#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2bqp s GLU 2 N 0.00 0.13 0.08 -2.82 2.12 0.26 -5.01 118.70 113.46 2bqp s GLU 2 Ca 0.00 0.41 0.02 0.00 0.36 0.00 0.00 54.97 55.77 2bqp s GLU 2 Cb 0.00 -0.16 -0.03 0.00 0.26 0.00 0.00 34.13 34.20 2bqp s GLU 2 CO 0.00 -0.16 -0.08 0.95 -0.54 0.00 0.00 175.26 175.43 2bqp s THR 3 N 1.17 0.70 -0.02 -1.70 -4.23 -1.26 -0.80 115.64 109.49 2bqp s THR 3 Ca -0.09 -1.53 -0.01 0.00 -1.18 0.00 0.00 61.69 58.88 2bqp s THR 3 Cb -0.11 -1.19 0.02 0.00 1.34 0.00 0.00 72.50 72.56 2bqp s THR 3 CO -0.07 -0.60 0.05 -0.89 -0.54 0.00 0.00 174.62 172.57 2bqp s THR 4 N -2.45 -0.03 0.02 3.99 2.01 -1.01 -5.00 115.64 113.17 2bqp s THR 4 Ca 0.02 0.11 -0.15 0.00 0.31 0.00 0.00 61.69 61.98 2bqp s THR 4 Cb -0.03 -0.09 0.02 0.00 0.01 0.00 0.00 72.50 72.42 2bqp s THR 4 CO -0.02 0.04 0.32 -0.44 -0.69 0.00 0.00 174.62 173.84 2bqp s SER 5 N 0.59 -0.17 0.14 3.53 0.01 -1.26 -0.81 113.70 115.73 2bqp s SER 5 Ca -0.05 -0.05 -0.24 0.00 1.31 0.00 0.00 55.95 56.92 2bqp s SER 5 Cb -0.07 0.35 0.07 0.00 0.21 0.00 0.00 66.02 66.58 2bqp s SER 5 CO -0.02 -0.55 0.65 0.72 0.41 0.00 0.00 173.24 174.45 2bqp s PHE 6 N -2.04 -0.49 -0.16 2.43 -0.12 -0.74 -5.00 117.98 111.85 2bqp s PHE 6 Ca -0.08 0.28 -0.09 0.00 -0.05 0.00 0.00 56.93 56.99 2bqp s PHE 6 Cb -0.03 0.56 0.06 0.00 -0.63 0.00 0.00 43.02 42.99 2bqp s PHE 6 CO -0.00 -0.82 0.40 -1.17 -0.05 0.00 0.00 175.22 173.58 2bqp s LEU 7 N -2.72 -0.04 -0.24 -1.99 2.96 -1.26 -2.06 118.68 113.33 2bqp s LEU 7 Ca 0.02 0.87 -0.03 0.00 -0.22 0.00 0.00 54.13 54.77 2bqp s LEU 7 Cb -0.01 1.31 0.08 0.00 0.50 0.00 0.00 46.19 48.06 2bqp s LEU 7 CO -0.11 -0.19 0.07 -0.63 -1.32 0.00 0.00 176.35 174.17 2bqp s ILE 8 N 1.36 0.41 -1.85 6.68 1.01 -0.50 -5.00 121.20 123.30 2bqp s ILE 8 Ca -0.09 -0.74 0.25 0.00 0.00 0.00 0.00 60.65 60.07 2bqp s ILE 8 Cb -0.08 -1.11 0.17 0.00 0.01 0.00 0.00 42.46 41.45 2bqp s ILE 8 CO -0.12 -0.43 1.39 0.35 0.00 0.00 0.00 174.94 176.14 2bqp n THR 9 N 5.07 0.00 -3.70 2.92 -2.24 -1.26 -1.51 114.28 113.56 2bqp n THR 9 Ca -0.07 -0.17 -0.12 0.00 -2.27 0.00 0.00 64.05 61.42 2bqp n THR 9 Cb 0.45 0.70 -0.09 0.00 -2.10 0.00 0.00 70.33 69.29 2bqp n THR 9 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2bqp s LYS 10 N -2.50 0.53 -0.03 -0.78 1.02 -1.26 -4.62 119.74 112.11 2bqp s LYS 10 Ca 0.22 0.75 -0.14 0.00 0.02 0.00 0.00 55.97 56.83 2bqp s LYS 10 Cb 0.19 0.18 -0.05 0.00 -0.52 0.00 0.00 37.83 37.63 2bqp s LYS 10 CO 0.54 -0.10 0.37 -0.06 -0.92 0.00 0.00 175.35 175.19 2bqp s PHE 11 N 0.68 3.69 0.29 3.18 0.08 -0.53 -5.02 117.98 120.35 2bqp s PHE 11 Ca -0.03 0.91 0.05 0.00 0.12 0.00 0.00 56.93 57.97 2bqp s PHE 11 Cb -0.05 -2.27 -0.02 0.00 -0.57 0.00 0.00 43.02 40.11 2bqp s PHE 11 CO -0.05 0.61 0.43 -1.12 -0.10 0.00 0.00 175.22 174.99 2bqp s SER 12 N -0.89 6.19 0.56 1.36 0.01 -1.26 -3.25 113.70 116.42 2bqp s SER 12 Ca 0.22 0.06 0.34 0.00 1.31 0.00 0.00 55.95 57.88 2bqp s SER 12 Cb -0.16 -1.69 1.54 0.00 0.21 0.00 0.00 66.02 65.93 2bqp s SER 12 CO 0.12 -0.24 2.06 -0.65 0.41 0.00 0.00 173.24 174.94 2bqp h PRO 13 N 0.99 0.00 -2.07 12.44 0.11 -1.97 -3.14 132.00 138.37 2bqp h PRO 13 Ca -0.50 0.00 -0.59 0.00 0.11 0.00 0.00 66.00 65.02 2bqp h PRO 13 Cb 1.24 0.00 -0.42 0.00 0.11 0.00 0.00 31.00 31.93 2bqp h PRO 13 CO 0.58 0.04 -0.64 -3.47 -0.21 0.00 0.00 178.00 174.31 2bqp n ASP 14 N -3.19 4.61 -4.57 -2.05 2.03 -1.26 -4.75 116.55 107.37 2bqp n ASP 14 Ca -0.00 -3.70 -0.30 0.00 0.52 0.00 0.00 54.79 51.31 2bqp n ASP 14 Cb 0.26 -0.54 -0.05 0.00 -0.72 0.00 0.00 41.12 40.07 2bqp n ASP 14 CO 0.00 0.00 0.00 -1.58 -1.92 0.00 0.00 177.20 173.70 2bqp s GLN 15 N -3.51 2.73 0.00 -0.67 2.00 -1.19 -4.80 119.66 114.23 2bqp s GLN 15 Ca 0.49 -0.83 0.24 0.00 -2.00 0.00 0.00 55.36 53.25 2bqp s GLN 15 Cb 0.31 -5.20 1.23 0.00 0.80 0.00 0.00 33.01 30.15 2bqp s GLN 15 CO -0.16 -3.43 1.79 1.04 -0.50 0.00 0.00 175.29 174.04 2bqp n GLN 16 N 8.60 0.38 -0.33 1.67 6.02 -1.26 -3.08 117.38 129.39 2bqp n GLN 16 Ca 0.42 0.06 0.08 0.00 -0.01 0.00 0.00 57.00 57.54 2bqp n GLN 16 Cb 0.47 -1.50 0.24 0.00 1.02 0.00 0.00 30.24 30.47 2bqp n GLN 16 CO 0.00 0.00 0.00 0.27 -1.01 0.00 0.00 177.06 176.32 2bqp n ASN 17 N -1.26 3.05 -4.39 1.08 2.04 -1.26 -4.89 115.26 109.63 2bqp n ASN 17 Ca 0.12 -2.11 -0.27 0.00 -0.44 0.00 0.00 54.58 51.88 2bqp n ASN 17 Cb 0.18 -0.40 -0.12 0.00 -2.53 0.00 0.00 39.78 36.91 2bqp n ASN 17 CO 0.00 0.00 0.00 -0.76 -0.44 0.00 0.00 177.26 176.06 2bqp s LEU 18 N -1.15 2.37 -0.23 -4.53 1.02 -1.18 -0.18 118.68 114.80 2bqp s LEU 18 Ca 0.36 -0.79 -0.01 0.00 0.02 0.00 0.00 54.13 53.71 2bqp s LEU 18 Cb 0.20 -1.14 0.02 0.00 0.02 0.00 0.00 46.19 45.30 2bqp s LEU 18 CO 0.22 0.13 -0.10 -0.63 0.02 0.00 0.00 176.35 175.99 2bqp s ILE 19 N -1.35 2.67 -0.02 -0.59 1.01 0.31 -4.79 121.20 118.44 2bqp s ILE 19 Ca 0.16 -1.00 -0.14 0.00 0.00 0.00 0.00 60.65 59.67 2bqp s ILE 19 Cb -0.09 -2.31 -0.05 0.00 0.01 0.00 0.00 42.46 40.02 2bqp s ILE 19 CO 0.07 0.29 0.38 -0.36 0.00 0.00 0.00 174.94 175.32 2bqp s PHE 20 N 1.31 3.70 0.03 3.97 0.08 -1.26 0.52 117.98 126.33 2bqp s PHE 20 Ca 0.01 0.93 0.03 0.00 0.12 0.00 0.00 56.93 58.02 2bqp s PHE 20 Cb -0.16 -2.27 -0.02 0.00 -0.57 0.00 0.00 43.02 40.01 2bqp s PHE 20 CO -0.06 0.62 -0.08 -0.65 -0.10 0.00 0.00 175.22 174.95 2bqp s GLN 21 N -0.96 0.57 5.30 0.44 -0.21 -0.17 -4.98 119.66 119.65 2bqp s GLN 21 Ca 0.23 -0.61 0.00 0.00 0.02 0.00 0.00 55.36 55.00 2bqp s GLN 21 Cb -0.16 -0.45 0.00 0.00 1.00 0.00 0.00 33.01 33.40 2bqp s GLN 21 CO 0.12 0.10 0.00 0.41 -2.12 0.00 0.00 175.29 173.80 2bqp n GLY 22 N 1.93 2.09 0.10 3.09 0.00 -1.26 -0.94 105.19 110.20 2bqp n GLY 22 Ca -0.19 -0.56 0.13 0.00 0.00 0.00 0.00 46.02 45.40 2bqp n GLY 22 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2bqp n ASP 23 N 1.97 0.31 -4.73 1.61 9.92 0.71 -4.89 116.55 121.46 2bqp n ASP 23 Ca 0.00 -1.25 -0.42 0.00 -0.53 0.00 0.00 54.79 52.59 2bqp n ASP 23 Cb 0.00 -0.01 -0.03 0.00 -0.64 0.00 0.00 41.12 40.45 2bqp n ASP 23 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 2bqp s GLY 24 N -1.83 1.96 0.16 0.44 0.00 -1.08 -4.72 107.32 102.25 2bqp s GLY 24 Ca 0.39 1.36 -0.24 0.00 0.00 0.00 0.00 44.72 46.23 2bqp s GLY 24 CO 0.31 2.46 0.83 -2.52 0.00 0.00 0.00 173.10 174.18 2bqp s TYR 25 N 0.53 -0.24 -0.03 1.90 1.13 -0.10 -4.58 117.35 115.96 2bqp s TYR 25 Ca 0.65 -0.07 -0.01 0.00 -1.41 0.00 0.00 57.07 56.22 2bqp s TYR 25 Cb -0.43 0.63 -0.04 0.00 -1.10 0.00 0.00 41.96 41.02 2bqp s TYR 25 CO 0.38 -0.90 0.06 0.95 -2.51 0.00 0.00 175.55 173.53 2bqp s THR 26 N -3.50 4.64 -0.29 -3.49 -4.23 -1.26 0.23 115.64 107.75 2bqp s THR 26 Ca 0.09 -0.33 -0.19 0.00 -1.18 0.00 0.00 61.69 60.08 2bqp s THR 26 Cb -0.03 -3.07 0.14 0.00 1.34 0.00 0.00 72.50 70.89 2bqp s THR 26 CO -0.00 0.44 1.03 0.28 -0.54 0.00 0.00 174.62 175.82 2bqp s THR 27 N -1.09 0.00 -1.40 3.99 -1.32 0.09 -4.67 115.64 111.23 2bqp s THR 27 Ca 0.19 0.00 -0.09 0.00 -1.21 0.00 0.00 61.69 60.59 2bqp s THR 27 Cb -0.12 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 69.91 2bqp s THR 27 CO 0.10 0.00 1.03 0.29 -2.21 0.00 0.00 174.62 173.83 2bqp n LYS 28 N 3.14 -6.56 -0.82 7.08 5.02 -1.26 -1.47 118.16 123.29 2bqp n LYS 28 Ca -0.16 0.72 0.00 0.00 -2.02 0.00 0.00 58.31 56.85 2bqp n LYS 28 Cb 0.57 -5.65 0.00 0.00 -0.02 0.00 0.00 35.03 29.93 2bqp n LYS 28 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 2bqp n GLU 29 N -4.71 -0.10 -4.37 1.97 1.02 -1.20 -4.98 120.64 108.27 2bqp n GLU 29 Ca -0.05 0.02 -0.29 0.00 -0.02 0.00 0.00 57.16 56.82 2bqp n GLU 29 Cb 0.57 -3.38 -0.12 0.00 -0.02 0.00 0.00 31.44 28.49 2bqp n GLU 29 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 2bqp s LYS 30 N -0.46 1.64 -0.33 3.49 -2.85 -0.54 -1.45 119.74 119.24 2bqp s LYS 30 Ca 0.00 -1.24 -0.17 0.00 -1.00 0.00 0.00 55.97 53.56 2bqp s LYS 30 Cb 0.00 -2.02 -0.01 