#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bq5 n SER 2 N 0.00 0.00 -0.07 0.00 2.88 -1.26 -4.99 113.62 110.19 2bq5 n SER 2 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 2bq5 n SER 2 Cb 0.00 0.00 0.35 0.00 -0.75 0.00 0.00 64.21 63.81 2bq5 n SER 2 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2bq5 n ASN 3 N 0.00 0.57 -3.69 -3.46 0.23 -1.26 -4.58 115.26 103.07 2bq5 n ASN 3 Ca 0.00 -0.36 -0.43 0.00 -0.53 0.00 0.00 54.58 53.27 2bq5 n ASN 3 Cb 0.00 0.12 -0.04 0.00 -2.08 0.00 0.00 39.78 37.78 2bq5 n ASN 3 CO 0.00 0.00 0.00 0.33 -0.93 0.00 0.00 177.26 176.66 2bq5 n PHE 4 N -1.25 2.42 -4.49 -2.53 -0.00 -1.26 -4.85 117.46 105.50 2bq5 n PHE 4 Ca 0.08 -2.16 -0.25 0.00 -0.00 0.00 0.00 57.45 55.12 2bq5 n PHE 4 Cb 0.33 -1.99 -0.10 0.00 -0.00 0.00 0.00 39.48 37.72 2bq5 n PHE 4 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.76 177.71 2bq5 s THR 5 N 4.61 2.40 0.48 -2.13 -4.23 -1.26 -4.86 115.64 110.65 2bq5 s THR 5 Ca 0.55 -2.25 -0.15 0.00 -1.18 0.00 0.00 61.69 58.66 2bq5 s THR 5 Cb 0.14 -2.54 -0.08 0.00 1.34 0.00 0.00 72.50 71.36 2bq5 s THR 5 CO 0.06 -0.28 0.92 0.00 -0.54 0.00 0.00 174.62 174.78 2bq5 s GLN 6 N -3.58 3.91 0.24 3.99 -2.07 -1.26 -4.64 119.66 116.25 2bq5 s GLN 6 Ca 0.32 0.82 -0.08 0.00 -1.82 0.00 0.00 55.36 54.60 2bq5 s GLN 6 Cb -0.01 -2.21 -0.02 0.00 -1.09 0.00 0.00 33.01 29.68 2bq5 s GLN 6 CO 0.16 -0.19 0.36 -0.59 -1.32 0.00 0.00 175.29 173.72 2bq5 s PHE 7 N -2.52 0.66 -0.31 9.60 -0.71 -0.28 -4.99 117.98 119.44 2bq5 s PHE 7 Ca 0.57 -0.97 -0.19 0.00 -1.04 0.00 0.00 56.93 55.30 2bq5 s PHE 7 Cb -0.10 -0.07 -0.01 0.00 -1.21 0.00 0.00 43.02 41.62 2bq5 s PHE 7 CO 0.30 -0.88 0.54 0.54 -1.34 0.00 0.00 175.22 174.38 2bq5 s VAL 8 N -4.02 5.01 -0.05 -2.49 0.11 -1.26 -1.23 120.40 116.47 2bq5 s VAL 8 Ca 0.28 0.68 -0.19 0.00 -2.93 0.00 0.00 61.98 59.82 2bq5 s VAL 8 Cb 0.02 -3.92 -0.31 0.00 -1.53 0.00 0.00 36.38 30.64 2bq5 s VAL 8 CO 0.11 -0.08 0.81 0.25 -3.33 0.00 0.00 175.10 172.85 2bq5 h LEU 9 N 9.00 0.51 -7.71 2.54 5.85 -1.38 -3.44 115.31 120.69 2bq5 h LEU 9 Ca -0.28 -0.92 -0.62 0.00 0.84 0.00 0.00 57.88 56.90 2bq5 h LEU 9 Cb 1.13 -0.17 -0.38 0.00 0.37 0.00 0.00 40.66 41.62 2bq5 h LEU 9 CO 0.76 1.53 -0.79 -0.69 -0.34 0.00 0.00 178.44 178.90 2bq5 s VAL 10 N -2.47 1.66 -0.25 1.05 1.01 -0.85 -4.99 120.40 115.56 2bq5 s VAL 10 Ca -0.15 -1.24 -0.17 0.00 0.00 0.00 0.00 61.98 60.43 2bq5 s VAL 10 Cb 0.03 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 2bq5 s VAL 10 CO 0.83 -0.03 0.45 -0.62 0.00 0.00 0.00 175.10 175.73 2bq5 s ASP 11 N 1.35 6.39 -0.20 3.32 2.15 -1.26 -0.81 116.67 127.60 2bq5 s ASP 11 Ca -0.05 0.46 0.13 0.00 0.43 0.00 0.00 52.55 53.51 2bq5 s ASP 11 Cb -0.18 -2.25 0.43 0.00 -0.30 0.00 0.00 42.92 40.62 2bq5 s ASP 11 CO -0.06 -0.21 1.20 0.59 -0.17 0.00 0.00 175.17 176.52 2bq5 n ASN 12 N 5.21 2.25 -2.32 -0.34 3.02 -1.26 -5.00 115.26 116.82 2bq5 n ASN 12 Ca -0.06 -3.53 -0.03 0.00 -0.03 0.00 0.00 54.58 50.93 2bq5 n ASN 12 Cb 0.50 -0.46 0.00 0.00 -0.61 0.00 0.00 39.78 39.22 2bq5 n ASN 12 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bq5 n GLY 13 N -0.79 -0.96 4.95 7.41 0.00 -1.26 -4.10 105.19 110.43 2bq5 n GLY 13 Ca 0.22 0.47 0.00 0.00 0.00 0.00 0.00 46.02 46.71 2bq5 n GLY 13 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bq5 n GLY 14 N -0.82 0.18 3.35 -0.02 0.00 -1.26 -4.81 105.19 101.82 2bq5 n GLY 14 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 2bq5 n GLY 14 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2bq5 s THR 15 N 0.00 3.41 0.00 2.61 -4.23 -1.26 -4.35 115.64 111.83 2bq5 s THR 15 Ca 0.00 -0.50 0.00 0.00 -1.18 0.00 0.00 61.69 60.01 2bq5 s THR 15 Cb 0.00 -2.52 0.00 0.00 1.34 0.00 0.00 72.50 71.32 2bq5 s THR 15 CO 0.00 0.45 0.00 0.61 -0.54 0.00 0.00 174.62 175.14 2bq5 n GLY 16 N 4.37 0.59 3.72 3.99 0.00 -1.26 -4.70 105.19 111.90 2bq5 n GLY 16 Ca -0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 2bq5 n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2bq5 s ASP 17 N -2.81 6.50 -0.46 1.61 1.11 -1.26 -4.73 116.67 116.63 2bq5 s ASP 17 Ca 0.00 2.74 -0.22 0.00 0.18 0.00 0.00 52.55 55.25 2bq5 s ASP 17 Cb 0.00 -2.60 0.03 0.00 1.07 0.00 0.00 42.92 41.42 2bq5 s ASP 17 CO 0.00 -0.87 0.74 -0.69 1.18 0.00 0.00 175.17 175.53 2bq5 s VAL 18 N 0.95 4.70 -0.13 -1.27 1.01 0.01 -4.97 120.40 