#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 0.05 0.05 -2.82 2.02 0.07 -5.00 118.70 113.07 2bqp s GLU 2 Ca 0.00 0.52 0.05 0.00 0.02 0.00 0.00 54.97 55.56 2bqp s GLU 2 Cb 0.00 -0.25 -0.02 0.00 0.10 0.00 0.00 34.13 33.96 2bqp s GLU 2 CO 0.00 -0.27 -0.15 0.95 0.02 0.00 0.00 175.26 175.81 2bqp s THR 3 N 2.03 1.16 -0.04 3.63 -4.23 -1.26 -0.88 115.64 116.05 2bqp s THR 3 Ca 0.00 -1.13 -0.00 0.00 -1.18 0.00 0.00 61.69 59.38 2bqp s THR 3 Cb -0.12 -1.07 0.03 0.00 1.34 0.00 0.00 72.50 72.68 2bqp s THR 3 CO -0.06 -0.07 0.01 -0.89 -0.54 0.00 0.00 174.62 173.07 2bqp s THR 4 N -1.01 0.15 0.09 3.99 2.01 -0.94 -4.99 115.64 114.95 2bqp s THR 4 Ca 0.01 0.15 0.02 0.00 0.31 0.00 0.00 61.69 62.19 2bqp s THR 4 Cb -0.09 -0.29 -0.04 0.00 0.01 0.00 0.00 72.50 72.10 2bqp s THR 4 CO 0.02 0.17 -0.08 -0.44 -0.69 0.00 0.00 174.62 173.60 2bqp s SER 5 N 1.37 1.21 -0.11 3.53 0.01 -1.26 -1.16 113.70 117.29 2bqp s SER 5 Ca -0.05 -0.87 -0.30 0.00 1.31 0.00 0.00 55.95 56.04 2bqp s SER 5 Cb -0.13 0.06 0.11 0.00 0.21 0.00 0.00 66.02 66.26 2bqp s SER 5 CO -0.03 -0.36 0.88 0.72 0.41 0.00 0.00 173.24 174.87 2bqp s PHE 6 N -2.89 -0.46 -0.08 2.43 -0.12 -0.64 -4.98 117.98 111.24 2bqp s PHE 6 Ca 0.06 0.76 -0.04 0.00 -0.05 0.00 0.00 56.93 57.67 2bqp s PHE 6 Cb 0.00 0.44 0.04 0.00 -0.63 0.00 0.00 43.02 42.88 2bqp s PHE 6 CO -0.02 -0.45 0.18 -1.17 -0.05 0.00 0.00 175.22 173.71 2bqp s LEU 7 N -1.24 0.67 -0.13 -1.99 2.96 -1.26 -0.99 118.68 116.70 2bqp s LEU 7 Ca -0.04 0.37 -0.01 0.00 -0.22 0.00 0.00 54.13 54.22 2bqp s LEU 7 Cb -0.00 0.48 0.04 0.00 0.50 0.00 0.00 46.19 47.21 2bqp s LEU 7 CO 0.03 -0.15 -0.01 -0.63 -1.32 0.00 0.00 176.35 174.27 2bqp s ILE 8 N 1.13 0.68 -1.97 6.68 1.01 0.74 -4.99 121.20 124.48 2bqp s ILE 8 Ca -0.09 -0.29 0.18 0.00 0.00 0.00 0.00 60.65 60.46 2bqp s ILE 8 Cb -0.11 -0.91 0.07 0.00 0.01 0.00 0.00 42.46 41.52 2bqp s ILE 8 CO -0.06 0.13 1.00 0.35 0.00 0.00 0.00 174.94 176.35 2bqp n THR 9 N 5.03 0.00 -3.66 2.92 -2.24 -1.26 -1.04 114.28 114.03 2bqp n THR 9 Ca -0.09 -0.40 -0.08 0.00 -2.27 0.00 0.00 64.05 61.20 2bqp n THR 9 Cb 0.49 1.29 -0.09 0.00 -2.10 0.00 0.00 70.33 69.93 2bqp n THR 9 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 2bqp s LYS 10 N -1.83 0.57 -0.02 -0.78 2.20 -1.26 -4.77 119.74 113.84 2bqp s LYS 10 Ca 0.18 1.05 -0.12 0.00 -0.36 0.00 0.00 55.97 56.72 2bqp s LYS 10 Cb 0.15 0.09 -0.05 0.00 -1.51 0.00 0.00 37.83 36.51 2bqp s LYS 10 CO 0.35 -0.16 0.34 -0.06 -0.36 0.00 0.00 175.35 175.46 2bqp s PHE 11 N 1.59 3.67 0.20 4.03 0.40 -0.51 -5.05 117.98 122.30 2bqp s PHE 11 Ca -0.10 0.84 0.05 0.00 -0.60 0.00 0.00 56.93 57.12 2bqp s PHE 11 Cb -0.07 -2.17 -0.03 0.00 0.51 0.00 0.00 43.02 41.26 2bqp s PHE 11 CO -0.17 0.65 0.24 -1.54 0.70 0.00 0.00 175.22 175.10 2bqp s SER 12 N -1.19 5.92 0.44 1.36 1.04 -1.26 -4.00 113.70 116.01 2bqp s SER 12 Ca 0.23 -0.03 0.22 0.00 0.48 0.00 0.00 55.95 56.85 2bqp s SER 12 Cb -0.15 -1.65 1.20 0.00 0.10 0.00 0.00 66.02 65.51 2bqp s SER 12 CO 0.12 0.01 1.83 -0.65 0.98 0.00 0.00 173.24 175.53 2bqp h PRO 13 N 1.84 0.29 -3.19 4.02 0.11 -1.98 -2.95 132.00 130.15 2bqp h PRO 13 Ca -0.49 -0.02 -0.63 0.00 0.11 0.00 0.00 66.00 64.97 2bqp h PRO 13 Cb 1.21 -0.07 -0.41 0.00 0.11 0.00 0.00 31.00 31.85 2bqp h PRO 13 CO 0.64 0.19 -0.63 0.34 -0.21 0.00 0.00 178.00 178.33 2bqp s ASP 14 N -5.47 4.34 -1.05 -2.05 2.15 -1.26 -4.74 116.67 108.60 2bqp s ASP 14 Ca -0.08 -3.31 -0.14 0.00 0.43 0.00 0.00 52.55 49.46 2bqp s ASP 14 Cb 0.23 -1.53 0.20 0.00 -0.30 0.00 0.00 42.92 41.53 2bqp s ASP 14 CO 0.79 -0.17 1.15 -1.58 -0.17 0.00 0.00 175.17 175.18 2bqp s GLN 15 N -0.67 3.92 0.19 4.34 2.00 -1.12 -4.87 119.66 123.46 2bqp s GLN 15 Ca 0.21 -2.56 0.18 0.00 -2.00 0.00 0.00 55.36 51.19 2bqp s GLN 15 Cb -0.16 -4.76 0.84 0.00 0.80 0.00 0.00 33.01 29.72 2bqp s GLN 15 CO -0.07 -1.53 1.56 1.04 -0.50 0.00 0.00 175.29 175.79 2bqp n GLN 16 N 4.69 0.12 -0.13 1.67 6.02 -1.26 -2.34 117.38 126.13 2bqp n GLN 16 Ca 0.26 0.46 0.08 0.00 -0.01 0.00 0.00 57.00 57.79 2bqp n GLN 16 Cb 0.44 -1.78 0.27 0.00 1.02 0.00 0.00 30.24 30.19 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 -2.01 1.84 -4.48 1.08 6.94 -1.26 -4.85 115.26 112.52 2bqp n ASN 17 Ca 0.01 -1.86 -0.30 0.00 -0.02 0.00 0.00 54.58 52.41 2bqp n ASN 17 Cb 0.13 -0.18 -0.12 0.00 -2.36 0.00 0.00 39.78 37.26 2bqp n ASN 17 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 2bqp s LEU 18 N -1.29 2.68 -0.22 -4.53 1.02 -0.99 -0.56 118.68 114.80 