0.00 -2.06 0.00 0.00 37.83 33.74 2bqp s LYS 30 CO 0.00 0.47 0.49 -1.17 0.10 0.00 0.00 175.35 175.24 2bqp s LEU 31 N -2.05 4.30 -0.27 2.77 2.96 0.30 -0.73 118.68 125.96 2bqp s LEU 31 Ca 0.16 0.03 -0.11 0.00 -0.22 0.00 0.00 54.13 53.99 2bqp s LEU 31 Cb -0.10 -2.55 -0.05 0.00 0.50 0.00 0.00 46.19 43.98 2bqp s LEU 31 CO 0.08 -0.42 0.19 -0.89 -1.32 0.00 0.00 176.35 173.99 2bqp s THR 32 N 2.32 5.32 -0.13 3.68 2.01 0.14 -0.90 115.64 128.07 2bqp s THR 32 Ca 0.18 0.19 -0.11 0.00 0.31 0.00 0.00 61.69 62.26 2bqp s THR 32 Cb -0.16 -3.53 -0.25 0.00 0.01 0.00 0.00 72.50 68.57 2bqp s THR 32 CO 0.12 0.27 0.39 -0.07 -0.69 0.00 0.00 174.62 174.64 2bqp h LEU 33 N 8.14 0.36 -7.50 4.42 3.38 -1.54 -0.24 115.31 122.33 2bqp h LEU 33 Ca -0.36 -0.86 -0.12 0.00 0.09 0.00 0.00 57.88 56.63 2bqp h LEU 33 Cb 1.18 -0.12 -0.20 0.00 0.09 0.00 0.00 40.66 41.62 2bqp h LEU 33 CO 0.58 1.76 -0.27 0.42 0.09 0.00 0.00 178.44 181.02 2bqp s THR 34 N -2.52 0.05 0.74 0.22 -4.23 -1.22 -3.11 115.64 105.59 2bqp s THR 34 Ca -0.23 -0.45 -0.02 0.00 -1.18 0.00 0.00 61.69 59.82 2bqp s THR 34 Cb 0.06 -0.61 0.14 0.00 1.34 0.00 0.00 72.50 73.43 2bqp s THR 34 CO 0.74 -0.24 1.02 -0.54 -0.54 0.00 0.00 174.62 175.06 2bqp s LYS 35 N -1.25 1.57 -1.46 3.99 1.02 -1.26 -2.03 119.74 120.32 2bqp s LYS 35 Ca -0.13 -1.11 -0.13 0.00 0.02 0.00 0.00 55.97 54.62 2bqp s LYS 35 Cb -0.05 -2.30 0.04 0.00 -0.52 0.00 0.00 37.83 35.00 2bqp s LYS 35 CO 0.04 -1.54 2.26 0.00 -0.92 0.00 0.00 175.35 175.19 2bqp n ALA 36 N -2.91 5.68 -2.77 5.17 0.00 -1.26 -4.15 120.51 120.27 2bqp n ALA 36 Ca 0.15 -3.88 -0.12 0.00 0.00 0.00 0.00 53.44 49.59 2bqp n ALA 36 Cb 0.61 -3.49 -0.11 0.00 0.00 0.00 0.00 19.45 16.45 2bqp n ALA 36 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 2bqp s VAL 37 N 2.95 0.48 0.47 0.00 -7.23 -1.26 -4.81 120.40 111.00 2bqp s VAL 37 Ca 0.48 -1.18 -0.23 0.00 -1.81 0.00 0.00 61.98 59.24 2bqp s VAL 37 Cb 0.14 -0.71 -0.07 0.00 0.56 0.00 0.00 36.38 36.30 2bqp s VAL 37 CO -0.08 -0.48 1.22 -0.54 -0.31 0.00 0.00 175.10 174.90 2bqp s LYS 38 N -1.91 3.66 -1.46 4.82 1.02 -1.26 -4.22 119.74 120.38 2bqp s LYS 38 Ca -0.08 1.90 -0.06 0.00 0.02 0.00 0.00 55.97 57.75 2bqp s LYS 38 Cb -0.08 -2.41 0.05 0.00 -0.52 0.00 0.00 37.83 34.87 2bqp s LYS 38 CO -0.01 -0.67 0.67 0.09 -0.92 0.00 0.00 175.35 174.51 2bqp n ASN 39 N -0.53 -2.00 -4.69 2.83 4.13 0.77 -4.88 115.26 110.90 2bqp n ASN 39 Ca 0.08 -0.91 -0.26 0.00 1.68 0.00 0.00 54.58 55.16 2bqp n ASN 39 Cb 0.47 -3.43 -0.09 0.00 -1.54 0.00 0.00 39.78 35.19 2bqp n ASN 39 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 2bqp s THR 40 N -3.63 2.12 -0.06 3.41 -4.23 -1.25 -4.94 115.64 107.06 2bqp s THR 40 Ca 0.27 -1.84 -0.07 0.00 -1.18 0.00 0.00 61.69 58.86 2bqp s THR 40 Cb -0.14 -2.97 0.02 0.00 1.34 0.00 0.00 72.50 70.75 2bqp s THR 40 CO 0.86 0.00 0.19 0.54 -0.54 0.00 0.00 174.62 175.68 2bqp s VAL 41 N -2.66 0.02 -0.03 2.29 0.11 -1.26 -1.73 120.40 117.13 2bqp s VAL 41 Ca 0.37 -0.17 -0.02 0.00 -2.93 0.00 0.00 61.98 59.23 2bqp s VAL 41 Cb 0.07 -0.34 0.02 0.00 -1.53 0.00 0.00 36.38 34.60 2bqp s VAL 41 CO 0.20 -0.09 0.08 -0.83 -3.33 0.00 0.00 175.10 171.12 2bqp s GLY 42 N -0.28 -0.01 0.01 6.54 0.00 -0.35 -0.20 107.32 113.02 2bqp s GLY 42 Ca -0.04 0.33 -0.03 0.00 0.00 0.00 0.00 44.72 44.99 2bqp s GLY 42 CO 0.01 0.49 0.04 0.50 0.00 0.00 0.00 173.10 174.13 2bqp s ARG 43 N 0.55 0.37 -0.06 2.90 0.52 -0.11 -1.28 118.95 121.84 2bqp s ARG 43 Ca -0.04 -0.51 -0.02 0.00 -0.52 0.00 0.00 55.73 54.64 2bqp s ARG 43 Cb -0.06 0.14 0.04 0.00 0.52 0.00 0.00 34.95 35.59 2bqp s ARG 43 CO -0.02 -0.07 0.12 0.00 0.02 0.00 0.00 175.30 175.34 2bqp s ALA 44 N -1.38 -0.18 0.06 2.13 0.00 -0.92 -1.00 121.76 120.46 2bqp s ALA 44 Ca -0.15 0.60 0.09 0.00 0.00 0.00 0.00 51.96 52.50 2bqp s ALA 44 Cb -0.09 -0.41 -0.03 0.00 0.00 0.00 0.00 23.12 22.59 2bqp s ALA 44 CO 0.00 -0.15 -0.25 -0.51 0.00 0.00 0.00 175.76 174.85 2bqp s LEU 45 N 1.16 2.19 0.24 0.00 2.01 0.18 -0.52 118.68 123.94 2bqp s LEU 45 Ca -0.09 -0.59 -0.30 0.00 0.01 0.00 0.00 54.13 53.16 2bqp s LEU 45 Cb -0.12 -1.18 -0.09 0.00 0.01 0.00 0.00 46.19 44.82 2bqp s LEU 45 CO -0.05 0.21 1.06 -0.47 1.01 0.00 0.00 176.35 178.11 2bqp s TYR 46 N -0.85 3.69 0.26 0.29 5.04 -0.68 0.11 117.35 125.22 2bqp s TYR 46 Ca 0.11 1.73 -0.05 0.00 -2.44 0.00 0.00 57.07 56.41 2bqp s TYR 46 Cb -0.10 -3.20 0.29 0.00 0.35 0.00 0.00 41.96 39.30 2bqp s TYR 46 CO 0.03 -0.30 1.93 0.66 -1.34 0.00 0.00 175.55 176.53 2bqp h SER 47 N 4.30 1.13 -3.44 4.32 4.64 -0.87 -3.43 113.55 120.19 2bqp h SER 47 Ca -0.46 -0.03 -0.54 0.00 -0.47 0.00 0.00 61.79 60.30 2bqp h SER 47 Cb 1.21 -0.28 -0.04 0.00 -0.31 0.00 0.00 62.40 62.98 2bqp h SER 47 CO 0.69 0.81 0.20 -0.55 -0.87 0.00 0.00 176.83 177.11 2bqp s SER 48 N -6.13 7.25 0.53 4.97 0.15 -1.26 -5.03 113.70 114.18 2bqp s SER 48 Ca -0.13 1.49 -0.21 0.00 0.70 0.00 0.00 55.95 57.81 2bqp s SER 48 Cb 0.18 -2.49 -0.05 0.00 -1.71 0.00 0.00 66.02 61.95 2bqp s SER 48 CO 0.82 -0.03 1.21 -2.84 1.20 0.00 0.00 173.24 173.60 2bqp s PRO 49 N 0.09 3.32 -0.01 5.44 0.02 -1.26 -4.80 135.00 137.79 2bqp s PRO 49 Ca 0.41 1.85 0.02 0.00 0.02 0.00 0.00 61.00 63.30 2bqp s PRO 49 Cb -0.21 -2.15 -0.03 0.00 0.02 0.00 0.00 34.50 32.13 2bqp s PRO 49 CO 0.24 -0.94 -0.05 0.42 -0.33 0.00 0.00 177.00 176.34 2bqp s ILE 50 N -1.55 3.79 -0.86 2.83 -1.09 0.71 -4.90 121.20 120.13 2bqp s ILE 50 Ca 0.71 -0.66 -0.18 0.00 -2.23 0.00 0.00 60.65 58.28 2bqp s ILE 50 Cb -0.31 -2.63 0.14 0.00 -1.58 0.00 0.00 42.46 38.07 2bqp s ILE 50 CO 0.35 0.44 1.03 -2.28 -1.23 0.00 0.00 174.94 173.25 2bqp s HIS 51 N -0.97 3.16 0.16 3.97 2.46 -1.26 -1.50 115.29 121.30 2bqp s HIS 51 Ca 0.16 -1.36 -0.00 0.00 0.47 0.00 0.00 55.06 54.33 2bqp s HIS 51 Cb -0.11 -4.20 -0.00 0.00 -0.13 0.00 0.00 32.58 28.14 2bqp s HIS 51 CO 0.07 -1.42 1.38 0.97 -2.47 0.00 0.00 174.74 173.26 2bqp h ILE 52 N 5.71 1.44 -3.68 0.89 6.09 -1.56 -3.44 117.51 122.95 2bqp h ILE 52 Ca 0.07 -2.43 -0.08 0.00 -1.37 0.00 0.00 64.86 61.05 2bqp h ILE 52 Cb 1.04 2.35 -0.14 0.00 0.47 0.00 0.00 36.82 40.54 2bqp h ILE 52 CO 1.07 0.72 -0.31 -1.66 -3.07 0.00 0.00 178.15 174.90 2bqp s TRP 53 N -3.34 0.06 -0.27 2.19 1.48 -1.18 -0.29 118.94 117.58 2bqp s TRP 53 Ca -0.04 -0.44 -0.07 0.00 -1.06 0.00 0.00 56.10 54.49 2bqp s TRP 53 Cb 0.10 0.01 -0.00 0.00 -1.16 0.00 0.00 33.47 32.42 2bqp s TRP 53 CO 0.84 -0.57 0.06 0.34 -4.06 0.00 0.00 176.95 173.57 2bqp s ASP 54 N -2.76 5.02 0.20 -2.66 2.15 0.19 -4.74 116.67 114.07 2bqp s ASP 54 Ca 0.03 -0.54 -0.11 0.00 0.43 0.00 0.00 52.55 52.37 2bqp s ASP 54 Cb 0.04 -1.87 0.15 0.00 -0.30 0.00 0.00 42.92 40.93 2bqp s ASP 54 CO -0.10 -0.13 1.87 -0.09 -0.17 0.00 0.00 175.17 176.55 2bqp h ARG 55 N 8.22 0.91 -0.51 4.34 2.43 -1.94 0.83 114.38 128.66 2bqp h ARG 55 Ca -0.35 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 58.66 2bqp h ARG 55 Cb 1.14 -0.21 -0.02 0.00 -0.42 0.00 0.00 29.97 30.47 2bqp h ARG 55 CO 0.60 0.60 -0.13 1.49 -1.51 0.00 0.00 179.97 181.02 2bqp h GLU 56 N 0.94 0.99 0.00 0.20 4.81 -1.97 -3.30 114.58 116.25 2bqp h GLU 56 Ca 0.26 -0.38 0.00 0.00 -0.13 0.00 0.00 59.36 59.11 2bqp h GLU 56 Cb -0.09 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 29.24 2bqp h GLU 56 CO -0.06 1.05 -1.56 0.25 -0.73 0.00 0.00 179.01 177.96 2bqp n THR 57 N -4.17 0.00 -0.94 0.32 -2.24 -1.21 -4.98 114.28 101.06 2bqp n THR 57 Ca 0.01 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 2bqp n THR 57 Cb 0.41 0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.90 2bqp n THR 57 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2bqp n GLY 58 N 1.61 0.50 3.79 3.38 0.00 0.29 -5.02 105.19 109.74 2bqp n GLY 58 Ca -0.02 -0.27 -0.35 0.00 0.00 0.00 0.00 46.02 45.38 2bqp n GLY 58 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2bqp s ASN 59 N -2.25 6.17 -0.04 1.61 -0.87 -1.18 -4.75 114.94 113.64 2bqp s ASN 59 Ca 0.00 2.06 0.07 0.00 -1.57 0.00 0.00 52.86 53.42 2bqp s ASN 59 Cb 0.00 -2.57 -0.02 0.00 -0.02 0.00 0.00 41.25 38.64 2bqp s ASN 59 CO 0.00 -0.90 -0.25 -0.69 -2.57 0.00 0.00 177.10 172.68 2bqp s VAL 60 N -1.83 2.05 0.47 1.60 1.01 -1.26 0.53 120.40 122.97 2bqp s VAL 60 Ca 0.68 -1.09 -0.21 0.00 0.00 0.00 0.00 61.98 61.36 2bqp s VAL 60 Cb -0.21 -1.71 -0.08 0.00 0.00 0.00 0.00 36.38 34.38 2bqp s VAL 60 CO 0.25 0.57 1.06 0.00 0.00 0.00 0.00 175.10 176.98 2bqp s ALA 61 N -0.40 2.90 0.04 5.51 0.00 0.60 -4.76 121.76 125.66 2bqp s ALA 61 Ca 0.03 0.67 -0.11 0.00 0.00 0.00 0.00 51.96 52.55 2bqp s ALA 61 Cb -0.12 -3.28 -0.06 0.00 0.00 0.00 0.00 23.12 19.67 2bqp s ALA 61 CO 0.01 -0.36 0.38 -0.80 0.00 0.00 0.00 175.76 175.00 2bqp s ASN 62 N -1.84 6.67 0.12 0.00 0.01 -0.52 -4.43 114.94 114.95 2bqp s ASN 62 Ca 0.66 0.82 -0.17 0.00 -0.71 0.00 0.00 52.86 53.45 2bqp s ASN 62 Cb -0.19 -2.19 0.04 0.00 0.41 0.00 0.00 41.25 39.32 2bqp s ASN 62 CO 0.23 0.23 0.43 0.72 -1.51 0.00 0.00 177.10 177.20 2bqp s PHE 63 N -1.28 -0.26 -0.15 2.20 -0.12 -1.08 -1.31 117.98 115.98 2bqp s PHE 63 Ca 0.29 0.00 -0.11 0.00 -0.05 0.00 0.00 56.93 57.06 2bqp s PHE 63 Cb -0.15 0.29 0.05 0.00 -0.63 0.00 0.00 43.02 42.58 2bqp s PHE 63 CO 0.16 -0.70 0.39 0.54 -0.05 0.00 0.00 175.22 175.56 2bqp s VAL 64 N -3.58 -0.01 0.10 -2.49 0.11 -0.64 -0.79 120.40 113.10 2bqp s VAL 64 Ca 0.01 0.05 0.07 0.00 -2.93 0.00 0.00 61.98 59.19 2bqp s VAL 64 Cb 0.01 -0.56 -0.03 0.00 -1.53 0.00 0.00 36.38 34.27 2bqp s VAL 64 CO -0.11 0.02 -0.18 0.28 -3.33 0.00 0.00 175.10 171.79 2bqp s THR 65 N 0.83 1.48 -0.01 5.04 -1.32 -0.00 -1.65 115.64 120.02 2bqp s THR 65 Ca -0.05 -1.52 0.01 0.00 -1.21 0.00 0.00 61.69 58.91 2bqp s THR 65 Cb -0.06 -1.42 0.00 0.00 -1.51 0.00 0.00 72.50 69.51 2bqp s THR 65 CO -0.06 -0.18 -0.02 -0.44 -2.21 0.00 0.00 174.62 171.71 2bqp s SER 66 N -1.99 0.32 0.06 8.08 0.01 -0.55 -1.32 113.70 118.32 2bqp s SER 66 Ca 0.05 -0.04 -0.22 0.00 1.31 0.00 0.00 55.95 57.04 2bqp s SER 66 Cb -0.09 -0.06 0.05 0.00 0.21 0.00 0.00 66.02 66.14 2bqp s SER 66 CO 0.04 0.02 0.52 0.72 0.41 0.00 0.00 173.24 174.94 2bqp s PHE 67 N 0.07 -0.42 -0.09 2.43 -0.12 -0.79 -0.27 117.98 118.79 2bqp s PHE 67 Ca -0.00 0.42 0.02 0.00 -0.05 0.00 0.00 56.93 57.32 2bqp s PHE 67 Cb -0.03 0.35 -0.01 0.00 -0.63 0.00 0.00 43.02 42.70 2bqp s PHE 67 CO -0.00 -0.66 -0.17 0.99 -0.05 0.00 0.00 175.22 175.33 2bqp s THR 68 N -2.62 2.74 0.07 -4.49 2.01 -1.11 -0.32 115.64 111.92 2bqp s THR 68 Ca -0.04 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.16 2bqp s THR 68 Cb -0.00 -2.09 -0.04 0.00 0.01 0.00 0.00 72.50 70.37 2bqp s THR 68 CO -0.03 0.55 -0.05 0.72 -0.69 0.00 0.00 174.62 175.13 2bqp s PHE 69 N -0.01 0.68 0.03 4.92 -0.71 -0.33 -1.26 117.98 121.30 2bqp s PHE 69 Ca -0.05 -0.96 0.02 0.00 -1.04 0.00 0.00 56.93 54.89 2bqp s PHE 69 Cb -0.14 -0.44 -0.02 0.00 -1.21 0.00 0.00 43.02 41.21 2bqp s PHE 69 CO 0.04 -0.26 -0.06 0.08 -1.34 0.00 0.00 175.22 173.68 2bqp s VAL 70 N -3.62 0.44 -0.11 -2.49 1.01 -0.06 -0.69 120.40 114.90 2bqp s VAL 70 Ca 0.08 -0.82 0.01 0.00 0.00 0.00 0.00 61.98 61.25 2bqp s VAL 70 Cb 0.06 -0.49 0.02 0.00 0.00 0.00 0.00 36.38 35.97 2bqp s VAL 70 CO -0.07 -0.26 -0.11 -0.63 0.00 0.00 0.00 175.10 174.03 2bqp s ILE 71 N -1.04 1.21 -0.35 2.22 1.01 -1.26 -1.47 121.20 121.52 2bqp s ILE 71 Ca -0.07 -0.44 0.00 0.00 0.00 0.00 0.00 60.65 60.14 2bqp s ILE 71 Cb -0.08 -1.16 0.09 0.00 0.01 0.00 0.00 42.46 41.32 2bqp s ILE 71 CO 0.00 0.39 0.08 0.20 0.00 0.00 0.00 174.94 175.61 2bqp s ASN 72 N 1.31 4.94 -0.17 3.58 0.01 -0.19 -0.70 114.94 123.72 2bqp s ASN 72 Ca -0.02 -1.82 -0.06 0.00 -0.71 0.00 0.00 52.86 50.25 2bqp s ASN 72 Cb -0.14 -1.71 -0.04 0.00 0.41 0.00 0.00 41.25 39.77 2bqp s ASN 72 CO -0.05 -0.39 0.03 0.00 -1.51 0.00 0.00 177.10 175.19 2bqp s ALA 73 N 1.09 3.31 0.43 0.60 0.00 -1.26 -0.78 121.76 125.15 2bqp s ALA 73 Ca 0.04 -0.76 0.10 0.00 0.00 0.00 0.00 51.96 51.34 2bqp s ALA 73 Cb -0.21 -1.79 0.95 0.00 0.00 0.00 0.00 23.12 22.07 2bqp s ALA 73 CO -0.05 0.24 2.04 -1.35 0.00 0.00 0.00 175.76 176.63 2bqp h PRO 74 N 6.52 0.28 -4.61 0.00 0.11 -1.89 -3.38 132.00 129.03 2bqp h PRO 74 Ca -0.37 -0.03 -0.63 0.00 0.11 0.00 0.00 66.00 65.07 2bqp h PRO 74 Cb 1.18 -0.06 -0.37 0.00 0.11 0.00 0.00 31.00 31.86 2bqp h PRO 74 CO 0.67 0.26 -0.80 1.21 -0.21 0.00 0.00 178.00 179.13 2bqp s ASN 75 N -6.86 3.93 0.13 -2.05 2.47 -1.26 -5.00 114.94 106.30 2bqp s ASN 75 Ca -0.06 -1.17 0.07 0.00 0.42 0.00 0.00 52.86 52.12 2bqp s ASN 75 Cb 0.17 -1.33 0.39 0.00 -1.45 0.00 0.00 41.25 39.02 2bqp s ASN 75 CO 0.71 -0.19 1.14 -0.24 -3.72 0.00 0.00 177.10 174.81 2bqp n SER 76 N 4.59 0.19 -0.06 -4.21 2.88 -1.26 -1.96 113.62 113.78 2bqp n SER 76 Ca -0.14 0.51 -0.04 0.00 -1.33 0.00 0.00 58.87 57.87 2bqp n SER 76 Cb 0.44 -0.51 -0.15 0.00 -0.75 0.00 0.00 64.21 63.23 2bqp n SER 76 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 2bqp n TYR 77 N -1.71 0.17 -3.83 0.66 4.01 -1.26 -4.76 117.16 110.43 2bqp n TYR 77 Ca -0.00 0.06 -0.34 0.00 -0.16 0.00 0.00 57.90 57.45 2bqp n TYR 77 Cb 0.13 -0.91 -0.12 0.00 -0.31 0.00 0.00 39.34 38.13 2bqp n TYR 77 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 2bqp s ASN 78 N -5.34 5.05 -0.03 7.72 0.01 -0.83 -5.07 114.94 116.46 2bqp s ASN 78 Ca -0.08 -2.32 0.04 0.00 -0.71 0.00 0.00 52.86 49.79 2bqp s ASN 78 Cb 0.08 -1.77 -0.00 0.00 0.41 0.00 0.00 41.25 39.97 2bqp s ASN 78 CO 0.85 -0.44 -0.14 -0.69 -1.51 0.00 0.00 177.10 175.16 2bqp s VAL 79 N 0.71 1.20 -0.08 1.60 1.01 -1.26 -4.46 120.40 119.12 2bqp s VAL 79 Ca 0.11 -0.60 -0.30 0.00 0.00 0.00 0.00 61.98 61.19 2bqp s VAL 79 Cb -0.22 -1.02 0.09 0.00 0.00 0.00 0.00 36.38 35.23 2bqp s VAL 79 CO -0.04 0.35 0.80 0.00 0.00 0.00 0.00 175.10 176.21 2bqp s ALA 80 N -0.04 -1.82 -0.03 5.51 0.00 -1.26 -4.12 121.76 120.00 2bqp s ALA 80 Ca -0.01 1.36 0.07 0.00 0.00 0.00 0.00 51.96 53.38 2bqp s ALA 80 Cb -0.09 -0.20 -0.10 0.00 0.00 0.00 0.00 23.12 22.73 2bqp s ALA 80 CO 0.01 -0.38 0.11 -0.25 0.00 0.00 0.00 175.76 175.25 2bqp n ASP 81 N 0.72 3.35 0.00 0.00 8.00 -0.07 -3.15 116.55 125.40 2bqp n ASP 81 Ca -0.15 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.35 2bqp n ASP 81 Cb 0.58 1.11 0.00 0.00 -0.02 0.00 0.00 41.12 42.79 2bqp n ASP 81 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2bqp n GLY 82 N 2.26 -0.23 3.04 0.44 0.00 -1.23 -2.01 105.19 107.45 2bqp n GLY 82 Ca -0.05 -1.69 -0.10 0.00 0.00 0.00 0.00 46.02 44.19 2bqp n GLY 82 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2bqp s PHE 83 N -1.79 0.20 0.08 1.61 2.19 -0.64 -2.71 117.98 116.92 2bqp s PHE 83 Ca 0.00 -0.43 -0.08 0.00 0.33 0.00 0.00 56.93 56.75 2bqp s PHE 83 Cb 0.00 -0.15 -0.00 0.00 -1.31 0.00 0.00 43.02 41.56 2bqp s PHE 83 CO 0.00 -0.25 0.17 0.95 1.83 0.00 0.00 175.22 177.92 2bqp s THR 84 N -1.67 0.15 -0.12 0.12 -4.23 0.95 -1.00 115.64 109.84 2bqp s THR 84 Ca -0.13 -1.20 0.00 0.00 -1.18 0.00 0.00 61.69 59.18 2bqp s THR 84 Cb -0.08 -1.29 -0.02 0.00 1.34 0.00 0.00 72.50 72.46 2bqp s THR 84 CO -0.01 -0.66 -0.12 0.12 -0.54 0.00 0.00 174.62 173.41 2bqp s PHE 85 N -3.67 2.82 0.03 3.99 5.36 -0.83 -1.20 117.98 124.48 2bqp s PHE 85 Ca 0.04 -0.49 -0.01 0.00 -0.96 0.00 0.00 56.93 55.50 2bqp s PHE 85 Cb 0.04 -1.81 -0.02 0.00 -0.34 0.00 0.00 43.02 40.89 2bqp s PHE 85 CO -0.10 -0.10 -0.00 -0.59 -1.46 0.00 0.00 175.22 172.97 2bqp s PHE 86 N 0.10 0.30 -0.18 10.12 -0.12 -0.71 -1.19 117.98 126.30 2bqp s PHE 86 Ca -0.05 -0.62 -0.00 0.00 -0.05 0.00 0.00 56.93 56.20 2bqp s PHE 86 Cb -0.15 -0.22 0.01 0.00 -0.63 0.00 0.00 43.02 42.03 2bqp s PHE 86 CO 0.04 -0.26 -0.16 0.42 -0.05 0.00 0.00 175.22 175.21 2bqp s ILE 87 N -2.17 2.51 0.28 -4.49 1.01 -0.32 -1.92 121.20 116.10 2bqp s ILE 87 Ca -0.09 -0.80 -0.05 0.00 0.00 0.00 0.00 60.65 59.71 2bqp