120.70 2bq5 s VAL 18 Ca 0.70 0.23 -0.03 0.00 0.00 0.00 0.00 61.98 62.88 2bq5 s VAL 18 Cb -0.46 -4.30 -0.03 0.00 0.00 0.00 0.00 36.38 31.59 2bq5 s VAL 18 CO 0.34 -0.72 -0.03 0.28 0.00 0.00 0.00 175.10 174.96 2bq5 s THR 19 N 3.14 3.96 -0.01 3.92 -1.32 -1.26 -0.90 115.64 123.17 2bq5 s THR 19 Ca 0.26 -0.35 0.05 0.00 -1.21 0.00 0.00 61.69 60.45 2bq5 s THR 19 Cb -0.13 -2.71 -0.03 0.00 -1.51 0.00 0.00 72.50 68.12 2bq5 s THR 19 CO 0.20 0.52 -0.15 -0.69 -2.21 0.00 0.00 174.62 172.29 2bq5 s VAL 20 N 0.01 2.97 0.17 5.08 1.01 -0.37 -4.37 120.40 124.90 2bq5 s VAL 20 Ca 0.01 -0.90 0.04 0.00 0.00 0.00 0.00 61.98 61.13 2bq5 s VAL 20 Cb -0.13 -2.20 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 2bq5 s VAL 20 CO 0.03 0.49 -0.07 0.00 0.00 0.00 0.00 175.10 175.55 2bq5 s ALA 21 N -0.81 1.50 0.09 5.51 0.00 -0.65 -1.12 121.76 126.29 2bq5 s ALA 21 Ca 0.13 -1.56 -0.32 0.00 0.00 0.00 0.00 51.96 50.21 2bq5 s ALA 21 Cb -0.11 0.19 -0.12 0.00 0.00 0.00 0.00 23.12 23.09 2bq5 s ALA 21 CO 0.03 -0.16 1.80 -2.30 0.00 0.00 0.00 175.76 175.13 2bq5 n PRO 22 N -0.24 2.56 0.00 0.00 -0.02 -1.26 -0.86 135.00 135.17 2bq5 n PRO 22 Ca -0.09 0.93 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 2bq5 n PRO 22 Cb 0.62 -2.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.30 2bq5 n PRO 22 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 2bq5 n SER 23 N 5.38 4.09 -3.63 2.55 3.41 0.16 -4.87 113.62 120.71 2bq5 n SER 23 Ca 0.19 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.74 2bq5 n SER 23 Cb 0.34 0.78 -0.06 0.00 -0.26 0.00 0.00 64.21 65.02 2bq5 n SER 23 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2bq5 s ASN 24 N -1.72 -0.21 -0.04 4.04 3.84 -1.13 -5.00 114.94 114.72 2bq5 s ASN 24 Ca 0.00 0.35 0.06 0.00 0.21 0.00 0.00 52.86 53.48 2bq5 s ASN 24 Cb 0.00 0.34 0.10 0.00 -0.55 0.00 0.00 41.25 41.13 2bq5 s ASN 24 CO 0.00 -0.11 0.97 0.33 -2.79 0.00 0.00 177.10 175.50 2bq5 n PHE 25 N 1.41 0.00 -1.98 0.43 7.35 -1.26 0.32 117.46 123.73 2bq5 n PHE 25 Ca -0.09 -0.40 -0.41 0.00 -0.76 0.00 0.00 57.45 55.79 2bq5 n PHE 25 Cb 0.57 -0.07 -0.01 0.00 0.35 0.00 0.00 39.48 40.31 2bq5 n PHE 25 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 2bq5 s ALA 26 N -1.09 3.54 -1.31 3.13 0.00 -1.26 -2.89 121.76 121.89 2bq5 s ALA 26 Ca 0.11 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.46 2bq5 s ALA 26 Cb 0.09 -3.54 0.00 0.00 0.00 0.00 0.00 23.12 19.67 2bq5 s ALA 26 CO 0.01 -0.81 0.00 0.09 0.00 0.00 0.00 175.76 175.05 2bq5 n ASN 27 N 0.85 -4.42 0.00 0.00 3.02 -1.26 -3.18 115.26 110.27 2bq5 n ASN 27 Ca 0.01 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.78 2bq5 n ASN 27 Cb 0.41 -3.25 0.00 0.00 -0.61 0.00 0.00 39.78 36.33 2bq5 n ASN 27 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2bq5 n GLY 28 N -1.26 0.50 3.28 7.41 0.00 -1.14 -5.00 105.19 108.97 2bq5 n GLY 28 Ca -0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.53 2bq5 n GLY 28 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bq5 s VAL 29 N -2.18 3.22 0.11 1.61 1.01 -1.19 -4.73 120.40 118.25 2bq5 s VAL 29 Ca 0.00 -0.64 -0.30 0.00 0.00 0.00 0.00 61.98 61.04 2bq5 s VAL 29 Cb 0.00 -2.50 -0.06 0.00 0.00 0.00 0.00 36.38 33.82 2bq5 s VAL 29 CO 0.00 0.37 1.05 0.00 0.00 0.00 0.00 175.10 176.51 2bq5 s ALA 30 N 1.44 3.30 -0.02 5.51 0.00 0.06 -4.06 121.76 127.98 2bq5 s ALA 30 Ca 0.05 0.69 0.04 0.00 0.00 0.00 0.00 51.96 52.74 2bq5 s ALA 30 Cb -0.15 -3.34 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 2bq5 s ALA 30 CO -0.04 -0.18 -0.14 -2.00 0.00 0.00 0.00 175.76 173.41 2bq5 s GLU 31 N 0.18 1.23 -0.01 0.00 2.12 0.15 -1.05 118.70 121.32 2bq5 s GLU 31 Ca 0.50 -0.48 0.04 0.00 0.36 0.00 0.00 54.97 55.40 2bq5 s GLU 31 Cb -0.26 -1.15 -0.01 0.00 0.26 0.00 0.00 34.13 32.97 2bq5 s GLU 31 CO 0.31 0.24 -0.14 -1.58 -0.54 0.00 0.00 175.26 173.56 2bq5 s TRP 32 N -0.13 1.25 0.08 5.30 0.51 0.34 0.37 118.94 126.67 2bq5 s TRP 32 Ca 0.01 -0.25 -0.05 0.00 -2.12 0.00 0.00 56.10 53.69 2bq5 s TRP 32 Cb -0.07 -0.81 -0.02 0.00 -0.81 0.00 0.00 33.47 31.75 2bq5 s TRP 32 CO 0.00 -0.04 0.10 0.96 -0.51 0.00 0.00 176.95 177.46 2bq5 s ILE 33 N -0.27 0.17 1.01 2.03 -0.00 -0.04 -0.71 121.20 123.40 2bq5 s ILE 33 Ca 0.04 -1.49 -0.17 0.00 -0.00 0.00 0.00 60.65 59.03 2bq5 s ILE 33 Cb -0.06 -1.48 0.24 0.00 -0.00 0.00 0.00 42.46 41.16 