -2.02 0.00 0.00 58.31 56.40 1ie5 n LYS 76 Cb 0.58 -5.02 -0.02 0.00 -0.02 0.00 0.00 35.03 30.55 1ie5 n LYS 76 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1ie5 s VAL 77 N -3.25 2.69 0.33 -0.18 1.01 -0.04 -4.74 120.40 116.23 1ie5 s VAL 77 Ca 0.27 0.65 -0.00 0.00 0.00 0.00 0.00 61.98 62.90 1ie5 s VAL 77 Cb -0.12 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 32.85 1ie5 s VAL 77 CO 0.54 0.13 0.44 0.47 0.00 0.00 0.00 175.10 176.69 1ie5 n ASP 78 N 1.42 -1.21 0.24 3.32 8.00 -1.26 -3.70 116.55 123.36 1ie5 n ASP 78 Ca 0.03 -2.86 0.14 0.00 0.71 0.00 0.00 54.79 52.81 1ie5 n ASP 78 Cb 0.41 2.32 0.76 0.00 -0.02 0.00 0.00 41.12 44.59 1ie5 n ASP 78 CO 0.00 0.00 0.00 0.11 -0.39 0.00 0.00 177.20 176.92 1ie5 h LYS 79 N 0.00 0.00 0.00 -1.24 1.79 -1.93 -1.25 116.57 113.94 1ie5 h LYS 79 Ca -0.26 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.21 1ie5 h LYS 79 Cb 1.14 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.79 1ie5 h LYS 79 CO 0.35 0.00 0.00 0.66 -1.08 0.00 0.00 179.45 179.38 1ie5 h SER 80 N 0.00 0.00 1.57 0.86 4.64 -1.99 -3.23 113.55 115.41 1ie5 h SER 80 Ca 0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1ie5 h SER 80 Cb 0.21 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.29 1ie5 h SER 80 CO 0.00 0.00 -0.43 0.44 -0.87 0.00 0.00 176.83 175.97 1ie5 h ASP 81 N 0.00 0.00 -0.86 4.97 3.32 -1.63 -3.47 116.42 118.75 1ie5 h ASP 81 Ca 0.00 0.00 -0.67 0.00 0.02 0.00 0.00 57.03 56.38 1ie5 h ASP 81 Cb 0.50 0.00 0.05 0.00 0.22 0.00 0.00 39.33 40.10 1ie5 h ASP 81 CO 0.00 0.04 0.01 1.21 -1.72 0.00 0.00 179.24 178.78 1ie5 n GLU 82 N -2.95 0.00 -3.92 3.56 2.13 -1.22 -4.97 120.64 113.27 1ie5 n GLU 82 Ca 0.02 0.00 -0.10 0.00 0.66 0.00 0.00 57.16 57.74 1ie5 n GLU 82 Cb 0.56 -1.26 -0.01 0.00 0.27 0.00 0.00 31.44 30.99 1ie5 n GLU 82 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ie5 s ALA 83 N -0.07 -0.42 -0.40 4.31 0.00 -0.40 -5.01 121.76 119.76 1ie5 s ALA 83 Ca 0.76 -0.85 0.09 0.00 0.00 0.00 0.00 51.96 51.97 1ie5 s ALA 83 Cb -1.07 0.89 0.28 0.00 0.00 0.00 0.00 23.12 23.23 1ie5 s ALA 83 CO 0.49 -0.93 0.66 -1.91 0.00 0.00 0.00 175.76 174.07 1ie5 n GLU 84 N -0.49 0.81 -1.56 0.00 2.13 -1.26 -1.46 120.64 118.81 1ie5 n GLU 84 Ca -0.04 -3.01 -0.49 0.00 0.66 0.00 0.00 57.16 54.28 1ie5 n GLU 84 Cb 0.60 -1.38 -0.04 0.00 0.27 0.00 0.00 31.44 30.90 1ie5 n GLU 84 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1ie5 n TYR 85 N 1.04 1.14 -4.79 4.31 4.01 0.23 -3.79 117.16 119.31 1ie5 n TYR 85 Ca 0.20 0.72 -0.30 0.00 -0.16 0.00 0.00 57.90 58.36 1ie5 n TYR 85 Cb 0.59 -2.25 -0.17 0.00 -0.31 0.00 0.00 39.34 37.21 1ie5 n TYR 85 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1ie5 s ILE 86 N -0.29 1.72 -0.03 -0.72 1.01 -1.11 -1.21 121.20 120.56 1ie5 s ILE 86 Ca 0.73 -0.80 0.05 0.00 0.00 0.00 0.00 60.65 60.62 1ie5 s ILE 86 Cb -0.87 -1.53 -0.01 0.00 0.01 0.00 0.00 42.46 40.07 1ie5 s ILE 86 CO 0.53 0.48 -0.18 0.00 0.00 0.00 0.00 174.94 175.78 1ie5 s ILE 88 N -0.11 0.78 0.10 0.00 1.01 -0.20 -0.88 121.20 121.90 1ie5 s ILE 88 Ca -0.00 -0.28 0.08 0.00 0.00 0.00 0.00 60.65 60.44 1ie5 s ILE 88 Cb -0.10 -0.74 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1ie5 s ILE 88 CO 0.01 0.27 -0.15 0.00 0.00 0.00 0.00 174.94 175.07 1ie5 s ALA 89 N 0.71 2.77 -0.47 9.38 0.00 0.07 -1.23 121.76 133.00 1ie5 s ALA 89 Ca -0.12 -1.29 0.03 0.00 0.00 0.00 0.00 51.96 50.59 1ie5 s ALA 89 Cb -0.14 -0.76 0.20 0.00 0.00 0.00 0.00 23.12 22.42 1ie5 s ALA 89 CO 0.02 0.61 0.83 -2.00 0.00 0.00 0.00 175.76 175.22 1ie5 s GLU 90 N -2.06 0.83 0.45 0.00 2.12 0.27 -0.68 118.70 119.64 1ie5 s GLU 90 Ca 0.19 -0.82 0.01 0.00 0.36 0.00 0.00 54.97 54.71 1ie5 s GLU 90 Cb -0.11 -0.04 0.09 0.00 0.26 0.00 0.00 34.13 34.33 1ie5 s GLU 90 CO 0.11 -1.03 0.62 0.27 -0.54 0.00 0.00 175.26 174.68 1ie5 n ASN 91 N 2.87 0.96 0.28 -1.70 6.94 -0.86 -4.54 115.26 119.22 1ie5 n ASN 91 Ca 0.16 -1.78 0.18 0.00 -0.02 0.00 0.00 54.58 53.13 1ie5 n ASN 91 Cb 0.58 -0.39 0.96 0.00 -2.36 0.00 0.00 39.78 38.57 1ie5 n ASN 91 CO 0.00 0.00 0.00 0.07 -1.03 0.00 0.00 177.26 176.30 1ie5 h LYS 92 N 0.00 0.00 0.00 -3.83 -0.00 -1.89 -3.05 116.57 107.80 1ie5 h LYS 92 Ca -0.20 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.45 1ie5 h LYS 92 Cb 0.79 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.02 1ie5 h LYS 92 CO 0.23 0.00 -1.38 0.00 -0.00 0.00 0.00 179.45 178.30 1ie5 n ALA 93 N -2.14 3.09 0.00 0.07 0.00 -1.26 -5.09 120.51 115.18 1ie5 n ALA 93 Ca -0.01 -0.40 0.00 0.00 0.00 0.00 0.00 53.44 53.03 1ie5 n ALA 93 Cb 0.25 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.14 1ie5 n ALA 93 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ie5 n GLY 94 N 1.51 -0.62 3.28 0.00 0.00 -1.15 -4.52 105.19 103.69 1ie5 n GLY 94 Ca -0.01 -0.57 -0.14 0.00 0.00 0.00 0.00 46.02 45.31 1ie5 n GLY 94 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1ie5 s GLU 95 N -0.29 0.71 0.18 1.61 2.12 -1.26 -2.03 118.70 119.74 1ie5 s GLU 95 Ca 0.00 -0.10 -0.24 0.00 0.36 0.00 0.00 54.97 54.99 1ie5 s GLU 95 Cb 0.00 0.32 0.05 0.00 0.26 0.00 0.00 34.13 34.76 1ie5 s GLU 95 CO 0.00 -0.19 0.80 -1.14 -0.54 0.00 0.00 175.26 174.18 1ie5 s GLN 96 N -1.23 1.38 0.03 4.30 2.00 0.14 -4.78 119.66 121.51 1ie5 s GLN 96 Ca -0.13 -0.70 -0.28 0.00 -2.00 0.00 0.00 55.36 52.26 1ie5 s GLN 96 Cb -0.04 0.51 0.07 0.00 0.80 0.00 0.00 33.01 34.35 1ie5 s GLN 96 CO 0.05 -0.63 0.67 0.16 -0.50 0.00 0.00 175.29 175.04 1ie5 s ASP 97 N -2.84 -0.60 0.32 6.67 -4.77 -1.26 -0.75 