s ILE 87 Cb -0.05 -2.07 -0.01 0.00 0.01 0.00 0.00 42.46 40.34 2bqp s ILE 87 CO -0.03 0.51 0.38 0.00 0.00 0.00 0.00 174.94 175.79 2bqp s ALA 88 N 1.14 0.63 0.85 9.38 0.00 -0.75 -2.03 121.76 130.98 2bqp s ALA 88 Ca 0.01 -1.40 -0.12 0.00 0.00 0.00 0.00 51.96 50.45 2bqp s ALA 88 Cb -0.14 1.21 0.11 0.00 0.00 0.00 0.00 23.12 24.29 2bqp s ALA 88 CO -0.06 -0.75 1.18 -2.14 0.00 0.00 0.00 175.76 173.99 2bqp s PRO 89 N -3.66 1.41 0.31 0.00 0.02 -1.25 -1.00 135.00 130.83 2bqp s PRO 89 Ca 0.31 1.66 0.04 0.00 0.02 0.00 0.00 61.00 63.03 2bqp s PRO 89 Cb 0.02 -1.76 0.65 0.00 0.02 0.00 0.00 34.50 33.42 2bqp s PRO 89 CO 0.15 -2.37 1.86 -0.39 -0.33 0.00 0.00 177.00 175.93 2bqp h VAL 90 N -1.29 0.91 -0.23 3.83 -1.51 -1.85 -1.74 116.25 114.37 2bqp h VAL 90 Ca -0.45 -0.31 0.00 0.00 -1.23 0.00 0.00 66.70 64.71 2bqp h VAL 90 Cb 1.28 -0.06 0.00 0.00 -2.13 0.00 0.00 31.29 30.38 2bqp h VAL 90 CO 0.44 0.16 0.00 0.47 -1.23 0.00 0.00 177.57 177.42 2bqp n ASP 91 N -4.58 1.67 -4.55 4.19 8.00 -1.26 -4.82 116.55 115.20 2bqp n ASP 91 Ca 0.18 -2.09 -0.44 0.00 0.71 0.00 0.00 54.79 53.15 2bqp n ASP 91 Cb 0.37 -0.28 -0.01 0.00 -0.02 0.00 0.00 41.12 41.18 2bqp n ASP 91 CO 0.00 0.00 0.00 1.07 -0.39 0.00 0.00 177.20 177.88 2bqp n THR 92 N 0.21 2.03 -4.16 -3.53 5.66 -0.66 -5.03 114.28 108.81 2bqp n THR 92 Ca 0.08 -0.50 -0.10 0.00 -3.05 0.00 0.00 64.05 60.48 2bqp n THR 92 Cb 0.31 -0.84 -0.10 0.00 -1.55 0.00 0.00 70.33 68.15 2bqp n THR 92 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 2bqp s LYS 93 N -1.58 0.83 0.30 1.09 1.02 -1.26 -5.09 119.74 115.06 2bqp s LYS 93 Ca 0.61 -1.35 -0.29 0.00 0.02 0.00 0.00 55.97 54.96 2bqp s LYS 93 Cb -0.68 -0.06 -0.13 0.00 -0.52 0.00 0.00 37.83 36.44 2bqp s LYS 93 CO 0.59 -0.09 1.25 -2.30 -0.92 0.00 0.00 175.35 173.88 2bqp n PRO 94 N -0.04 1.93 0.00 -1.68 -0.02 -1.26 -4.98 135.00 128.94 2bqp n PRO 94 Ca -0.11 0.68 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 2bqp n PRO 94 Cb 0.62 -2.23 0.00 0.00 -0.02 0.00 0.00 33.50 31.87 2bqp n PRO 94 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2bqp n GLN 95 N 0.93 3.97 -1.84 -0.52 1.13 -0.02 -5.01 117.38 116.02 2bqp n GLN 95 Ca 0.07 0.00 -0.41 0.00 -1.94 0.00 0.00 57.00 54.72 2bqp n GLN 95 Cb 0.34 0.00 -0.01 0.00 0.11 0.00 0.00 30.24 30.68 2bqp n GLN 95 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2bqp s THR 96 N 2.81 2.13 0.00 5.09 2.01 -1.11 -4.60 115.64 121.97 2bqp s THR 96 Ca 0.00 0.13 0.00 0.00 0.31 0.00 0.00 61.69 62.13 2bqp s THR 96 Cb 0.00 -3.09 0.00 0.00 0.01 0.00 0.00 72.50 69.42 2bqp s THR 96 CO 0.00 0.03 0.00 0.61 -0.69 0.00 0.00 174.62 174.57 2bqp n GLY 97 N 0.65 0.29 7.00 4.40 0.00 -1.26 0.16 105.19 116.43 2bqp n GLY 97 Ca 0.01 -1.75 0.00 0.00 0.00 0.00 0.00 46.02 44.29 2bqp n GLY 97 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bqp n GLY 98 N 5.00 2.80 0.31 -0.02 0.00 -1.19 -1.84 105.19 110.25 2bqp n GLY 98 Ca 0.00 -0.23 0.17 0.00 0.00 0.00 0.00 46.02 45.95 2bqp n GLY 98 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2bqp h GLY 99 N 0.00 0.00 1.62 -0.02 0.00 -1.91 0.18 103.07 102.93 2bqp h GLY 99 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2bqp h GLY 99 CO 0.00 0.00 -0.03 -1.72 0.00 0.00 0.00 176.54 174.79 2bqp n TYR 100 N -2.83 0.00 -1.66 5.60 4.01 -0.77 -4.93 117.16 116.58 2bqp n TYR 100 Ca -0.02 0.00 -0.21 0.00 -0.16 0.00 0.00 57.90 57.51 2bqp n TYR 100 Cb 0.25 -0.34 -0.08 0.00 -0.31 0.00 0.00 39.34 38.85 2bqp n TYR 100 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 2bqp n LEU 101 N -1.33 -1.56 0.00 7.72 4.77 0.63 -2.44 117.00 124.80 2bqp n LEU 101 Ca 0.12 0.48 0.00 0.00 -0.03 0.00 0.00 56.01 56.58 2bqp n LEU 101 Cb 0.28 -2.88 0.00 0.00 -2.33 0.00 0.00 43.42 38.49 2bqp n LEU 101 CO 0.25 -1.04 0.00 0.61 -1.33 0.00 0.00 177.39 175.88 2bqp n GLY 102 N -0.43 0.29 0.00 -0.72 0.00 0.12 -4.38 105.19 100.08 2bqp n GLY 102 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2bqp n GLY 102 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2bqp n VAL 103 N -2.46 0.00 -4.37 1.61 0.24 -1.02 -0.84 118.33 111.48 2bqp n VAL 103 Ca 0.00 -0.06 -0.20 0.00 -2.04 0.00 0.00 64.34 62.05 2bqp n VAL 103 Cb 0.21 0.56 -0.09 0.00 -1.47 0.00 0.00 33.84 33.04 2bqp n VAL 103 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 2bqp s PHE 104 N -1.88 1.66 0.00 6.34 0.08 -1.18 -4.80 117.98 118.20 2bqp s PHE 104 Ca 0.00 -1.26 0.00 0.00 0.12 0.00 0.00 56.93 55.79 2bqp s PHE 104 Cb 0.00 -0.97 0.00 0.00 -0.57 0.00 0.00 43.02 41.48 2bqp s PHE 104 CO 0.00 -0.38 0.08 0.09 -0.10 0.00 0.00 175.22 174.92 2bqp n ASN 105 N -0.85 0.17 -3.62 1.36 3.02 -1.26 -2.76 115.26 111.31 2bqp n ASN 105 Ca -0.01 -0.50 -0.10 0.00 -0.03 0.00 0.00 54.58 53.93 2bqp n ASN 105 Cb 0.65 0.33 -0.04 0.00 -0.61 0.00 0.00 39.78 40.12 2bqp n ASN 105 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2bqp s SER 106 N -0.33 -0.32 0.00 6.41 1.04 -1.26 -5.00 113.70 114.24 2bqp s SER 106 Ca 0.00 -0.30 0.28 0.00 0.48 0.00 0.00 55.95 56.40 2bqp s SER 106 Cb 0.00 0.54 0.99 0.00 0.10 0.00 0.00 66.02 67.65 2bqp s SER 106 CO 0.00 -0.96 1.71 0.00 0.98 0.00 0.00 173.24 174.98 2bqp n ALA 107 N -0.31 2.91 -2.64 5.32 0.00 -1.26 -2.08 120.51 122.46 2bqp n ALA 107 Ca -0.14 -0.33 -0.35 0.00 0.00 0.00 0.00 53.44 52.62 2bqp n ALA 107 Cb 0.64 -1.24 -0.05 0.00 0.00 0.00 0.00 19.45 18.80 2bqp n ALA 107 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2bqp s GLU 108 N -2.49 3.70 0.07 0.00 8.01 -1.26 -4.52 118.70 122.21 2bqp s GLU 108 Ca 0.26 0.09 -0.30 0.00 0.01 0.00 0.00 54.97 55.03 2bqp s GLU 108 Cb 0.20 -3.04 -0.09 0.00 -4.31 0.00 0.00 34.13 26.89 2bqp s GLU 108 CO 0.50 0.60 1.84 -0.47 0.01 0.00 0.00 175.26 177.74 2bqp s TYR 109 N -1.34 1.86 -0.35 1.61 5.04 -1.26 -4.59 117.35 118.31 2bqp s TYR 109 Ca 0.30 -0.11 0.02 0.00 -2.44 0.00 0.00 57.07 54.84 2bqp s TYR 109 Cb -0.14 -4.15 0.11 0.00 0.35 0.00 0.00 41.96 38.13 2bqp s TYR 109 CO 0.17 -4.88 0.10 0.34 -1.34 0.00 0.00 175.55 169.94 2bqp s ASP 110 N 3.35 4.29 0.56 4.32 -1.08 0.16 -4.97 116.67 123.30 2bqp s ASP 110 Ca 0.82 -2.01 0.25 0.00 -0.52 0.00 0.00 52.55 51.09 2bqp s ASP 110 Cb -0.43 -1.22 1.58 0.00 -1.46 0.00 0.00 42.92 41.40 2bqp s ASP 110 CO 0.37 -0.38 2.16 0.07 0.52 0.00 0.00 175.17 177.92 2bqp h LYS 111 N 7.68 0.00 0.00 4.34 2.10 -1.93 -2.26 116.57 126.50 2bqp h LYS 111 Ca -0.08 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.57 2bqp h LYS 111 Cb 1.00 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.33 2bqp h LYS 111 CO 0.50 0.00 0.00 1.79 -2.00 0.00 0.00 179.45 179.74 2bqp h THR 112 N 0.00 0.00 -0.07 0.07 1.35 -1.95 -2.71 112.91 109.60 2bqp h THR 112 Ca 0.04 -0.36 -0.11 0.00 -0.55 0.00 0.00 66.41 65.43 2bqp h THR 112 Cb 0.21 1.33 -0.01 0.00 -1.73 0.00 0.00 68.15 67.94 2bqp h THR 112 CO -0.00 0.00 -0.47 0.74 -0.25 0.00 0.00 175.52 175.54 2bqp h THR 113 N 0.00 1.34 -6.76 6.82 2.02 -1.77 -3.47 112.91 111.09 2bqp h THR 113 Ca 0.00 -1.65 -0.53 0.00 0.77 0.00 0.00 66.41 65.00 2bqp h THR 113 Cb 0.38 1.81 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 2bqp h THR 113 CO 0.00 0.49 -1.00 0.00 0.37 0.00 0.00 175.52 175.37 2bqp n GLN 114 N -3.98 -0.78 -3.76 6.66 6.02 -1.02 -4.74 117.38 115.78 2bqp n GLN 114 Ca -0.02 0.37 -0.13 0.00 -0.01 0.00 0.00 57.00 57.22 2bqp n GLN 114 Cb 0.51 -2.71 -0.12 0.00 1.02 0.00 0.00 30.24 28.94 2bqp n GLN 114 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2bqp s THR 115 N -3.33 -0.02 -0.12 5.09 2.01 -1.26 -3.90 115.64 114.10 2bqp s THR 115 Ca 0.32 0.07 0.02 0.00 0.31 0.00 0.00 61.69 62.41 2bqp s THR 115 Cb -0.17 -0.36 -0.00 0.00 0.01 0.00 0.00 72.50 71.98 2bqp s THR 115 CO 0.93 0.03 -0.19 -0.69 -0.69 0.00 0.00 174.62 174.01 2bqp s VAL 116 N 0.64 2.44 0.05 3.82 1.01 -0.86 -1.23 120.40 126.27 2bqp s VAL 116 Ca -0.04 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.09 