2bq5 s ILE 33 CO -0.00 -0.77 1.14 -1.54 -0.00 0.00 0.00 174.94 173.77 2bq5 n SER 34 N -0.00 -0.82 -1.52 4.36 3.41 -0.82 -1.64 113.62 116.59 2bq5 n SER 34 Ca -0.14 -1.31 -0.08 0.00 -0.26 0.00 0.00 58.87 57.08 2bq5 n SER 34 Cb 0.62 -0.94 0.12 0.00 -0.26 0.00 0.00 64.21 63.74 2bq5 n SER 34 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2bq5 n SER 35 N -4.21 3.38 -2.40 4.04 7.64 -1.26 -4.75 113.62 116.05 2bq5 n SER 35 Ca 0.15 -2.73 -0.04 0.00 1.01 0.00 0.00 58.87 57.27 2bq5 n SER 35 Cb 0.54 -0.65 0.02 0.00 -1.01 0.00 0.00 64.21 63.11 2bq5 n SER 35 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 2bq5 n ASN 36 N -0.18 0.22 -4.77 6.43 4.13 -1.26 -5.05 115.26 114.78 2bq5 n ASN 36 Ca 0.26 -1.18 -0.32 0.00 1.68 0.00 0.00 54.58 55.02 2bq5 n ASN 36 Cb 1.01 -0.10 0.06 0.00 -1.54 0.00 0.00 39.78 39.21 2bq5 n ASN 36 CO 0.00 0.00 0.00 -0.94 0.28 0.00 0.00 177.26 176.60 2bq5 s SER 37 N -1.64 4.95 0.45 6.41 1.04 -1.26 -4.72 113.70 118.93 2bq5 s SER 37 Ca 0.10 1.93 0.18 0.00 0.48 0.00 0.00 55.95 58.64 2bq5 s SER 37 Cb -0.01 -2.54 1.13 0.00 0.10 0.00 0.00 66.02 64.71 2bq5 s SER 37 CO 0.07 -1.74 1.93 -0.09 0.98 0.00 0.00 173.24 174.39 2bq5 h ARG 38 N -0.34 0.31 0.00 4.02 9.65 -1.96 -0.59 114.38 125.48 2bq5 h ARG 38 Ca -0.46 -0.02 0.00 0.00 -1.10 0.00 0.00 59.98 58.40 2bq5 h ARG 38 Cb 1.24 -0.07 0.00 0.00 -1.39 0.00 0.00 29.97 29.75 2bq5 h ARG 38 CO 0.53 0.21 0.00 0.66 2.80 0.00 0.00 179.97 184.17 2bq5 h SER 39 N 0.32 0.00 0.00 -3.80 4.64 -1.89 -3.21 113.55 109.61 2bq5 h SER 39 Ca 0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.67 2bq5 h SER 39 Cb 0.92 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 2bq5 h SER 39 CO -0.10 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.86 2bq5 n GLN 40 N -2.40 -0.42 -1.26 4.77 6.02 -0.32 -3.76 117.38 120.00 2bq5 n GLN 40 Ca 0.02 -0.58 -0.32 0.00 -0.01 0.00 0.00 57.00 56.12 2bq5 n GLN 40 Cb 0.28 -0.95 0.10 0.00 1.02 0.00 0.00 30.24 30.68 2bq5 n GLN 40 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2bq5 s ALA 41 N -0.12 2.16 0.20 -1.58 0.00 -0.65 -4.84 121.76 116.92 2bq5 s ALA 41 Ca 0.00 0.40 -0.09 0.00 0.00 0.00 0.00 51.96 52.27 2bq5 s ALA 41 Cb 0.00 -3.32 -0.07 0.00 0.00 0.00 0.00 23.12 19.73 2bq5 s ALA 41 CO 0.00 -1.85 0.51 0.71 0.00 0.00 0.00 175.76 175.13 2bq5 s TYR 42 N -2.72 3.46 0.01 0.00 1.51 -1.26 -4.63 117.35 113.73 2bq5 s TYR 42 Ca 0.64 0.83 0.01 0.00 -1.01 0.00 0.00 57.07 57.54 2bq5 s TYR 42 Cb -0.19 -2.22 -0.01 0.00 -0.11 0.00 0.00 41.96 39.43 2bq5 s TYR 42 CO 0.53 0.33 -0.05 0.21 -1.11 0.00 0.00 175.55 175.47 2bq5 s LYS 43 N -2.64 0.38 -0.05 -0.62 2.20 -1.07 -1.95 119.74 115.99 2bq5 s LYS 43 Ca 0.44 -0.35 -0.00 0.00 -0.36 0.00 0.00 55.97 55.70 2bq5 s LYS 43 Cb -0.12 -0.27 0.03 0.00 -1.51 0.00 0.00 37.83 35.96 2bq5 s LYS 43 CO 0.21 0.06 -0.01 0.08 -0.36 0.00 0.00 175.35 175.34 2bq5 s VAL 44 N -0.56 0.30 0.04 4.02 1.01 0.11 -0.31 120.40 125.01 2bq5 s VAL 44 Ca -0.03 0.08 0.05 0.00 0.00 0.00 0.00 61.98 62.08 2bq5 s VAL 44 Cb -0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 36.38 35.90 2bq5 s VAL 44 CO -0.00 0.20 -0.16 0.42 0.00 0.00 0.00 175.10 175.56 2bq5 s THR 45 N 1.39 1.25 -0.02 3.92 -4.23 0.56 -0.50 115.64 118.01 2bq5 s THR 45 Ca -0.04 -1.03 -0.11 0.00 -1.18 0.00 0.00 61.69 59.33 2bq5 s THR 45 Cb -0.13 -1.12 0.01 0.00 1.34 0.00 0.00 72.50 72.60 2bq5 s THR 45 CO -0.02 0.07 0.23 0.00 -0.54 0.00 0.00 174.62 174.36 2bq5 s SER 47 N -1.17 -0.50 0.08 0.00 1.04 -0.91 -0.76 113.70 111.47 2bq5 s SER 47 Ca -0.12 0.31 0.05 0.00 0.48 0.00 0.00 55.95 56.67 2bq5 s SER 47 Cb -0.06 0.46 -0.03 0.00 0.10 0.00 0.00 66.02 66.49 2bq5 s SER 47 CO 0.03 -0.63 -0.13 -0.69 0.98 0.00 0.00 173.24 172.79 2bq5 s VAL 48 N -2.22 1.09 -0.01 5.02 1.01 -1.26 -0.15 120.40 123.88 2bq5 s VAL 48 Ca -0.02 -1.37 -0.13 0.00 0.00 0.00 0.00 61.98 60.46 2bq5 s VAL 48 Cb -0.01 -1.12 0.02 0.00 0.00 0.00 0.00 36.38 35.27 2bq5 s VAL 48 CO -0.02 -0.28 0.28 0.00 0.00 0.00 0.00 175.10 175.07 2bq5 s ARG 49 N -1.92 0.64 -1.41 2.72 1.70 -0.95 -4.96 118.95 114.76 2bq5 s ARG 49 Ca -0.01 -0.25 -0.07 0.00 -0.47 0.00 0.00 55.73 54.93 2bq5 s ARG 49 Cb -0.09 0.28 0.06 0.00 -0.57 0.00 0.00 34.95 34.63 2bq5 s ARG 49 CO 0.02 -0.17 2.52 0.94 -1.08 0.00 0.00 175.30 177.53 2bq5 n GLN 50 N 1.27 4.23 0.00 3.89 -0.06 -1.26 -0.01 