2bqp s LEU 18 Ca 0.29 -0.45 -0.04 0.00 0.02 0.00 0.00 54.13 53.95 2bqp s LEU 18 Cb 0.15 -1.56 -0.02 0.00 0.02 0.00 0.00 46.19 44.79 2bqp s LEU 18 CO 0.22 0.23 -0.02 -0.63 0.02 0.00 0.00 176.35 176.17 2bqp s ILE 19 N -1.00 3.64 -0.01 -0.59 1.01 0.57 -4.79 121.20 120.02 2bqp s ILE 19 Ca 0.16 -0.41 -0.03 0.00 0.00 0.00 0.00 60.65 60.37 2bqp s ILE 19 Cb -0.11 -2.66 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 2bqp s ILE 19 CO 0.07 0.42 0.18 -0.36 0.00 0.00 0.00 174.94 175.25 2bqp s PHE 20 N 1.33 3.55 0.04 3.97 0.40 -1.26 -0.43 117.98 125.58 2bqp s PHE 20 Ca 0.04 0.36 0.00 0.00 -0.60 0.00 0.00 56.93 56.74 2bqp s PHE 20 Cb -0.14 -1.83 -0.03 0.00 0.51 0.00 0.00 43.02 41.52 2bqp s PHE 20 CO -0.01 0.65 -0.04 -0.65 0.70 0.00 0.00 175.22 175.87 2bqp s GLN 21 N -1.90 0.51 6.18 0.44 -0.21 -0.42 -4.99 119.66 119.27 2bqp s GLN 21 Ca 0.27 -0.94 0.00 0.00 0.02 0.00 0.00 55.36 54.71 2bqp s GLN 21 Cb -0.13 0.05 0.00 0.00 1.00 0.00 0.00 33.01 33.93 2bqp s GLN 21 CO 0.18 -0.05 0.00 0.41 -2.12 0.00 0.00 175.29 173.71 2bqp n GLY 22 N 0.84 2.74 1.24 3.09 0.00 -1.26 -1.63 105.19 110.20 2bqp n GLY 22 Ca -0.19 -0.39 0.07 0.00 0.00 0.00 0.00 46.02 45.52 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 2.38 3.61 -4.72 1.61 8.00 -0.16 -4.90 116.55 122.36 2bqp n ASP 23 Ca 0.00 -2.30 -0.42 0.00 0.71 0.00 0.00 54.79 52.78 2bqp n ASP 23 Cb 0.00 -0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 40.58 2bqp n ASP 23 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2bqp s GLY 24 N -0.81 2.13 0.23 0.44 0.00 -1.05 -4.73 107.32 103.54 2bqp s GLY 24 Ca 0.38 1.10 -0.19 0.00 0.00 0.00 0.00 44.72 46.01 2bqp s GLY 24 CO 0.19 2.25 0.60 -2.52 0.00 0.00 0.00 173.10 173.61 2bqp s TYR 25 N 0.83 -0.13 -0.12 1.90 1.13 -0.16 -4.58 117.35 116.22 2bqp s TYR 25 Ca 0.62 -0.24 -0.03 0.00 -1.41 0.00 0.00 57.07 56.01 2bqp s TYR 25 Cb -0.36 0.50 -0.03 0.00 -1.10 0.00 0.00 41.96 40.96 2bqp s TYR 25 CO 0.32 -1.03 -0.03 0.95 -2.51 0.00 0.00 175.55 173.25 2bqp s THR 26 N -3.89 4.04 -0.01 -3.49 -4.23 -1.26 0.40 115.64 107.19 2bqp s THR 26 Ca 0.11 -0.33 -0.24 0.00 -1.18 0.00 0.00 61.69 60.05 2bqp s THR 26 Cb -0.03 -2.73 0.05 0.00 1.34 0.00 0.00 72.50 71.14 2bqp s THR 26 CO 