2bqp s VAL 116 Cb -0.06 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.32 2bqp s VAL 116 CO -0.04 0.54 -0.09 0.00 0.00 0.00 0.00 175.10 175.52 2bqp s ALA 117 N 0.47 0.68 -0.29 5.51 0.00 -0.22 -1.17 121.76 126.74 2bqp s ALA 117 Ca -0.13 -0.82 -0.01 0.00 0.00 0.00 0.00 51.96 50.99 2bqp s ALA 117 Cb -0.17 0.03 0.05 0.00 0.00 0.00 0.00 23.12 23.03 2bqp s ALA 117 CO 0.06 0.00 -0.02 0.08 0.00 0.00 0.00 175.76 175.88 2bqp s VAL 118 N -1.44 2.91 0.13 0.00 1.01 -0.34 0.17 120.40 122.84 2bqp s VAL 118 Ca -0.08 -1.38 0.01 0.00 0.00 0.00 0.00 61.98 60.54 2bqp s VAL 118 Cb -0.09 -2.66 -0.04 0.00 0.00 0.00 0.00 36.38 33.59 2bqp s VAL 118 CO 0.01 -0.07 0.28 -1.83 0.00 0.00 0.00 175.10 173.49 2bqp s GLU 119 N 1.25 3.46 -0.51 2.72 -1.05 0.16 -1.96 118.70 122.77 2bqp s GLU 119 Ca -0.05 -0.50 0.03 0.00 -0.15 0.00 0.00 54.97 54.30 2bqp s GLU 119 Cb -0.20 -2.96 0.15 0.00 -0.44 0.00 0.00 34.13 30.68 2bqp s GLU 119 CO -0.02 0.52 0.31 -0.06 0.95 0.00 0.00 175.26 176.97 2bqp s PHE 120 N -1.70 2.46 -0.27 4.83 0.08 -0.17 -1.60 117.98 121.60 2bqp s PHE 120 Ca 0.35 -2.76 -0.21 0.00 0.12 0.00 0.00 56.93 54.44 2bqp s PHE 120 Cb -0.12 -2.12 -0.01 0.00 -0.57 0.00 0.00 43.02 40.20 2bqp s PHE 120 CO 0.28 -0.73 0.65 0.34 -0.10 0.00 0.00 175.22 175.67 2bqp s ASP 121 N -0.22 6.58 0.00 1.36 -1.08 -0.59 -1.62 116.67 121.10 2bqp s ASP 121 Ca 0.21 0.66 0.20 0.00 -0.52 0.00 0.00 52.55 53.10 2bqp s ASP 121 Cb -0.16 -2.35 0.26 0.00 -1.46 0.00 0.00 42.92 39.21 2bqp s ASP 121 CO -0.06 -0.42 1.22 0.35 0.52 0.00 0.00 175.17 176.77 2bqp n THR 122 N 5.27 0.26 -3.79 1.71 -2.24 -0.85 -2.21 114.28 112.43 2bqp n THR 122 Ca 0.00 -0.63 -0.15 0.00 -2.27 0.00 0.00 64.05 61.00 2bqp n THR 122 Cb 0.49 1.18 -0.16 0.00 -2.10 0.00 0.00 70.33 69.74 2bqp n THR 122 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 2bqp s PHE 123 N -1.49 0.04 -0.29 4.78 5.36 -1.25 -4.52 117.98 120.60 2bqp s PHE 123 Ca 0.28 0.11 -0.29 0.00 -0.96 0.00 0.00 56.93 56.07 2bqp s PHE 123 Cb 0.18 -0.23 -0.00 0.00 -0.34 0.00 0.00 43.02 42.63 2bqp s PHE 123 CO 0.26 -0.08 1.34 -0.47 -1.46 0.00 0.00 175.22 174.81 2bqp s TYR 124 N 0.98 2.61 -0.42 10.12 5.04 -1.26 -4.98 117.35 129.44 2bqp s TYR 124 Ca -0.08 0.82 -0.09 0.00 -2.44 0.00 0.00 57.07 55.29 2bqp s TYR 124 Cb -0.12 -3.93 0.09 0.00 0.35 0.00 0.00 41.96 38.35 2bqp s TYR 124 CO -0.03 -1.86 0.26 -0.80 -1.34 0.00 0.00 175.55 171.79 2bqp s ASN 125 N 3.00 5.61 0.47 4.32 -0.87 -1.26 -4.98 114.94 121.23 2bqp s ASN 125 Ca 0.58 -1.60 0.28 0.00 -1.57 0.00 0.00 52.86 50.55 2bqp s ASN 125 Cb -0.17 -1.97 1.34 0.00 -0.02 0.00 0.00 41.25 40.42 2bqp s ASN 125 CO 0.24 -0.56 1.78 0.00 -2.57 0.00 0.00 177.10 175.99 2bqp h ALA 126 N 8.38 2.69 0.00 0.60 0.00 -1.93 0.13 119.26 129.13 2bqp h ALA 126 Ca -0.22 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 2bqp h ALA 126 Cb 1.08 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 2bqp h ALA 126 CO 0.77 -1.08 -0.01 0.00 0.00 0.00 0.00 179.25 178.93 2bqp h ALA 127 N 1.52 1.02 0.00 0.00 0.00 -2.02 -3.38 119.26 116.39 2bqp h ALA 127 Ca 0.59 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.49 2bqp h ALA 127 Cb 1.94 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.73 2bqp h ALA 127 CO -0.17 0.01 0.00 -2.67 0.00 0.00 0.00 179.25 176.43 2bqp n TRP 128 N -3.12 0.00 -1.53 0.00 2.14 -0.59 -5.09 117.44 109.24 2bqp n TRP 128 Ca -0.01 0.00 -0.30 0.00 2.07 0.00 0.00 57.50 59.26 2bqp n TRP 128 Cb 0.22 0.00 0.08 0.00 -0.81 0.00 0.00 31.31 30.79 2bqp n TRP 128 CO 0.00 0.00 0.00 -0.51 2.07 0.00 0.00 177.69 179.25 2bqp s ASP 129 N 0.00 4.79 0.20 -0.67 1.01 0.35 -4.77 116.67 117.58 2bqp s ASP 129 Ca 0.00 1.45 -0.32 0.00 0.71 0.00 0.00 52.55 54.39 2bqp s ASP 129 Cb 0.00 -2.23 -0.14 0.00 1.01 0.00 0.00 42.92 41.55 2bqp s ASP 129 CO 0.00 -1.80 1.36 -2.65 0.21 0.00 0.00 175.17 172.29 2bqp n PRO 130 N -3.34 1.74 -0.16 8.23 -0.02 -1.26 -4.86 135.00 135.33 2bqp n PRO 130 Ca 0.07 0.62 0.19 0.00 -2.02 0.00 0.00 63.50 62.37 2bqp n PRO 130 Cb 0.55 -2.25 0.57 0.00 -0.02 0.00 0.00 33.50 32.36 2bqp n PRO 130 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2bqp h SER 131 N 4.22 0.26 0.10 2.55 0.02 -1.95 -1.43 113.55 117.32 2bqp h SER 131 Ca -0.45 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 2bqp h SER 131 Cb 1.30 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.81 2bqp h SER 131 CO 0.76 0.12 0.00 -0.46 -1.14 0.00 0.00 176.83 176.11 2bqp n ASN 132 N -4.44 0.14 -0.45 3.07 0.23 -1.26 -4.83 115.26 107.72 2bqp n ASN 132 Ca 0.15 0.56 -0.06 0.00 -0.53 0.00 0.00 54.58 54.70 2bqp n ASN 132 Cb 0.65 -0.58 -0.03 0.00 -2.08 0.00 0.00 39.78 37.75 2bqp n ASN 132 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 2bqp n ARG 133 N -1.68 -1.19 -2.68 -3.83 1.74 -0.54 -5.00 116.66 103.48 2bqp n ARG 133 Ca 0.00 0.61 -0.33 0.00 -0.77 0.00 0.00 57.85 57.37 2bqp n ARG 133 Cb 0.04 -4.65 -0.06 0.00 -1.02 0.00 0.00 32.46 26.77 2bqp n ARG 133 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2bqp s ASP 134 N -2.35 6.83 0.56 0.55 1.01 -1.26 -4.75 116.67 117.25 2bqp s ASP 134 Ca 0.00 1.64 -0.18 0.00 0.71 0.00 0.00 52.55 54.72 2bqp s ASP 134 Cb 0.00 -2.53 -0.05 0.00 1.01 0.00 0.00 42.92 41.35 2bqp s ASP 134 CO 0.00 -0.43 1.08 -0.13 0.21 0.00 0.00 175.17 175.89 2bqp s ARG 135 N -3.48 3.40 0.25 8.23 0.52 -1.26 -4.85 118.95 121.77 2bqp s ARG 135 Ca 0.61 1.38 -0.18 0.00 -0.52 0.00 0.00 55.73 57.02 2bqp s ARG 135 Cb -0.09 -2.03 0.02 0.00 0.52 0.00 0.00 34.95 33.36 2bqp s ARG 135 CO 0.19 -0.76 0.61 -3.38 0.02 0.00 0.00 175.30 171.97 2bqp s HIS 136 N -2.12 -0.03 -0.06 -0.53 -3.43 -0.94 -1.63 115.29 106.55 2bqp s HIS 136 Ca 0.68 -0.37 -0.02 0.00 -0.80 0.00 0.00 55.06 54.54 2bqp s HIS 136 Cb -0.19 0.49 -0.04 0.00 -1.43 0.00 0.00 32.58 31.42 2bqp s HIS 136 CO 0.30 -1.09 0.05 0.42 -2.00 0.00 0.00 174.74 172.42 2bqp s ILE 137 N -3.93 4.64 0.06 -5.38 1.01 0.12 -1.54 121.20 116.18 2bqp s ILE 137 Ca 0.14 -0.23 -0.15 0.00 0.00 0.00 0.00 60.65 60.40 2bqp s ILE 137 Cb -0.03 -3.02 0.03 0.00 0.01 0.00 0.00 42.46 39.44 2bqp s ILE 137 CO 0.05 0.52 0.34 -0.83 0.00 0.00 0.00 174.94 175.02 2bqp s GLY 138 N -1.20 -0.17 -0.24 6.18 0.00 -0.63 -0.37 107.32 110.89 2bqp s GLY 138 Ca 0.17 0.02 -0.05 0.00 0.00 0.00 0.00 44.72 44.86 2bqp s GLY 138 CO 0.06 -0.21 0.00 -0.42 0.00 0.00 0.00 173.10 172.54 2bqp s ILE 139 N -2.89 3.67 -0.09 0.90 1.01 -0.56 -0.66 121.20 122.57 2bqp s ILE 139 Ca -0.03 -0.48 -0.01 0.00 0.00 0.00 0.00 60.65 60.13 2bqp s ILE 139 Cb 0.00 -2.73 -0.03 0.00 0.01 0.00 0.00 42.46 39.71 2bqp s ILE 139 CO -0.05 0.33 -0.02 -1.81 0.00 0.00 0.00 174.94 173.39 2bqp s ASP 140 N 1.51 5.03 -0.25 3.58 1.01 0.13 -0.25 116.67 127.41 2bqp s ASP 140 Ca 0.05 0.06 -0.03 0.00 0.71 0.00 0.00 52.55 53.35 2bqp s ASP 140 Cb -0.15 -1.44 0.08 0.00 1.01 0.00 0.00 42.92 42.42 2bqp s ASP 140 CO -0.01 0.34 0.08 -0.69 0.21 0.00 0.00 175.17 175.11 2bqp s VAL 141 N -0.67 0.47 -1.46 -1.27 1.01 -1.26 -1.06 120.40 116.16 2bqp s VAL 141 Ca 0.10 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.21 2bqp s VAL 141 Cb -0.12 -1.21 0.00 0.00 0.00 0.00 0.00 36.38 35.05 2bqp s VAL 141 CO 0.02 -0.50 0.00 0.59 0.00 0.00 0.00 175.10 175.21 2bqp n ASN 142 N 5.04 -4.69 -3.59 3.32 5.03 -0.36 -4.83 115.26 115.18 2bqp n ASN 142 Ca -0.06 0.17 -0.09 0.00 0.87 0.00 0.00 54.58 55.47 2bqp n ASN 142 Cb 0.44 -4.01 -0.05 0.00 -1.02 0.00 0.00 39.78 35.15 2bqp n ASN 142 CO 0.00 0.00 0.00 -0.55 -1.83 0.00 0.00 177.26 174.88 2bqp s SER 143 N -2.12 -0.33 0.00 6.41 0.15 -1.26 -0.67 113.70 115.89 2bqp s SER 143 Ca 0.00 0.36 0.29 0.00 0.70 0.00 0.00 55.95 57.30 2bqp s SER 143 Cb 0.00 0.27 1.24 0.00 -1.71 0.00 0.00 66.02 65.81 2bqp s SER 143 CO 0.00 -0.30 1.92 0.00 1.20 0.00 0.00 173.24 176.06 2bqp n ILE 144 N 0.70 0.00 -3.00 6.45 0.13 -0.88 -4.54 119.36 