117.38 125.44 2bq5 n GLN 50 Ca -0.22 -3.07 0.00 0.00 -2.00 0.00 0.00 57.00 51.71 2bq5 n GLN 50 Cb 0.56 -2.72 0.00 0.00 -4.06 0.00 0.00 30.24 24.02 2bq5 n GLN 50 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 2bq5 n SER 51 N 2.53 0.00 -3.72 1.69 3.41 -1.16 -4.70 113.62 111.66 2bq5 n SER 51 Ca 0.66 0.09 -0.30 0.00 -0.26 0.00 0.00 58.87 59.06 2bq5 n SER 51 Cb 0.25 0.00 0.28 0.00 -0.26 0.00 0.00 64.21 64.48 2bq5 n SER 51 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 2bq5 s SER 52 N -2.97 -0.51 0.00 4.04 0.15 -1.24 -4.83 113.70 108.34 2bq5 s SER 52 Ca 0.00 1.01 0.25 0.00 0.70 0.00 0.00 55.95 57.90 2bq5 s SER 52 Cb 0.00 -1.47 1.30 0.00 -1.71 0.00 0.00 66.02 64.14 2bq5 s SER 52 CO 0.00 -5.05 1.84 0.00 1.20 0.00 0.00 173.24 171.23 2bq5 n ALA 53 N -5.43 2.29 -2.08 5.45 0.00 -1.26 -3.77 120.51 115.70 2bq5 n ALA 53 Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2bq5 n ALA 53 Cb 0.59 -1.40 -0.00 0.00 0.00 0.00 0.00 19.45 18.63 2bq5 n ALA 53 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2bq5 n GLN 54 N -1.23 0.00 -4.20 0.00 6.02 -1.26 -5.07 117.38 111.63 2bq5 n GLN 54 Ca 0.13 -0.90 -0.12 0.00 -0.01 0.00 0.00 57.00 56.10 2bq5 n GLN 54 Cb 0.18 -0.19 -0.10 0.00 1.02 0.00 0.00 30.24 31.15 2bq5 n GLN 54 CO 0.00 0.00 0.00 -0.80 -1.01 0.00 0.00 177.06 175.25 2bq5 s ASN 55 N -0.90 1.42 0.04 1.08 0.02 -1.25 -2.12 114.94 113.23 2bq5 s ASN 55 Ca 0.06 -0.98 0.07 0.00 -1.02 0.00 0.00 52.86 50.98 2bq5 s ASN 55 Cb 0.06 0.05 -0.02 0.00 0.02 0.00 0.00 41.25 41.36 2bq5 s ASN 55 CO -0.03 -0.39 -0.19 -0.13 0.02 0.00 0.00 177.10 176.38 2bq5 s ARG 56 N -3.67 1.33 -0.18 -0.60 0.52 -0.79 -3.00 118.95 112.56 2bq5 s ARG 56 Ca 0.13 -0.88 -0.01 0.00 -0.52 0.00 0.00 55.73 54.44 2bq5 s ARG 56 Cb 0.03 -1.41 0.05 0.00 0.52 0.00 0.00 34.95 34.14 2bq5 s ARG 56 CO -0.02 0.36 -0.02 0.21 0.02 0.00 0.00 175.30 175.86 2bq5 s LYS 57 N -1.09 1.10 0.01 3.54 2.47 0.98 -1.35 119.74 125.41 2bq5 s LYS 57 Ca 0.07 -0.51 -0.24 0.00 -1.56 0.00 0.00 55.97 53.73 2bq5 s LYS 57 Cb -0.08 -2.06 -0.05 0.00 -1.46 0.00 0.00 37.83 34.18 2bq5 s LYS 57 CO 0.01 -0.53 0.72 0.71 0.16 0.00 0.00 175.35 176.43 2bq5 s TYR 58 N 1.70 3.69 -0.31 4.03 1.51 0.57 -2.25 117.35 126.29 2bq5 s TYR 58 Ca -0.01 1.38 0.02 0.00 -1.01 0.00 0.00 57.07 57.45 2bq5 s TYR 58 Cb -0.16 -2.78 0.09 0.00 -0.11 0.00 0.00 41.96 38.99 2bq5 s TYR 58 CO -0.07 0.24 0.03 0.99 -1.11 0.00 0.00 175.55 175.62 2bq5 s THR 59 N 0.14 1.84 -0.04 -0.71 2.01 0.78 -1.43 115.64 118.23 2bq5 s THR 59 Ca 0.37 -1.88 0.01 0.00 0.31 0.00 0.00 61.69 60.51 2bq5 s THR 59 Cb -0.19 -2.27 -0.03 0.00 0.01 0.00 0.00 72.50 70.01 2bq5 s THR 59 CO 0.21 -0.47 -0.05 -0.63 -0.69 0.00 0.00 174.62 172.98 2bq5 s ILE 60 N 1.16 3.80 -0.01 1.82 1.01 -0.70 -2.14 121.20 126.15 2bq5 s ILE 60 Ca 0.06 -0.56 -0.00 0.00 0.00 0.00 0.00 60.65 60.14 2bq5 s ILE 60 Cb -0.19 -2.60 0.01 0.00 0.01 0.00 0.00 42.46 39.69 2bq5 s ILE 60 CO -0.11 0.51 0.01 -0.75 0.00 0.00 0.00 174.94 174.60 2bq5 s LYS 61 N -1.09 0.00 -0.03 2.79 2.36 0.77 -1.09 119.74 123.45 2bq5 s LYS 61 Ca 0.15 0.05 0.02 0.00 -2.55 0.00 0.00 55.97 53.63 2bq5 s LYS 61 Cb -0.11 -0.04 0.01 0.00 -1.05 0.00 0.00 37.83 36.64 2bq5 s LYS 61 CO 0.04 -0.03 -0.08 0.08 1.55 0.00 0.00 175.35 176.91 2bq5 s VAL 62 N 0.20 0.75 -0.20 4.02 1.01 0.43 -0.32 120.40 126.28 2bq5 s VAL 62 Ca -0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 61.98 61.63 2bq5 s VAL 62 Cb -0.02 -0.69 0.01 0.00 0.00 0.00 0.00 36.38 35.68 2bq5 s VAL 62 CO -0.01 0.25 -0.13 -1.61 0.00 0.00 0.00 175.10 173.60 2bq5 s GLU 63 N 0.34 3.08 -0.33 2.72 2.02 0.57 -0.98 118.70 126.12 2bq5 s GLU 63 Ca -0.05 -0.79 -0.07 0.00 0.02 0.00 0.00 54.97 54.08 2bq5 s GLU 63 Cb -0.10 -2.78 0.03 0.00 0.10 0.00 0.00 34.13 31.38 2bq5 s GLU 63 CO 0.01 -0.24 0.10 0.08 0.02 0.00 0.00 175.26 175.23 2bq5 s VAL 64 N 1.35 3.85 0.29 2.63 1.01 -0.08 -2.61 120.40 126.84 2bq5 s VAL 64 Ca 0.04 -1.05 -0.12 0.00 0.00 0.00 0.00 61.98 60.85 2bq5 s VAL 64 Cb -0.14 -3.14 -0.08 0.00 0.00 0.00 0.00 36.38 33.01 2bq5 s VAL 64 CO -0.08 -0.14 0.65 -2.16 0.00 0.00 0.00 175.10 173.37 2bq5 s PRO 65 N 1.43 3.90 -0.91 2.72 0.04 -1.26 -0.38 135.00 140.54 2bq5 s PRO 65 Ca -0.01 0.48 -0.04 0.00 0.04 0.00 0.00 61.00 61.47 2bq5 s PRO 65 Cb -0.19 -2.52 0.23 0.00 0.04 0.00 0.00 34.50 32.05 2bq5 s PRO 65 CO 