116.67 113.45 1ie5 s ASP 97 Ca 0.09 0.38 -0.02 0.00 -3.30 0.00 0.00 52.55 49.69 1ie5 s ASP 97 Cb -0.03 0.55 -0.00 0.00 -1.09 0.00 0.00 42.92 42.35 1ie5 s ASP 97 CO -0.00 -0.75 0.43 0.00 0.70 0.00 0.00 175.17 175.55 1ie5 s ALA 98 N -2.32 0.81 -0.07 2.11 0.00 -0.05 -4.80 121.76 117.43 1ie5 s ALA 98 Ca -0.05 -1.52 -0.08 0.00 0.00 0.00 0.00 51.96 50.30 1ie5 s ALA 98 Cb -0.00 1.20 0.02 0.00 0.00 0.00 0.00 23.12 24.33 1ie5 s ALA 98 CO -0.01 -0.77 0.22 0.99 0.00 0.00 0.00 175.76 176.19 1ie5 s THR 99 N -3.27 0.01 -0.02 0.00 2.01 -1.26 -0.97 115.64 112.14 1ie5 s THR 99 Ca 0.31 -0.12 -0.04 0.00 0.31 0.00 0.00 61.69 62.15 1ie5 s THR 99 Cb 0.00 -0.36 0.00 0.00 0.01 0.00 0.00 72.50 72.16 1ie5 s THR 99 CO 0.19 -0.07 0.09 -0.63 -0.69 0.00 0.00 174.62 173.52 1ie5 s ILE 100 N -0.17 0.04 0.02 1.82 1.01 -0.35 -4.77 121.20 118.80 1ie5 s ILE 100 Ca -0.03 -0.31 -0.11 0.00 0.00 0.00 0.00 60.65 60.20 1ie5 s ILE 100 Cb -0.03 -0.24 -0.05 0.00 0.01 0.00 0.00 42.46 42.15 1ie5 s ILE 100 CO 0.01 -0.17 0.37 -1.00 0.00 0.00 0.00 174.94 174.15 1ie5 s HIS 101 N -0.54 3.64 -0.40 3.97 3.76 -0.29 -0.60 115.29 124.83 1ie5 s HIS 101 Ca -0.06 0.83 0.01 0.00 -0.15 0.00 0.00 55.06 55.69 1ie5 s HIS 101 Cb -0.04 -2.18 0.13 0.00 1.11 0.00 0.00 32.58 31.60 1ie5 s HIS 101 CO 0.00 0.60 0.22 -1.17 -0.85 0.00 0.00 174.74 173.54 1ie5 s LEU 102 N -1.48 2.13 -0.61 0.89 1.98 -0.54 -0.76 118.68 120.29 1ie5 s LEU 102 Ca 0.27 -2.40 -0.09 0.00 -2.89 0.00 0.00 54.13 49.02 1ie5 s LEU 102 Cb -0.15 -0.83 0.16 0.00 0.66 0.00 0.00 46.19 46.03 1ie5 s LEU 102 CO 0.15 -0.29 0.49 -0.54 -1.89 0.00 0.00 176.35 174.26 1ie5 s LYS 103 N 0.69 2.81 0.32 1.98 -0.14 -0.67 -1.28 119.74 123.45 1ie5 s LYS 103 Ca 0.17 -2.17 -0.28 0.00 -1.36 0.00 0.00 55.97 52.33 1ie5 s LYS 103 Cb -0.23 -4.01 -0.09 0.00 -1.68 0.00 0.00 37.83 31.81 1ie5 s LYS 103 CO -0.02 -1.22 1.12 0.08 -0.76 0.00 0.00 175.35 174.56 1ie5 s VAL 104 N 0.64 3.40 0.04 3.17 1.01 -1.26 -3.99 120.40 123.40 1ie5 s VAL 104 Ca 0.12 1.33 0.08 0.00 0.00 0.00 0.00 61.98 63.51 1ie5 s VAL 104 Cb -0.20 -3.81 -0.03 0.00 0.00 0.00 0.00 36.38 32.33 1ie5 s VAL 104 CO -0.04 0.26 -0.21 0.72 0.00 0.00 0.00 175.10 175.83 1ie5 s PHE 105 N -1.26 2.48 -0.69 5.22 -0.12 -0.15 -4.93 117.98 118.53 1ie5 s PHE 105 Ca 0.48 -0.31 -0.02 0.00 -0.05 0.00 0.00 56.93 57.03 1ie5 s PHE 105 Cb -0.31 -1.45 0.30 0.00 -0.63 0.00 0.00 43.02 40.93 1ie5 s PHE 105 CO 0.40 0.21 2.19 0.00 -0.05 0.00 0.00 175.22 177.97 1ie5 n ALA 106 N 1.67 6.38 -0.48 1.99 0.00 -1.26 -1.19 120.51 127.61 1ie5 n ALA 106 Ca -0.16 -3.59 0.00 0.00 0.00 0.00 0.00 53.44 49.69 1ie5 n ALA 106 Cb 0.52 -1.94 0.00 0.00 0.00 0.00 0.00 19.45 18.03 1ie5 n ALA 106 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13