118.22 2bqp n ILE 144 Ca -0.09 -0.00 -0.43 0.00 -1.10 0.00 0.00 62.75 61.13 2bqp n ILE 144 Cb 0.58 -0.47 -0.05 0.00 -0.84 0.00 0.00 39.64 38.86 2bqp n ILE 144 CO 0.00 0.00 0.00 -0.75 2.80 0.00 0.00 176.55 178.60 2bqp s LYS 145 N -2.96 3.19 0.58 9.51 2.20 -1.26 -4.93 119.74 126.06 2bqp s LYS 145 Ca 0.15 -0.69 -0.18 0.00 -0.36 0.00 0.00 55.97 54.89 2bqp s LYS 145 Cb 0.19 -4.11 -0.06 0.00 -1.51 0.00 0.00 37.83 32.33 2bqp s LYS 145 CO 0.53 -1.42 0.78 0.43 -0.36 0.00 0.00 175.35 175.31 2bqp n SER 146 N 6.86 0.01 0.15 1.43 7.64 -1.26 -4.79 113.62 123.66 2bqp n SER 146 Ca -0.03 0.78 0.03 0.00 1.01 0.00 0.00 58.87 60.66 2bqp n SER 146 Cb 0.46 -1.30 0.04 0.00 -1.01 0.00 0.00 64.21 62.40 2bqp n SER 146 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 2bqp h VAL 147 N 0.39 0.77 -2.01 0.44 -1.51 -1.00 -3.46 116.25 109.88 2bqp h VAL 147 Ca -0.47 -2.09 -0.05 0.00 -1.23 0.00 0.00 66.70 62.86 2bqp h VAL 147 Cb 1.38 2.38 -0.20 0.00 -2.13 0.00 0.00 31.29 32.72 2bqp h VAL 147 CO 0.49 0.44 0.15 0.21 -1.23 0.00 0.00 177.57 177.63 2bqp s ASN 148 N -6.43 -0.71 0.19 4.19 3.84 -1.25 -5.02 114.94 109.75 2bqp s ASN 148 Ca 0.04 1.16 -0.01 0.00 0.21 0.00 0.00 52.86 54.27 2bqp s ASN 148 Cb 0.07 1.11 -0.04 0.00 -0.55 0.00 0.00 41.25 41.84 2bqp s ASN 148 CO 0.74 -0.39 0.11 0.42 -2.79 0.00 0.00 177.10 175.19 2bqp s THR 149 N -0.23 0.09 -0.15 -5.21 -4.23 -1.26 -1.50 115.64 103.14 2bqp s THR 149 Ca -0.04 -1.98 -0.07 0.00 -1.18 0.00 0.00 61.69 58.41 2bqp s THR 149 Cb -0.03 -2.43 0.06 0.00 1.34 0.00 0.00 72.50 71.44 2bqp s THR 149 CO 0.04 -0.09 0.35 -0.75 -0.54 0.00 0.00 174.62 173.64 2bqp s LYS 150 N -4.12 0.29 0.71 3.99 2.47 0.50 -4.94 119.74 118.63 2bqp s LYS 150 Ca 0.36 0.78 -0.16 0.00 -1.56 0.00 0.00 55.97 55.39 2bqp s LYS 150 Cb 0.07 0.03 0.00 0.00 -1.46 0.00 0.00 37.83 36.47 2bqp s LYS 150 CO 0.10 -0.20 1.01 0.43 0.16 0.00 0.00 175.35 176.85 2bqp n SER 151 N 4.68 0.70 -3.66 1.43 7.64 -1.26 -0.70 113.62 122.44 2bqp n SER 151 Ca -0.18 0.69 -0.09 0.00 1.01 0.00 0.00 58.87 60.31 2bqp n SER 151 Cb 0.53 -1.43 -0.08 0.00 -1.01 0.00 0.00 64.21 62.21 2bqp n SER 151 CO 0.00 0.00 0.00 0.86 -3.01 0.00 0.00 175.04 172.89 2bqp s TRP 152 N -1.76 -0.88 -0.29 1.43 -0.00 -0.65 -4.76 118.94 112.05 2bqp s TRP 152 Ca 0.75 1.80 -0.17 0.00 -0.00 0.00 0.00 56.10 58.48 2bqp s TRP 152 Cb -0.35 0.48 -0.03 0.00 -0.00 0.00 0.00 33.47 33.58 2bqp s TRP 152 CO 0.49 -0.45 0.45 0.15 -0.00 0.00 0.00 176.95 177.59 2bqp s LYS 153 N 1.51 3.93 0.03 5.86 3.01 -1.26 -4.26 119.74 128.56 2bqp s LYS 153 Ca -0.10 0.07 -0.30 0.00 -1.01 0.00 0.00 55.97 54.63 2bqp s LYS 153 Cb -0.06 -3.69 -0.05 0.00 -1.01 0.00 0.00 37.83 33.02 2bqp s LYS 153 CO -0.17 -0.39 1.15 -1.17 0.51 0.00 0.00 175.35 175.28 2bqp s LEU 154 N 2.22 4.35 -0.56 3.17 2.96 -1.26 -4.98 118.68 124.58 2bqp s LEU 154 Ca 0.18 1.90 -0.12 0.00 -0.22 0.00 0.00 54.13 55.86 2bqp s LEU 154 Cb -0.16 -3.57 0.14 0.00 0.50 0.00 0.00 46.19 43.10 2bqp s LEU 154 CO 0.10 -0.44 0.47 -1.10 -1.32 0.00 0.00 176.35 174.06 2bqp s GLN 155 N 1.25 2.84 0.08 1.98 -0.21 -1.26 -5.03 119.66 119.31 2bqp s GLN 155 Ca 0.57 -1.88 -0.33 0.00 0.02 0.00 0.00 55.36 53.73 2bqp s GLN 155 Cb -0.27 -4.13 -0.13 0.00 1.00 0.00 0.00 33.01 29.49 2bqp s GLN 155 CO 0.28 -1.26 1.71 -1.71 -2.12 0.00 0.00 175.29 172.19 2bqp n ASN 156 N 4.84 3.38 0.00 5.90 5.15 -1.26 -2.05 115.26 131.21 2bqp n ASN 156 Ca -0.06 1.03 0.00 0.00 -0.60 0.00 0.00 54.58 54.95 2bqp n ASN 156 Cb 0.41 -1.43 0.00 0.00 -0.53 0.00 0.00 39.78 38.23 2bqp n ASN 156 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2bqp n GLY 157 N 3.85 1.58 3.89 8.20 0.00 0.13 -5.02 105.19 117.82 2bqp n GLY 157 Ca 0.19 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.89 2bqp n GLY 157 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2bqp s GLU 158 N -0.15 3.63 -0.02 1.61 0.41 -0.87 -4.90 118.70 118.42 2bqp s GLU 158 Ca 0.00 -0.06 -0.18 0.00 -0.41 0.00 0.00 54.97 54.32 2bqp s GLU 158 Cb 0.00 -2.86 -0.05 0.00 -1.78 0.00 0.00 34.13 29.44 2bqp s GLU 158 CO 0.00 0.48 0.51 -1.83 -0.49 0.00 0.00 175.26 173.92 2bqp s GLU 159 N -2.57 4.19 -0.07 1.61 -1.05 -1.26 -4.35 118.70 115.20 2bqp s GLU 159 Ca 0.40 0.57 0.03 0.00 -0.15 0.00 0.00 54.97 55.82 2bqp s GLU 159 Cb -0.12 -3.31 -0.02 0.00 -0.44 0.00 0.00 34.13 30.24 2bqp s GLU 159 CO 0.24 0.46 -0.17 0.00 0.95 0.00 0.00 175.26 176.74 2bqp s ALA 160 N -0.42 2.53 -0.21 -0.84 0.00 0.14 -4.56 121.76 118.40 2bqp s ALA 160 Ca 0.27 -0.98 -0.11 0.00 0.00 0.00 0.00 51.96 51.15 2bqp s ALA 160 Cb -0.17 -0.95 -0.05 0.00 0.00 0.00 0.00 23.12 21.95 2bqp s ALA 160 CO 0.15 0.45 0.18 -0.80 0.00 0.00 0.00 175.76 175.73 2bqp s ASN 161 N -0.33 6.22 -0.03 0.00 -0.87 -0.64 -1.18 114.94 118.10 2bqp s ASN 161 Ca 0.03 0.24 0.07 0.00 -1.57 0.00 0.00 52.86 51.62 2bqp s ASN 161 Cb -0.13 -2.11 -0.02 0.00 -0.02 0.00 0.00 41.25 38.97 2bqp s ASN 161 CO 0.02 0.11 -0.24 -0.69 -2.57 0.00 0.00 177.10 173.74 2bqp s VAL 162 N 0.68 1.89 -0.08 1.60 1.01 0.56 -1.29 120.40 124.77 2bqp s VAL 162 Ca 0.09 -1.01 0.02 0.00 0.00 0.00 0.00 61.98 61.08 2bqp s VAL 162 Cb -0.12 -1.58 0.02 0.00 0.00 0.00 0.00 36.38 34.69 2bqp s VAL 162 CO 0.02 0.53 -0.12 -0.69 0.00 0.00 0.00 175.10 174.84 2bqp s VAL 163 N -0.41 1.20 -0.15 2.92 1.01 -0.62 -1.89 120.40 122.46 2bqp s VAL 163 Ca 0.05 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.56 2bqp s VAL 163 Cb -0.11 -1.11 0.02 0.00 0.00 0.00 0.00 36.38 35.18 2bqp s VAL 163 CO 0.01 0.38 -0.16 -0.63 0.00 0.00 0.00 175.10 174.70 2bqp s ILE 164 N 0.93 1.66 0.13 2.22 1.01 -0.43 -1.29 121.20 125.43 2bqp s ILE 164 Ca -0.09 -0.70 0.09 0.00 0.00 0.00 0.00 60.65 59.95 2bqp s ILE 164 Cb -0.15 -1.54 -0.04 0.00 0.01 0.00 0.00 42.46 40.74 2bqp s ILE 164 CO 0.00 0.47 -0.22 0.00 0.00 0.00 0.00 174.94 175.20 2bqp s ALA 165 N 1.37 2.04 -0.08 9.38 0.00 -0.68 -0.82 121.76 132.97 2bqp s ALA 165 Ca 0.03 -1.37 0.00 0.00 0.00 0.00 0.00 51.96 50.62 2bqp s ALA 165 Cb -0.13 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.74 2bqp s ALA 165 CO -0.10 0.39 -0.06 0.12 0.00 0.00 0.00 175.76 176.11 2bqp s PHE 166 N -1.34 1.13 -0.36 0.00 5.36 0.03 -0.49 117.98 122.32 2bqp s PHE 166 Ca 0.11 -0.45 -0.13 0.00 -0.96 0.00 0.00 56.93 55.50 2bqp s PHE 166 Cb -0.09 -0.96 -0.01 0.00 -0.34 0.00 0.00 43.02 41.62 2bqp s PHE 166 CO 0.06 -0.34 0.25 1.21 -1.46 0.00 0.00 175.22 174.93 2bqp s ASN 167 N 1.32 6.02 0.44 6.13 3.84 -0.56 -2.63 114.94 129.50 2bqp s ASN 167 Ca -0.04 -0.56 0.11 0.00 0.21 0.00 0.00 52.86 52.58 2bqp s ASN 167 Cb -0.14 -2.13 1.01 0.00 -0.55 0.00 0.00 41.25 39.44 2bqp s ASN 167 CO -0.03 -0.29 2.06 0.00 -2.79 0.00 0.00 177.10 176.06 2bqp h ALA 168 N 8.51 1.87 -0.05 1.71 0.00 -1.86 0.21 119.26 129.65 2bqp h ALA 168 Ca -0.30 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.45 2bqp h ALA 168 Cb 1.15 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2bqp h ALA 168 CO 0.66 0.09 -0.59 0.00 0.00 0.00 0.00 179.25 179.40 2bqp h ALA 169 N 1.79 0.92 0.00 0.00 0.00 -1.93 -3.32 119.26 116.72 2bqp h ALA 169 Ca 0.15 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.52 2bqp h ALA 169 Cb 0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.82 2bqp h ALA 169 CO -0.03 0.72 -0.88 0.25 0.00 0.00 0.00 179.25 179.31 2bqp n THR 170 N -3.87 0.00 -2.21 0.00 -2.24 -1.00 -4.99 114.28 99.97 2bqp n THR 170 Ca -0.02 -0.24 -0.16 0.00 -2.27 0.00 0.00 64.05 61.36 2bqp n THR 170 Cb 0.60 0.74 -0.01 0.00 -2.10 0.00 0.00 70.33 69.56 2bqp n THR 170 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 2bqp n ASN 171 N -1.49 -4.70 -4.73 3.42 5.03 0.72 -4.90 115.26 108.60 2bqp n ASN 171 Ca 0.01 0.03 -0.35 0.00 0.87 0.00 0.00 54.58 55.13 2bqp n ASN 171 Cb 0.22 -3.81 -0.08 0.00 -1.02 0.00 0.00 39.78 35.10 2bqp n ASN 171 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2bqp s VAL 172 N -2.76 5.38 -0.21 2.41 1.01 -1.20 0.31 120.40 125.34 2bqp s VAL 172 Ca 0.00 0.28 -0.05 0.00 0.00 0.00 0.00 61.98 62.21 2bqp s VAL 172 Cb 0.00 -3.51 -0.02 0.00 0.00 0.00 0.00 36.38 32.85 2bqp s VAL 172 CO 0.00 0.43 0.01 -0.22 0.00 0.00 0.00 175.10 175.32 2bqp s LEU 173 N 0.35 3.23 0.04 3.92 2.96 0.17 -1.49 118.68 127.85 2bqp s LEU 173 Ca 0.10 -0.24 0.07 0.00 -0.22 0.00 0.00 54.13 53.84 2bqp s LEU 173 Cb -0.12 -1.83 -0.03 0.00 0.50 0.00 0.00 46.19 44.71 2bqp s LEU 173 CO -0.00 0.03 -0.17 -0.89 -1.32 0.00 0.00 176.35 173.99 2bqp s THR 174 N 1.22 2.83 0.00 3.68 2.01 0.36 -2.23 115.64 123.52 2bqp s THR 174 Ca 0.03 -1.17 0.05 0.00 0.31 0.00 0.00 61.69 60.91 2bqp s THR 174 Cb -0.15 -2.20 -0.01 0.00 0.01 0.00 0.00 72.50 70.16 2bqp s THR 174 CO 0.01 0.34 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.44 2bqp s VAL 175 N -0.93 1.15 -0.02 3.82 1.01 0.57 -1.68 120.40 124.32 2bqp s VAL 175 Ca 0.15 -0.73 -0.00 0.00 0.00 0.00 0.00 61.98 61.39 2bqp s VAL 175 Cb -0.11 -0.98 0.03 0.00 0.00 0.00 0.00 36.38 35.33 2bqp s VAL 175 CO 0.05 0.24 0.04 -0.44 0.00 0.00 0.00 175.10 174.99 2bqp s SER 176 N -0.57 0.05 -0.10 3.32 0.01 -0.41 -1.37 113.70 114.64 2bqp s SER 176 Ca 0.05 0.07 0.03 0.00 1.31 0.00 0.00 55.95 57.40 2bqp s SER 176 Cb -0.06 -0.04 0.01 0.00 0.21 0.00 0.00 66.02 66.13 2bqp s SER 176 CO 0.00 -0.13 -0.19 -0.22 0.41 0.00 0.00 173.24 173.11 2bqp s LEU 177 N 1.05 1.91 -0.03 2.44 0.20 -0.00 -1.58 118.68 122.66 2bqp s LEU 177 Ca -0.09 -0.47 0.03 0.00 0.69 0.00 0.00 54.13 54.29 2bqp s LEU 177 Cb -0.12 -1.20 0.00 0.00 -0.43 0.00 0.00 46.19 44.43 2bqp s LEU 177 CO -0.03 0.10 -0.12 -0.89 -0.29 0.00 0.00 176.35 175.12 2bqp s THR 178 N 0.57 1.01 0.16 3.68 2.01 -0.41 -0.65 115.64 122.01 2bqp s THR 178 Ca -0.15 -0.48 0.07 0.00 0.31 0.00 0.00 61.69 61.44 2bqp s THR 178 Cb -0.17 -0.89 -0.04 0.00 0.01 0.00 0.00 72.50 71.41 2bqp s THR 178 CO 0.05 0.31 0.02 -0.31 -0.69 0.00 0.00 174.62 174.00 2bqp s TYR 179 N 0.19 2.91 0.17 4.92 2.02 0.16 -1.62 117.35 126.10 2bqp s TYR 179 Ca -0.04 -0.10 -0.07 0.00 -0.37 0.00 0.00 57.07 56.48 2bqp s TYR 179 Cb -0.10 -1.42 0.04 0.00 -0.40 0.00 0.00 41.96 40.08 2bqp s TYR 179 CO 0.01 0.51 1.51 -1.35 -1.57 0.00 0.00 175.55 174.66 2bqp h PRO 180 N 2.76 0.79 -3.46 -1.71 0.11 -1.87 -2.36 132.00 126.25 2bqp h PRO 180 Ca -0.47 -0.43 -0.69 0.00 0.11 0.00 0.00 66.00 64.52 2bqp h PRO 180 Cb 1.20 0.02 -0.36 0.00 0.11 0.00 0.00 31.00 31.97 2bqp h PRO 180 CO 0.59 1.06 -0.33 -0.80 -0.21 0.00 0.00 178.00 178.31 2bqp s ASN 181 N -6.87 5.33 -0.48 -2.05 0.01 -1.26 -4.53 114.94 105.10 2bqp s ASN 181 Ca -0.10 -3.14 -0.27 0.00 -0.71 0.00 0.00 52.86 48.64 2bqp s ASN 181 Cb 0.11 -1.84 -0.02 0.00 0.41 0.00 0.00 41.25 39.91 2bqp s ASN 181 CO 0.86 -0.30 1.80 -0.69 -1.51 0.00 0.00 177.10 177.26 2bqp s VAL 188 N -0.47 3.45 -0.18 1.60 1.01 -1.26 -5.10 120.40 119.45 2bqp s VAL 188 Ca 0.20 0.38 0.00 0.00 0.00 0.00 0.00 61.98 62.56 2bqp s VAL 188 Cb -0.17 -3.84 0.01 0.00 0.00 0.00 0.00 36.38 32.38 2bqp s VAL 188 CO -0.06 -0.69 -0.17 -0.89 0.00 0.00 0.00 175.10 173.29 2bqp s THR 189 N 7.89 2.35 0.13 3.92 2.01 -0.89 -4.97 115.64 126.08 2bqp s THR 189 Ca 0.72 -0.85 0.10 0.00 0.31 0.00 0.00 61.69 61.96 2bqp s THR 189 Cb -0.17 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.31 2bqp s THR 189 CO 0.27 0.52 -0.23 -0.44 -0.69 0.00 0.00 174.62 174.05 2bqp s SER 190 N 1.22 2.92 -0.01 3.53 0.01 -1.26 -0.67 113.70 119.45 2bqp s SER 190 Ca 0.03 -0.76 0.02 0.00 1.31 0.00 0.00 55.95 56.55 2bqp s SER 190 Cb -0.14 -0.18 0.00 0.00 0.21 0.00 0.00 66.02 65.91 2bqp s SER 190 CO -0.09 0.09 -0.06 -0.31 0.41 0.00 0.00 173.24 173.28 2bqp s TYR 191 N -1.32 0.65 0.06 2.43 2.02 0.18 -4.98 117.35 116.39 2bqp s TYR 191 Ca 0.12 -0.13 0.03 0.00 -0.37 0.00 0.00 57.07 56.72 2bqp s TYR 191 Cb -0.09 -0.45 -0.03 0.00 -0.40 0.00 0.00 41.96 40.99 2bqp s TYR 191 CO 0.06 -0.04 -0.10 -0.08 -1.57 0.00 0.00 175.55 173.81 2bqp s THR 192 N 0.05 0.77 -0.17 -0.71 -1.32 -1.26 -0.82 115.64 112.17 2bqp s THR 192 Ca -0.00 -1.23 -0.13 0.00 -1.21 0.00 0.00 61.69 59.12 2bqp s THR 192 Cb -0.05 -0.86 0.05 0.00 -1.51 0.00 0.00 72.50 70.14 2bqp s THR 192 CO -0.00 -0.36 0.44 -0.22 -2.21 0.00 0.00 174.62 172.27 2bqp s LEU 193 N -1.75 0.08 0.12 9.08 2.96 -0.47 -4.99 118.68 123.71 2bqp s LEU 193 Ca -0.05 0.92 0.03 0.00 -0.22 0.00 0.00 54.13 54.81 2bqp s LEU 193 Cb -0.09 1.48 -0.04 0.00 0.50 0.00 0.00 46.19 48.04 2bqp s LEU 193 CO 0.01 -0.17 -0.09 -0.44 -1.32 0.00 0.00 176.35 174.34 2bqp s SER 194 N 0.79 1.45 -0.15 3.68 0.01 -1.26 -0.31 113.70 117.91 2bqp s SER 194 Ca -0.05 -0.97 -0.32 0.00 1.31 0.00 0.00 55.95 55.92 2bqp s SER 194 Cb -0.05 0.04 0.13 0.00 0.21 0.00 0.00 66.02 66.35 2bqp s SER 194 CO -0.06 -0.38 1.11 -0.62 0.41 0.00 0.00 173.24 173.70 2bqp s ASP 195 N -2.98 -0.22 -0.27 2.44 -1.08 -0.95 -5.00 116.67 108.62 2bqp s ASP 195 Ca 0.12 0.08 -0.20 0.00 -0.52 0.00 0.00 52.55 52.04 2bqp s ASP 195 Cb 0.03 0.22 -0.02 0.00 -1.46 0.00 0.00 42.92 41.69 2bqp s ASP 195 CO -0.02 -0.32 0.63 -0.69 0.52 0.00 0.00 175.17 175.29 2bqp s VAL 196 N -2.16 4.97 -0.10 1.11 1.01 -1.26 -0.65 120.40 123.31 2bqp s VAL 196 Ca 0.06 1.04 0.02 0.00 0.00 0.00 0.00 61.98 63.10 2bqp s VAL 196 Cb -0.01 -3.95 -0.01 0.00 0.00 0.00 0.00 36.38 32.40 2bqp s VAL 196 CO -0.05 -0.02 -0.16 -0.69 0.00 0.00 0.00 175.10 174.18 2bqp s VAL 197 N 2.54 2.81 -1.10 2.92 1.01 0.15 -4.96 120.40 123.77 2bqp s VAL 197 Ca 0.26 -0.77 -0.10 0.00 0.00 0.00 0.00 61.98 61.37 2bqp s VAL 197 Cb -0.15 -2.14 0.26 0.00 0.00 0.00 0.00 36.38 34.35 2bqp s VAL 197 CO 0.10 0.55 1.13 -0.55 0.00 0.00 0.00 175.10 176.32 2bqp s SER 198 N 0.08 7.24 0.20 3.32 0.15 -1.26 -4.63 113.70 118.80 2bqp s SER 198 Ca -0.07 -3.44 -0.18 0.00 0.70 0.00 0.00 55.95 52.97 2bqp s SER 198 Cb -0.15 -2.24 0.18 0.00 -1.71 0.00 0.00 66.02 62.10 2bqp s SER 198 CO 0.05 -0.38 1.59 -0.07 1.20 0.00 0.00 173.24 175.64 2bqp h LEU 199 N 7.18 -1.00 -1.61 3.45 4.07 -1.96 -1.52 115.31 123.90 2bqp h LEU 199 Ca 0.19 0.22 0.00 0.00 0.08 0.00 0.00 57.88 58.37 2bqp h LEU 199 Cb 0.89 0.54 0.00 0.00 1.08 0.00 0.00 40.66 43.16 2bqp h LEU 199 CO 1.02 -0.28 0.40 0.50 -1.08 0.00 0.00 178.44 179.00 2bqp h LYS 200 N -0.11 0.00 -0.15 1.13 3.64 -1.91 -0.06 116.57 119.12 2bqp h LYS 200 Ca 0.27 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.65 2bqp h LYS 200 Cb 0.54 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.36 2bqp h LYS 200 CO -0.70 0.00 0.00 -0.25 -2.27 0.00 0.00 179.45 176.23 2bqp n ASP 201 N -2.71 2.47 -0.01 4.20 8.00 -0.58 -4.70 116.55 123.22 2bqp n ASP 201 Ca -0.02 -1.71 -0.02 0.00 0.71 0.00 0.00 54.79 53.76 2bqp n ASP 201 Cb 0.44 -0.09 -0.01 0.00 -0.02 0.00 0.00 41.12 41.44 2bqp n ASP 201 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 2bqp n VAL 202 N 0.78 0.12 -4.20 2.53 0.31 -0.08 -5.07 118.33 112.72 2bqp n VAL 202 Ca 0.10 -0.04 -0.28 0.00 -0.01 0.00 0.00 64.34 64.11 2bqp n VAL 202 Cb 0.39 -0.99 -0.08 0.00 -0.91 0.00 0.00 33.84 32.24 2bqp n VAL 202 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2bqp s VAL 203 N -2.04 3.65 1.00 2.52 -7.23 -0.95 -4.25 120.40 113.08 2bqp s VAL 203 Ca -0.03 -1.34 -0.12 0.00 -1.81 0.00 0.00 61.98 58.69 2bqp s VAL 203 Cb 0.01 -2.79 0.19 0.00 0.56 0.00 0.00 36.38 34.35 2bqp s VAL 203 CO 0.04 -0.02 1.08 -2.16 -0.31 0.00 0.00 175.10 173.73 2bqp s PRO 204 N -2.66 0.42 0.38 4.82 0.04 -1.26 -4.73 135.00 132.00 2bqp s PRO 204 Ca 0.26 0.89 0.28 0.00 0.04 0.00 0.00 61.00 62.46 2bqp s PRO 204 Cb -0.10 -1.71 1.16 0.00 0.04 0.00 0.00 34.50 33.90 2bqp s PRO 204 CO 0.17 -2.84 1.83 1.05 0.04 0.00 0.00 177.00 177.26 2bqp h GLU 205 N -1.98 0.00 -5.18 4.56 4.11 -1.95 -3.40 114.58 110.74 2bqp h GLU 205 Ca -0.53 0.00 -0.66 0.00 0.07 0.00 0.00 59.36 58.24 2bqp h GLU 205 Cb 1.30 0.00 -0.34 0.00 0.50 0.00 0.00 28.75 30.22 