0.03 0.22 0.81 0.21 0.04 0.00 0.00 177.00 178.30 2bq5 s LYS 66 N -2.96 3.41 0.34 4.56 2.47 -0.23 -4.98 119.74 122.34 2bq5 s LYS 66 Ca 0.51 -3.14 -0.27 0.00 -1.56 0.00 0.00 55.97 51.51 2bq5 s LYS 66 Cb -0.11 -4.08 -0.13 0.00 -1.46 0.00 0.00 37.83 32.06 2bq5 s LYS 66 CO 0.20 -1.25 1.01 1.33 0.16 0.00 0.00 175.35 176.80 2bq5 n VAL 67 N 2.62 2.11 -3.50 4.02 0.24 -1.26 0.18 118.33 122.73 2bq5 n VAL 67 Ca 0.20 -0.50 -0.10 0.00 -2.04 0.00 0.00 64.34 61.90 2bq5 n VAL 67 Cb 0.38 -1.07 -0.03 0.00 -1.47 0.00 0.00 33.84 31.65 2bq5 n VAL 67 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2bq5 s ALA 68 N -1.15 -1.81 -0.29 2.33 0.00 0.13 -4.68 121.76 116.29 2bq5 s ALA 68 Ca 0.60 1.05 -0.08 0.00 0.00 0.00 0.00 51.96 53.52 2bq5 s ALA 68 Cb -0.64 0.30 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 2bq5 s ALA 68 CO 0.59 -0.63 0.12 0.99 0.00 0.00 0.00 175.76 176.83 2bq5 s THR 69 N -2.82 4.39 -0.11 0.00 2.01 -1.26 -1.24 115.64 116.60 2bq5 s THR 69 Ca 0.03 -0.43 -0.04 0.00 0.31 0.00 0.00 61.69 61.56 2bq5 s THR 69 Cb -0.01 -3.20 -0.04 0.00 0.01 0.00 0.00 72.50 69.26 2bq5 s THR 69 CO -0.07 0.13 0.05 -1.58 -0.69 0.00 0.00 174.62 172.46 2bq5 s GLN 70 N 1.59 3.31 -0.59 4.92 0.74 -0.39 -4.89 119.66 124.34 2bq5 s GLN 70 Ca 0.05 -0.32 -0.19 0.00 0.05 0.00 0.00 55.36 54.94 2bq5 s GLN 70 Cb -0.17 -2.98 0.09 0.00 1.10 0.00 0.00 33.01 31.05 2bq5 s GLN 70 CO 0.05 0.64 0.72 0.99 -0.55 0.00 0.00 175.29 177.13 2bq5 s THR 71 N -0.67 4.78 -0.38 -0.34 2.01 -1.26 -0.24 115.64 119.54 2bq5 s THR 71 Ca 0.11 -0.87 -0.07 0.00 0.31 0.00 0.00 61.69 61.17 2bq5 s THR 71 Cb -0.12 -4.48 0.06 0.00 0.01 0.00 0.00 72.50 67.97 2bq5 s THR 71 CO 0.02 -1.11 0.18 -0.69 -0.69 0.00 0.00 174.62 172.33 2bq5 s VAL 72 N 2.81 3.96 -0.67 3.82 1.01 0.10 -4.58 120.40 126.84 2bq5 s VAL 72 Ca 0.13 -1.31 -0.03 0.00 0.00 0.00 0.00 61.98 60.77 2bq5 s VAL 72 Cb -0.23 -3.36 0.00 0.00 0.00 0.00 0.00 36.38 32.80 2bq5 s VAL 72 CO 0.07 -0.36 0.58 0.61 0.00 0.00 0.00 175.10 176.00 2bq5 n GLY 73 N 4.85 0.15 3.21 4.51 0.00 -1.26 -3.01 105.19 113.63 2bq5 n GLY 73 Ca -0.10 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2bq5 n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bq5 n GLY 74 N -1.22 1.20 3.29 -0.02 0.00 -1.26 -4.99 105.19 102.19 2bq5 n GLY 74 Ca -0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 2bq5 n GLY 74 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2bq5 s VAL 75 N -3.30 1.97 0.01 1.61 1.01 -1.16 -5.11 120.40 115.43 2bq5 s VAL 75 Ca 0.00 -1.06 -0.19 0.00 0.00 0.00 0.00 61.98 60.73 2bq5 s VAL 75 Cb 0.00 -1.64 -0.06 0.00 0.00 0.00 0.00 36.38 34.68 2bq5 s VAL 75 CO 0.00 0.56 0.54 -1.61 0.00 0.00 0.00 175.10 174.58 2bq5 s GLU 76 N -0.52 4.21 0.03 2.72 2.02 -1.26 0.00 118.70 125.90 2bq5 s GLU 76 Ca 0.08 0.64 0.04 0.00 0.02 0.00 0.00 54.97 55.75 2bq5 s GLU 76 Cb -0.10 -3.29 -0.02 0.00 0.10 0.00 0.00 34.13 30.81 2bq5 s GLU 76 CO -0.00 0.50 -0.12 -0.51 0.02 0.00 0.00 175.26 175.14 2bq5 s LEU 77 N -0.58 2.16 0.01 1.80 1.43 0.67 -4.95 118.68 119.22 2bq5 s LEU 77 Ca 0.28 -0.43 -0.30 0.00 -1.03 0.00 0.00 54.13 52.65 2bq5 s LEU 77 Cb -0.18 -0.50 -0.04 0.00 0.03 0.00 0.00 46.19 45.50 2bq5 s LEU 77 CO 0.16 0.00 1.05 -2.16 0.23 0.00 0.00 176.35 175.63 2bq5 s PRO 78 N -1.08 4.51 0.35 1.29 0.04 -1.26 -1.27 135.00 137.58 2bq5 s PRO 78 Ca -0.00 1.52 -0.14 0.00 0.04 0.00 0.00 61.00 62.42 2bq5 s PRO 78 Cb -0.07 -3.44 0.04 0.00 0.04 0.00 0.00 34.50 31.07 2bq5 s PRO 78 CO 0.01 -0.13 0.71 0.54 0.04 0.00 0.00 177.00 178.17 2bq5 s VAL 79 N 1.11 0.00 -0.21 -0.36 0.11 -0.38 -4.77 120.40 115.91 2bq5 s VAL 79 Ca 0.54 -1.12 -0.05 0.00 -2.93 0.00 0.00 61.98 58.41 2bq5 s VAL 79 Cb -0.23 -2.66 -0.02 0.00 -1.53 0.00 0.00 36.38 31.94 2bq5 s VAL 79 CO 0.28 0.00 -0.00 0.00 -3.33 0.00 0.00 175.10 172.04 2bq5 s ALA 80 N -2.80 3.00 0.39 1.54 0.00 -1.25 0.19 121.76 122.83 2bq5 s ALA 80 Ca 0.18 -1.04 0.07 0.00 0.00 0.00 0.00 51.96 51.17 2bq5 s ALA 80 Cb -0.04 -1.79 0.81 0.00 0.00 0.00 0.00 23.12 22.10 2bq5 s ALA 80 CO 0.12 -0.24 2.01 0.00 0.00 0.00 0.00 175.76 177.66 2bq5 h ALA 81 N 7.68 1.72 -1.95 0.00 0.00 -0.54 -3.45 119.26 122.71 2bq5 h ALA 81 Ca -0.37 -0.03 0.21 0.00 0.00 0.00 0.00 54.91 54.72 2bq5 h ALA 81 Cb 1.18 -0.18 -0.13 0.00 0.00 0.00 0.00 17.79 18.66 2bq5 h ALA 81 CO 0.60 0.21 0.63 1.67 0.00 0.00 