2bqp h GLU 205 CO 0.52 0.00 -0.87 -1.58 0.07 0.00 0.00 179.01 177.15 2bqp s TRP 206 N -3.47 2.47 0.26 2.06 0.52 -1.26 -1.44 118.94 118.08 2bqp s TRP 206 Ca 0.03 -1.12 0.02 0.00 0.02 0.00 0.00 56.10 55.04 2bqp s TRP 206 Cb 0.09 -1.68 -0.04 0.00 -1.15 0.00 0.00 33.47 30.69 2bqp s TRP 206 CO 0.45 -0.49 0.14 0.14 0.02 0.00 0.00 176.95 177.21 2bqp s VAL 207 N 0.61 0.30 0.04 4.03 -7.23 -0.56 -4.13 120.40 113.46 2bqp s VAL 207 Ca -0.13 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.12 2bqp s VAL 207 Cb -0.17 -2.55 -0.03 0.00 0.56 0.00 0.00 36.38 34.20 2bqp s VAL 207 CO 0.03 0.00 -0.21 -0.13 -0.31 0.00 0.00 175.10 174.48 2bqp s ARG 208 N -3.96 1.45 0.14 4.82 0.52 -0.17 -0.20 118.95 121.55 2bqp s ARG 208 Ca 0.37 -0.96 0.10 0.00 -0.52 0.00 0.00 55.73 54.73 2bqp s ARG 208 Cb 0.06 -1.57 -0.04 0.00 0.52 0.00 0.00 34.95 33.92 2bqp s ARG 208 CO 0.15 0.40 -0.20 0.96 0.02 0.00 0.00 175.30 176.63 2bqp s ILE 209 N -0.79 2.64 0.00 1.52 -4.36 -1.26 -1.81 121.20 117.14 2bqp s ILE 209 Ca 0.08 -1.70 0.00 0.00 -0.26 0.00 0.00 60.65 58.77 2bqp s ILE 209 Cb -0.09 -2.23 0.00 0.00 1.25 0.00 0.00 42.46 41.39 2bqp s ILE 209 CO 0.02 0.03 0.00 0.61 0.24 0.00 0.00 174.94 175.83 2bqp n GLY 210 N 0.62 1.47 3.39 6.27 0.00 -0.81 -1.68 105.19 114.44 2bqp n GLY 210 Ca -0.15 -0.85 -0.24 0.00 0.00 0.00 0.00 46.02 44.78 2bqp n GLY 210 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2bqp s PHE 211 N -4.87 2.08 -0.11 1.61 0.08 0.32 -1.73 117.98 115.35 2bqp s PHE 211 Ca 0.00 -0.41 -0.09 0.00 0.12 0.00 0.00 56.93 56.55 2bqp s PHE 211 Cb 0.00 -1.01 0.03 0.00 -0.57 0.00 0.00 43.02 41.47 2bqp s PHE 211 CO 0.00 0.46 0.28 0.45 -0.10 0.00 0.00 175.22 176.31 2bqp s SER 212 N -2.82 -0.30 -0.07 1.36 0.15 -0.34 -2.18 113.70 109.50 2bqp s SER 212 Ca 0.20 0.58 -0.08 0.00 0.70 0.00 0.00 55.95 57.35 2bqp s SER 212 Cb -0.06 0.57 0.02 0.00 -1.71 0.00 0.00 66.02 64.83 2bqp s SER 212 CO 0.09 -0.11 0.21 0.00 1.20 0.00 0.00 173.24 174.63 2bqp s ALA 213 N 0.31 -0.51 0.17 5.45 0.00 -0.40 -0.03 121.76 126.75 2bqp s ALA 213 Ca -0.01 0.51 0.01 0.00 0.00 0.00 0.00 51.96 52.47 2bqp s ALA 213 Cb -0.03 -0.28 -0.05 0.00 0.00 0.00 0.00 23.12 22.76 2bqp s ALA 213 CO -0.01 -0.12 0.02 0.95 0.00 0.00 0.00 175.76 176.60 2bqp s THR 214 N -0.09 0.57 0.28 0.00 -4.23 -1.10 -1.21 115.64 109.86 2bqp s THR 214 Ca -0.02 -1.97 0.02 0.00 -1.18 0.00 0.00 61.69 58.54 2bqp s THR 214 Cb -0.02 -2.13 -0.05 0.00 1.34 0.00 0.00 72.50 71.64 2bqp s THR 214 CO 0.01 -0.45 0.11 0.42 -0.54 0.00 0.00 174.62 174.17 2bqp s THR 215 N -3.73 0.51 0.00 3.99 -4.23 -0.71 -0.89 115.64 110.59 2bqp s THR 215 Ca 0.25 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 2bqp s THR 215 Cb 0.06 -2.60 0.00 0.00 1.34 0.00 0.00 72.50 71.31 2bqp s THR 215 CO 0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 2bqp n GLY 216 N -0.52 3.61 0.10 3.99 0.00 -1.26 -3.16 105.19 107.95 2bqp n GLY 216 Ca 0.00 -0.32 -0.03 0.00 0.00 0.00 0.00 46.02 45.67 2bqp n GLY 216 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2bqp h ALA 217 N 1.28 0.57 -2.51 4.61 0.00 -1.96 0.22 119.26 121.47 2bqp h ALA 217 Ca 0.00 -0.70 -0.55 0.00 0.00 0.00 0.00 54.91 53.66 2bqp h ALA 217 Cb 0.00 -0.12 -0.07 0.00 0.00 0.00 0.00 17.79 17.60 2bqp h ALA 217 CO 0.00 0.96 -0.57 -1.21 0.00 0.00 0.00 179.25 178.43 2bqp s GLU 218 N -2.97 2.79 0.34 0.00 0.41 -1.26 -4.92 118.70 113.09 2bqp s GLU 218 Ca 0.01 -1.01 -0.11 0.00 -0.41 0.00 0.00 54.97 53.45 2bqp s GLU 218 Cb 0.10 -2.54 0.03 0.00 -1.78 0.00 0.00 34.13 29.94 2bqp s GLU 218 CO 0.78 0.44 0.64 1.52 -0.49 0.00 0.00 175.26 178.15 2bqp s TYR 219 N -1.92 0.44 -0.22 1.61 -0.85 -1.24 -4.33 117.35 110.84 2bqp s TYR 219 Ca 0.31 -0.91 -0.36 0.00 -0.52 0.00 0.00 57.07 55.59 2bqp s TYR 219 Cb -0.09 0.43 0.15 0.00 0.38 0.00 0.00 41.96 42.83 2bqp s TYR 219 CO 0.23 -1.32 1.32 0.00 -1.52 0.00 0.00 175.55 174.26 2bqp s ALA 220 N -2.92 -2.19 -0.07 9.51 0.00 -1.19 -4.09 121.76 120.81 2bqp s ALA 220 Ca 0.21 1.66 -0.21 0.00 0.00 0.00 0.00 51.96 53.62 2bqp s ALA 220 Cb -0.03 -0.21 -0.04 0.00 0.00 0.00 0.00 23.12 22.84 2bqp s ALA 220 CO 0.14 -0.63 0.61 0.00 0.00 0.00 0.00 175.76 175.87 2bqp s ALA 221 N -2.19 3.41 -0.16 0.00 0.00 0.04 -4.11 121.76 118.76 2bqp s ALA 221 Ca 0.11 0.01 -0.00 0.00 0.00 0.00 0.00 51.96 52.08 2bqp s ALA 221 Cb 0.00 -2.81 -0.00 0.00 0.00 0.00 0.00 23.12 20.31 2bqp s ALA 221 CO -0.04 -0.01 -0.14 -1.01 0.00 0.00 0.00 175.76 174.56 2bqp s HIS 222 N 0.54 2.79 0.02 0.00 3.76 -0.86 -1.02 115.29 120.53 2bqp s HIS 222 Ca 0.32 -0.99 0.01 0.00 -0.15 0.00 0.00 55.06 54.25 2bqp s HIS 222 Cb -0.17 -1.89 -0.02 0.00 1.11 0.00 0.00 32.58 31.61 2bqp s HIS 222 CO 0.15 -0.45 -0.04 -1.21 -0.85 0.00 0.00 174.74 172.35 2bqp s GLU 223 N 0.80 0.33 -0.07 1.40 2.02 -0.54 -1.53 118.70 121.11 2bqp s GLU 223 Ca -0.05 -0.56 0.05 0.00 0.02 0.00 0.00 54.97 54.43 2bqp s GLU 223 Cb -0.15 -0.03 -0.01 0.00 0.10 0.00 0.00 34.13 34.04 2bqp s GLU 223 CO 0.00 -0.01 -0.24 0.08 0.02 0.00 0.00 175.26 175.12 2bqp s VAL 224 N -1.21 2.18 -0.17 2.63 1.01 -0.08 -0.88 120.40 123.88 2bqp s VAL 224 Ca -0.12 -1.02 0.13 0.00 0.00 0.00 0.00 61.98 60.98 2bqp s VAL 224 Cb -0.08 -1.80 -0.19 0.00 0.00 0.00 0.00 36.38 34.30 2bqp s VAL 224 CO -0.00 0.57 0.36 0.18 0.00 0.00 0.00 175.10 176.20 2bqp n LEU 225 N 3.01 0.15 -3.46 3.92 4.77 -0.39 -0.54 117.00 124.47 2bqp n LEU 225 Ca -0.18 -0.13 -0.12 0.00 -0.03 0.00 0.00 56.01 55.56 2bqp n LEU 225 Cb 0.52 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.58 2bqp n LEU 225 CO 0.26 0.04 0.48 -0.94 -1.33 0.00 0.00 177.39 175.90 2bqp s SER 226 N -3.20 -0.53 -0.28 -1.43 1.04 -1.25 -4.22 113.70 103.83 2bqp s SER 226 Ca -0.02 0.12 -0.16 0.00 0.48 0.00 0.00 55.95 56.37 2bqp s SER 226 Cb 0.09 0.54 0.09 0.00 0.10 0.00 0.00 66.02 66.84 2bqp s SER 226 CO 0.55 -0.82 0.73 0.86 0.98 0.00 0.00 173.24 175.53 2bqp s TRP 227 N -3.15 -1.02 0.14 5.02 -0.00 -0.57 -2.76 118.94 116.60 2bqp s TRP 227 Ca -0.00 2.02 0.06 0.00 -0.00 0.00 0.00 56.10 58.18 2bqp s TRP 227 Cb -0.01 0.61 -0.04 0.00 -0.00 0.00 0.00 33.47 34.03 2bqp s TRP 227 CO -0.08 -0.51 -0.13 -1.54 -0.00 0.00 0.00 176.95 174.69 2bqp s SER 228 N 1.71 2.05 -0.07 5.86 1.04 0.63 -1.41 113.70 123.50 2bqp s SER 228 Ca -0.09 -0.88 -0.19 0.00 0.48 0.00 0.00 55.95 55.26 2bqp s SER 228 Cb -0.05 -0.07 0.04 0.00 0.10 0.00 0.00 66.02 66.04 2bqp s SER 228 CO -0.19 -0.19 0.43 0.12 0.98 0.00 0.00 173.24 174.39 2bqp s PHE 229 N -2.51 -0.38 -0.20 5.02 5.36 -0.88 -1.48 117.98 122.91 2bqp s PHE 229 Ca 0.13 0.74 -0.09 0.00 -0.96 0.00 0.00 56.93 56.74 2bqp s PHE 229 Cb -0.03 0.19 0.08 0.00 -0.34 0.00 0.00 43.02 42.91 2bqp s PHE 229 CO 0.03 -0.39 0.47 -1.58 -1.46 0.00 0.00 175.22 172.29 2bqp s HIS 230 N -0.82 -0.77 0.09 10.12 5.65 -0.66 -1.79 115.29 127.11 2bqp s HIS 230 Ca -0.09 1.54 0.04 0.00 0.25 0.00 0.00 55.06 56.81 2bqp s HIS 230 Cb -0.03 0.36 -0.03 0.00 -1.18 0.00 0.00 32.58 31.69 2bqp s HIS 230 CO 0.04 -0.43 -0.12 -1.54 -0.65 0.00 0.00 174.74 172.04 2bqp s SER 231 N 1.90 1.58 -0.13 9.88 1.04 0.01 -1.62 113.70 126.37 2bqp s SER 231 Ca -0.07 -0.75 -0.04 0.00 0.48 0.00 0.00 55.95 55.57 2bqp s SER 231 Cb -0.09 -0.02 0.06 0.00 0.10 0.00 0.00 66.02 66.07 2bqp s SER 231 CO -0.14 -0.19 0.20 -0.70 0.98 0.00 0.00 173.24 173.39 2bqp s GLU 232 N -2.44 0.10 -0.23 4.02 2.12 -0.42 -2.40 118.70 119.45 2bqp s GLU 232 Ca 0.03 0.51 -0.02 0.00 0.36 0.00 0.00 54.97 55.85 2bqp s GLU 232 Cb -0.05 -0.47 0.01 0.00 0.26 0.00 0.00 34.13 33.88 2bqp s GLU 232 CO 0.01 -0.39 -0.07 -1.17 -0.54 0.00 0.00 175.26 173.10 2bqp s LEU 233 N 2.33 2.95 0.00 2.70 2.96 0.01 -1.44 118.68 128.19 2bqp s LEU 233 Ca 0.03 -0.67 0.29 0.00 -0.22 0.00 0.00 54.13 53.56 2bqp s LEU 233 Cb -0.13 -1.67 1.25 0.00 0.50 0.00 0.00 46.19 46.14 2bqp s LEU 233 CO -0.08 -0.07 1.86 -1.54 -1.32 0.00 0.00 176.35 175.19