0.00 179.25 182.37 2bq5 s TRP 82 N -5.57 -0.17 0.12 0.00 1.48 -1.26 -5.03 118.94 108.52 2bq5 s TRP 82 Ca -0.09 0.00 0.07 0.00 -1.06 0.00 0.00 56.10 55.02 2bq5 s TRP 82 Cb 0.18 0.57 -0.04 0.00 -1.16 0.00 0.00 33.47 33.02 2bq5 s TRP 82 CO 0.75 -0.51 -0.16 1.03 -4.06 0.00 0.00 176.95 174.01 2bq5 s ARG 83 N -2.88 1.08 -0.16 3.25 0.52 -1.26 -1.07 118.95 118.43 2bq5 s ARG 83 Ca 0.10 -1.24 -0.03 0.00 -0.52 0.00 0.00 55.73 54.04 2bq5 s ARG 83 Cb 0.00 -1.06 -0.02 0.00 0.52 0.00 0.00 34.95 34.39 2bq5 s ARG 83 CO -0.03 0.22 -0.05 0.45 0.02 0.00 0.00 175.30 175.90 2bq5 s SER 84 N -2.36 4.66 -0.14 0.23 0.15 0.49 -4.96 113.70 111.77 2bq5 s SER 84 Ca 0.09 -0.17 -0.01 0.00 0.70 0.00 0.00 55.95 56.56 2bq5 s SER 84 Cb -0.06 -1.76 -0.01 0.00 -1.71 0.00 0.00 66.02 62.48 2bq5 s SER 84 CO 0.04 0.16 -0.12 -0.31 1.20 0.00 0.00 173.24 174.21 2bq5 s TYR 85 N 0.43 2.84 -0.16 3.44 1.51 -1.26 -0.90 117.35 123.25 2bq5 s TYR 85 Ca -0.05 -0.69 0.00 0.00 -1.01 0.00 0.00 57.07 55.33 2bq5 s TYR 85 Cb -0.14 -1.88 0.00 0.00 -0.11 0.00 0.00 41.96 39.83 2bq5 s TYR 85 CO 0.03 -0.26 -0.15 -1.17 -1.11 0.00 0.00 175.55 172.89 2bq5 s LEU 86 N 0.50 2.44 -0.04 -1.29 2.96 -0.15 -5.01 118.68 118.09 2bq5 s LEU 86 Ca -0.08 -0.49 0.02 0.00 -0.22 0.00 0.00 54.13 53.36 2bq5 s LEU 86 Cb -0.16 -1.56 0.01 0.00 0.50 0.00 0.00 46.19 44.99 2bq5 s LEU 86 CO 0.04 0.07 -0.09 0.00 -1.32 0.00 0.00 176.35 175.05 2bq5 s ALA 87 N 0.90 0.93 0.02 5.97 0.00 -1.26 -0.43 121.76 127.89 2bq5 s ALA 87 Ca -0.04 -0.26 0.02 0.00 0.00 0.00 0.00 51.96 51.68 2bq5 s ALA 87 Cb -0.15 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.52 2bq5 s ALA 87 CO -0.02 0.09 -0.06 0.00 0.00 0.00 0.00 175.76 175.76 2bq5 s MET 88 N 0.58 0.47 -0.08 0.00 0.23 -0.25 -5.03 119.30 115.23 2bq5 s MET 88 Ca -0.10 -0.47 0.03 0.00 -1.03 0.00 0.00 55.69 54.12 2bq5 s MET 88 Cb -0.13 -0.35 0.01 0.00 -1.53 0.00 0.00 34.83 32.83 2bq5 s MET 88 CO 0.02 0.08 -0.18 0.21 -2.03 0.00 0.00 175.02 173.11 2bq5 s LYS 89 N -0.86 2.42 -0.14 3.16 2.20 -1.26 -1.71 119.74 123.54 2bq5 s LYS 89 Ca -0.04 -0.66 0.00 0.00 -0.36 0.00 0.00 55.97 54.91 2bq5 s LYS 89 Cb -0.06 -1.88 0.02 0.00 -1.51 0.00 0.00 37.83 34.40 2bq5 s LYS 89 CO 0.00 0.11 -0.11 -1.17 -0.36 0.00 0.00 175.35 173.81 2bq5 s LEU 90 N 0.50 1.53 -0.21 5.43 2.96 -0.51 -4.99 118.68 123.39 2bq5 s LEU 90 Ca -0.17 -0.45 -0.04 0.00 -0.22 0.00 0.00 54.13 53.26 2bq5 s LEU 90 Cb -0.17 -1.05 -0.01 0.00 0.50 0.00 0.00 46.19 45.46 2bq5 s LEU 90 CO 0.06 -0.09 -0.05 -0.89 -1.32 0.00 0.00 176.35 174.07 2bq5 s THR 91 N 1.57 3.38 -0.16 3.68 2.01 -1.26 -0.32 115.64 124.53 2bq5 s THR 91 Ca 0.05 -0.49 0.01 0.00 0.31 0.00 0.00 61.69 61.56 2bq5 s THR 91 Cb -0.13 -2.53 0.02 0.00 0.01 0.00 0.00 72.50 69.87 2bq5 s THR 91 CO -0.10 0.43 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.45 2bq5 s ILE 92 N 1.37 1.88 0.39 1.82 1.01 -0.45 -4.95 121.20 122.26 2bq5 s ILE 92 Ca 0.04 -0.83 -0.26 0.00 0.00 0.00 0.00 60.65 59.60 2bq5 s ILE 92 Cb -0.14 -1.71 -0.11 0.00 0.01 0.00 0.00 42.46 40.51 2bq5 s ILE 92 CO -0.02 0.51 1.32 -0.81 0.00 0.00 0.00 174.94 175.93 2bq5 n PRO 93 N 4.60 2.11 0.24 2.79 -0.04 -1.26 -1.88 135.00 141.56 2bq5 n PRO 93 Ca -0.19 0.74 0.18 0.00 -0.04 0.00 0.00 63.50 64.19 2bq5 n PRO 93 Cb 0.50 -2.42 0.85 0.00 -0.04 0.00 0.00 33.50 32.39 2bq5 n PRO 93 CO 0.00 0.00 0.00 -0.84 -0.04 0.00 0.00 175.50 174.62 2bq5 h ILE 94 N 2.35 0.22 0.00 0.52 3.07 -1.76 -0.97 117.51 120.94 2bq5 h ILE 94 Ca -0.48 0.00 0.00 0.00 1.55 0.00 0.00 64.86 65.93 2bq5 h ILE 94 Cb 1.28 0.75 0.00 0.00 -0.27 0.00 0.00 36.82 38.58 2bq5 h ILE 94 CO 0.61 0.00 0.00 0.49 -1.05 0.00 0.00 178.15 178.20 2bq5 n PHE 95 N -3.36 0.00 -2.11 0.16 3.72 -1.26 -4.81 117.46 109.79 2bq5 n PHE 95 Ca 0.01 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.99 2bq5 n PHE 95 Cb 0.39 -0.47 -0.03 0.00 -0.94 0.00 0.00 39.48 38.43 2bq5 n PHE 95 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2bq5 s ALA 96 N -2.93 3.63 0.88 4.37 0.00 -0.37 -5.01 121.76 122.34 2bq5 s ALA 96 Ca 0.12 1.14 -0.12 0.00 0.00 0.00 0.00 51.96 53.10 2bq5 s ALA 96 Cb 0.14 -3.58 0.16 0.00 0.00 0.00 0.00 23.12 19.85 2bq5 s ALA 96 CO 0.39 -0.73 1.23 0.99 0.00 0.00 0.00 175.76 177.64 2bq5 s THR 97 N 1.44 2.04 0.17 0.00 2.01 -1.26 -4.84 115.64 115.21 2bq5 s THR 97 Ca 0.66 -0.11 -0.07 0.00 0.31 0.00 0.00 61.69 62.48 2bq5 s THR 97 Cb -0.38 -2.93 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 2bq5 s THR 97 CO 0.30 0.00 1.50 0.78 -0.69 0.00 0.00 174.62 176.51 2bq5 h ASN 98 N -1.31 0.81 -0.45 3.53 2.35 -1.99 -0.34 115.58 118.17 2bq5 h ASN 98 Ca -0.43 -0.39 0.03 0.00 -0.55 0.00 0.00 56.30 54.96 2bq5 h ASN 98 Cb 1.26 -0.23 -0.04 0.00 0.05 0.00 0.00 38.32 39.36 2bq5 h ASN 98 CO 0.44 1.14 0.23 0.77 -1.65 0.00 0.00 177.43 178.36 2bq5 h SER 99 N 0.60 0.34 -0.21 5.81 4.64 -2.00 0.17 113.55 122.92 2bq5 h SER 99 Ca 0.04 0.02 0.02 0.00 -0.47 0.00 0.00 61.79 61.40 2bq5 h SER 99 Cb 1.01 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 63.04 2bq5 h SER 99 CO 0.10 0.24 0.08 0.44 -0.87 0.00 0.00 176.83 176.82 2bq5 h ASP 100 N 0.46 0.11 -0.86 4.97 3.32 -1.78 -2.79 116.42 119.85 2bq5 h ASP 100 Ca 0.19 0.02 -0.02 0.00 0.02 0.00 0.00 57.03 57.24 2bq5 h ASP 100 Cb 0.09 -0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.60 2bq5 h ASP 100 CO -0.13 0.09 0.48 0.00 -1.72 0.00 0.00 179.24 177.96 2bq5 h GLU 102 N 1.20 0.44 0.02 0.00 5.08 -0.77 -0.99 114.58 119.57 2bq5 h GLU 102 Ca 0.30 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2bq5 h GLU 102 Cb 0.02 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2bq5 h GLU 102 CO -0.05 0.29 -0.01 1.25 -1.00 0.00 0.00 179.01 179.49 2bq5 h LEU 103 N 0.46 -0.03 -0.42 1.33 5.85 -1.12 -0.67 115.31 120.70 2bq5 h LEU 103 Ca 0.18 -0.09 0.08 0.00 0.84 0.00 0.00 57.88 58.90 2bq5 h LEU 103 Cb 0.16 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.12 2bq5 h LEU 103 CO -0.05 0.07 -0.06 0.40 -0.34 0.00 0.00 178.44 178.47 2bq5 h ILE 104 N -0.12 0.62 0.06 4.05 2.04 -1.04 -0.39 117.51 122.73 2bq5 h ILE 104 Ca -0.00 -0.02 0.01 0.00 1.00 0.00 0.00 64.86 65.85 2bq5 h ILE 104 Cb 0.11 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 36.75 2bq5 h ILE 104 CO 0.01 0.01 -0.09 0.58 0.00 0.00 0.00 178.15 178.65 2bq5 h VAL 105 N 0.05 0.79 -0.90 1.67 2.07 -1.01 -1.52 116.25 117.39 2bq5 h VAL 105 Ca 0.21 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.81 2bq5 h VAL 105 Cb 0.31 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.80 2bq5 h VAL 105 CO -0.40 0.00 0.58 0.11 0.02 0.00 0.00 177.57 177.88 2bq5 h LYS 106 N -0.19 0.92 -0.73 1.57 1.57 -0.63 -1.34 116.57 117.74 2bq5 h LYS 106 Ca 0.02 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.68 2bq5 h LYS 106 Cb 0.20 -0.21 -0.03 0.00 0.08 0.00 0.00 32.23 32.27 2bq5 h LYS 106 CO -0.05 0.61 0.21 0.00 -0.57 0.00 0.00 179.45 179.65 2bq5 h ALA 107 N 1.54 0.95 -0.13 3.86 0.00 -0.56 -0.88 119.26 124.04 2bq5 h ALA 107 Ca 0.41 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 55.00 2bq5 h ALA 107 Cb 0.33 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2bq5 h ALA 107 CO -0.17 0.65 -0.31 0.52 0.00 0.00 0.00 179.25 179.94 2bq5 h MET 108 N 1.08 0.25 -0.20 0.00 2.86 -0.26 -1.42 114.93 117.23 2bq5 h MET 108 Ca 0.23 -0.09 -0.14 0.00 -2.06 0.00 0.00 59.70 57.64 2bq5 h MET 108 Cb 0.33 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2bq5 h MET 108 CO -0.00 0.54 -0.41 1.96 1.06 0.00 0.00 176.91 180.06 2bq5 h GLN 109 N 0.22 0.64 -0.58 1.72 4.20 -0.96 -3.03 115.11 117.31 2bq5 h GLN 109 Ca 0.03 -0.41 -0.02 0.00 0.06 0.00 0.00 58.65 58.31 2bq5 h GLN 109 Cb 0.66 0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.46 2bq5 h GLN 109 CO 0.05 1.03 0.27 0.78 -0.67 0.00 0.00 178.83 180.29 2bq5 h GLY 110 N 0.32 0.88 0.60 3.46 0.00 -0.89 -1.79 103.07 105.66 2bq5 h GLY 110 Ca 0.01 -0.41 0.09 0.00 0.00 0.00 0.00 47.33 47.01 2bq5 h GLY 110 CO 0.09 0.39 0.57 -2.00 0.00 0.00 0.00 176.54 175.60 2bq5 h LEU 111 N 0.82 0.87 -2.60 3.11 5.85 -1.15 -2.93 115.31 119.28 2bq5 h LEU 111 Ca 0.20 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.96 2bq5 h LEU 111 Cb 0.10 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 40.98 2bq5 h LEU 111 CO -0.03 0.51 0.00 0.18 -0.34 0.00 0.00 178.44 178.77 2bq5 n LEU 112 N -4.63 3.44 -4.76 2.25 4.77 -1.01 -4.24 117.00 112.83 2bq5 n LEU 112 Ca 0.15 -1.81 -0.41 0.00 -0.03 0.00 0.00 56.01 53.91 2bq5 n LEU 112 Cb 0.26 -0.33 -0.02 0.00 -2.33 0.00 0.00 43.42 41.00 2bq5 n LEU 112 CO 0.29 0.82 1.07 -0.75 -1.33 0.00 0.00 177.39 177.49 2bq5 s LYS 113 N -1.12 4.27 0.15 3.23 2.20 -0.70 -4.78 119.74 122.98 2bq5 s LYS 113 Ca 0.37 2.32 -0.34 0.00 -0.36 0.00 0.00 55.97 57.96 2bq5 s LYS 113 Cb 0.20 -3.07 -0.15 0.00 -1.51 0.00 0.00 37.83 33.30 2bq5 s LYS 113 CO 0.27 -0.37 1.38 -0.25 -0.36 0.00 0.00 175.35 176.03 2bq5 n ASP 114 N 1.55 2.17 0.00 1.43 8.00 -1.26 -1.61 116.55 126.83 2bq5 n ASP 114 Ca 0.04 1.12 0.00 0.00 0.71 0.00 0.00 54.79 56.65 2bq5 n ASP 114 Cb 0.40 -1.30 0.00 0.00 -0.02 0.00 0.00 41.12 40.21 2bq5 n ASP 114 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bq5 n GLY 115 N 2.62 2.95 3.77 0.44 0.00 -1.26 -5.07 105.19 108.64 2bq5 n GLY 115 Ca 0.16 -0.83 -0.36 0.00 0.00 0.00 0.00 46.02 44.99 2bq5 n GLY 115 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bq5 s ASN 116 N 0.04 5.59 0.12 1.61 0.01 -0.64 -4.85 114.94 116.82 2bq5 s ASN 116 Ca 0.00 2.27 -0.18 0.00 -0.71 0.00 0.00 52.86 54.24 2bq5 s ASN 116 Cb 0.00 -2.59 0.02 0.00 0.41 0.00 0.00 41.25 39.09 2bq5 s ASN 116 CO 0.00 -1.32 1.04 -2.65 -1.51 0.00 0.00 177.10 172.66 2bq5 n PRO 117 N -1.32 -0.25 0.43 -0.60 -0.02 -1.26 -2.56 135.00 129.42 2bq5 n PRO 117 Ca 0.12 1.02 -0.17 0.00 -2.02 0.00 0.00 63.50 62.45 2bq5 n PRO 117 Cb 0.50 -1.51 -0.08 0.00 -0.02 0.00 0.00 33.50 32.39 2bq5 n PRO 117 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 2bq5 h ILE 118 N 0.00 0.00 -0.15 4.25 2.04 -1.92 -0.96 117.51 120.77 2bq5 h ILE 118 Ca 0.15 -0.17 0.04 0.00 1.00 0.00 0.00 64.86 65.88 2bq5 h ILE 118 Cb 0.32 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 2bq5 h ILE 118 CO -0.64 0.00 0.14 1.55 0.00 0.00 0.00 178.15 179.20 2bq5 h PRO 119 N -1.27 0.00 0.55 2.37 0.13 -1.73 -0.94 132.00 131.12 2bq5 h PRO 119 Ca -0.11 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.99 2bq5 h PRO 119 Cb 0.84 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.98 2bq5 h PRO 119 CO 0.18 0.00 -0.27 0.77 -0.23 0.00 0.00 178.00 178.46 2bq5 h SER 120 N 0.00 -0.63 -0.35 1.44 0.02 -1.29 -2.15 113.55 110.59 2bq5 h SER 120 Ca 0.07 -0.03 0.01 0.00 -0.84 0.00 0.00 61.79 61.00 2bq5 h SER 120 Cb 0.35 0.16 -0.02 0.00 0.14 0.00 0.00 62.40 63.04 2bq5 h SER 120 CO -0.00 -0.36 0.21 0.00 -1.14 0.00 0.00 176.83 175.54 2bq5 h ALA 121 N -0.51 0.44 -0.25 3.77 0.00 -0.52 -3.02 119.26 119.17 2bq5 h ALA 121 Ca -0.08 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.89 2bq5 h ALA 121 Cb 0.62 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 18.23 2bq5 h ALA 121 CO 0.13 -0.13 -0.20 0.82 0.00 0.00 0.00 179.25 179.86 2bq5 h ILE 122 N 0.43 0.46 0.00 0.00 2.04 -1.13 -1.01 117.51 118.30 2bq5 h ILE 122 Ca 0.14 0.00 0.00 0.00 1.00 0.00 0.00 64.86 66.00 2bq5 h ILE 122 Cb -0.01 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 36.53 2bq5 h ILE 122 CO -0.06 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.09 2bq5 n ALA 123 N -2.75 2.38 -0.30 1.87 0.00 -0.81 -2.42 120.51 118.48 2bq5 n ALA 123 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 2bq5 n ALA 123 Cb 0.27 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.72 2bq5 n ALA 123 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2bq5 n ALA 124 N -0.43 1.72 -3.69 0.00 0.00 -0.55 -4.99 120.51 112.57 2bq5 n ALA 124 Ca 0.00 -0.71 -0.23 0.00 0.00 0.00 0.00 53.44 52.50 2bq5 n ALA 124 Cb 0.03 0.00 0.05 0.00 0.00 0.00 0.00 19.45 19.52 2bq5 n ALA 124 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2bq5 n ASN 125 N -0.25 -2.65 -4.25 0.00 3.02 -1.01 -4.98 115.26 105.13 2bq5 n ASN 125 Ca 0.00 -0.75 -0.14 0.00 -0.03 0.00 0.00 54.58 53.66 2bq5 n ASN 125 Cb 0.26 -4.30 -0.10 0.00 -0.61 0.00 0.00 39.78 35.02 2bq5 n ASN 125 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2bq5 s SER 126 N -4.02 1.31 0.54 6.41 0.15 -0.49 -5.06 113.70 112.53 2bq5 s SER 126 Ca 0.21 -1.16 0.07 0.00 0.70 0.00 0.00 55.95 55.77 2bq5 s SER 126 Cb -0.10 0.10 0.07 0.00 -1.71 0.00 0.00 66.02 64.38 2bq5 s SER 126 CO 0.79 -0.55 0.61 0.61 1.20 0.00 0.00 173.24 175.91 2bq5 n GLY 127 N -0.25 2.28 3.75 9.45 0.00 -1.26 -4.17 105.19 114.98 2bq5 n GLY 127 Ca -0.07 -2.25 -0.38 0.00 0.00 0.00 0.00 46.02 43.32 2bq5 n GLY 127 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2bq5 s ILE 128 N -2.48 5.14 0.00 -0.61 1.09 -1.26 -4.87 121.20 118.22 2bq5 s ILE 128 Ca 0.47 0.92 0.00 0.00 -1.10 0.00 0.00 60.65 60.93 2bq5 s ILE 128 Cb -0.04 -3.79 0.00 0.00 -1.06 0.00 0.00 42.46 37.58 2bq5 s ILE 128 CO 0.30 0.39 0.00 0.00 -0.10 0.00 0.00 174.94 175.53