0.01 0.54 0.53 0.28 -0.54 0.00 0.00 174.62 175.45 2bqp s THR 27 N -0.21 0.02 -1.15 3.99 -1.32 -0.49 -4.62 115.64 111.86 2bqp s THR 27 Ca 0.04 -0.20 0.00 0.00 -1.21 0.00 0.00 61.69 60.32 2bqp s THR 27 Cb -0.13 -0.90 0.00 0.00 -1.51 0.00 0.00 72.50 69.96 2bqp s THR 27 CO 0.02 -0.11 0.00 0.29 -2.21 0.00 0.00 174.62 172.61 2bqp n LYS 28 N 0.81 -1.98 -0.96 7.08 5.02 -1.26 -1.12 118.16 125.75 2bqp n LYS 28 Ca -0.19 0.65 0.00 0.00 -2.02 0.00 0.00 58.31 56.75 2bqp n LYS 28 Cb 0.58 -5.17 0.00 0.00 -0.02 0.00 0.00 35.03 30.42 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 -2.58 -0.11 -4.40 1.97 1.02 -1.26 -5.03 120.64 110.25 2bqp n GLU 29 Ca -0.15 0.03 -0.24 0.00 -0.02 0.00 0.00 57.16 56.78 2bqp n GLU 29 Cb 0.57 -2.97 -0.09 0.00 -0.02 0.00 0.00 31.44 28.93 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 -0.19 1.94 -0.30 3.49 -2.85 -0.27 -1.43 119.74 120.12 2bqp s LYS 30 Ca 0.00 -1.67 -0.15 0.00 -1.00 0.00 0.00 55.97 53.15 2bqp s LYS 30 Cb 0.00 -1.91 -0.03 0.00 -2.06 0.00 0.00 37.83 33.83 2bqp s LYS 30 CO 0.00 0.30 0.36 -1.17 0.10 0.00 0.00 175.35 174.94 2bqp s LEU 31 N -3.60 4.22 -0.27 2.77 2.96 -0.50 -1.39 118.68 122.87 2bqp s LEU 31 Ca 0.31 0.03 -0.11 0.00 -0.22 0.00 0.00 54.13 54.15 2bqp s LEU 31 Cb -0.04 -2.37 -0.05 0.00 0.50 0.00 0.00 46.19 44.23 2bqp s LEU 31 CO 0.17 -0.25 0.18 -0.89 -1.32 0.00 0.00 176.35 174.24 2bqp s THR 32 N 2.04 5.24 -0.19 3.68 2.01 0.16 -0.61 115.64 127.97 2bqp s THR 32 Ca 0.13 0.14 -0.23 0.00 0.31 0.00 0.00 61.69 62.04 2bqp s THR 32 Cb -0.16 -3.49 -0.21 0.00 0.01 0.00 0.00 72.50 68.66 2bqp s THR 32 CO 0.11 0.27 0.36 -0.07 -0.69 0.00 0.00 174.62 174.60 2bqp h LEU 33 N 8.27 0.00 -7.97 4.42 4.07 -1.34 -0.39 115.31 122.37 2bqp h LEU 33 Ca -0.36 -0.64 -0.16 0.00 0.08 0.00 0.00 57.88 56.81 2bqp h LEU 33 Cb 1.19 0.00 -0.20 0.00 1.08 0.00 0.00 40.66 42.73 2bqp h LEU 33 CO 0.56 1.35 -0.65 0.42 -1.08 0.00 0.00 178.44 179.04 2bqp s THR 34 N -2.32 0.12 0.66 0.22 -4.23 -1.21 -3.51 115.64 105.38 2bqp s THR 34 Ca -0.26 -0.99 0.04 0.00 -1.18 0.00 0.00 61.69 59.30 2bqp s THR 34 Cb 0.03 -0.47 0.11 0.00 1.34 0.00 0.00 72.50 73.52 2bqp s THR 34 CO 0.61 -0.54 0.91 -0.54 -0.54 0.00 0.00 174.62 174.52 2bqp s LYS 35 N -1.80 1.92 -1.54 3.99 1.02 -1.26 -2.79 119.74 119.28 2bqp s LYS 35 Ca -0.13 -1.39 -0.12 0.00 0.02 0.00 0.00 55.97 54.36 2bqp s LYS 35 Cb -0.07 -2.47 -0.03 0.00 -0.52 0.00 0.00 37.83 34.74 2bqp s LYS 35 CO -0.02 -1.22 2.61 0.00 -0.92 0.00 0.00 175.35 175.80 2bqp n ALA 36 N -2.59 6.58 -2.33 5.17 0.00 -1.26 -4.22 120.51 121.86 2bqp n ALA 36 Ca 0.16 -3.67 -0.18 0.00 0.00 0.00 0.00 53.44 49.75 2bqp n ALA 36 Cb 0.61 -3.45 -0.10 0.00 0.00 0.00 0.00 19.45 16.51 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 2.68 1.51 0.47 0.00 -7.23 -1.26 -4.82 120.40 111.74 2bqp s VAL 37 Ca 0.59 -2.14 -0.19 0.00 -1.81 0.00 0.00 61.98 58.43 2bqp s VAL 37 Cb 0.16 -2.09 -0.10 0.00 0.56 0.00 0.00 36.38 34.91 2bqp s VAL 37 CO -0.07 -0.56 0.97 -0.54 -0.31 0.00 0.00 175.10 174.59 2bqp s LYS 38 N -3.71 4.09 -1.19 4.82 1.02 -1.26 -4.49 119.74 119.02 2bqp s LYS 38 Ca 0.23 1.05 -0.32 0.00 0.02 0.00 0.00 55.97 56.95 2bqp s LYS 38 Cb 0.01 -2.16 0.04 0.00 -0.52 0.00 0.00 37.83 35.20 2bqp s LYS 38 CO 0.06 -0.15 0.70 0.09 -0.92 0.00 0.00 175.35 175.14 2bqp n ASN 39 N -1.07 -4.40 -4.50 2.83 4.13 -0.12 -4.84 115.26 107.28 2bqp n ASN 39 Ca 0.07 -1.24 -0.24 0.00 1.68 0.00 0.00 54.58 54.85 2bqp n ASN 39 Cb 0.54 -1.99 -0.11 0.00 -1.54 0.00 0.00 39.78 36.68 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 -3.50 1.58 -0.00 3.41 -4.23 -1.19 -4.92 115.64 106.80 2bqp s THR 40 Ca 0.48 -2.03 -0.02 0.00 -1.18 0.00 0.00 61.69 58.93 2bqp s THR 40 Cb -0.25 -2.79 -0.00 0.00 1.34 0.00 0.00 72.50 70.80 2bqp s THR 40 CO 0.95 -0.07 0.05 0.54 -0.54 0.00 0.00 174.62 175.55 2bqp s VAL 41 N -3.02 0.05 -0.11 2.29 0.11 -1.26 -0.96 120.40 117.50 2bqp s VAL 41 Ca 0.35 -0.45 -0.07 0.00 -2.93 0.00 0.00 61.98 58.88 2bqp s VAL 41 Cb 0.08 -0.22 0.04 0.00 -1.53 0.00 0.00 36.38 34.75 2bqp s VAL 41 CO 0.16 -0.25 0.27 -0.83 -3.33 0.00 0.00 175.10 171.12 2bqp s GLY 42 N -0.77 -0.18 0.08 6.54 0.00 -0.52 -0.99 107.32 111.49 2bqp s GLY 42 Ca -0.08 0.97 0.02 0.00 0.00 0.00 0.00 44.72 45.62 2bqp s GLY 42 CO 0.00 1.09 -0.08 0.50 0.00 0.00 0.00 173.10 174.62 2bqp s ARG 43 N 0.90 0.74 -0.09 2.90 0.52 -0.65 -1.66 118.95 121.62 2bqp s ARG 43 Ca -0.06 -1.12 -0.04 0.00 -0.52 0.00 0.00 55.73 53.99 2bqp s ARG 43 Cb -0.07 -0.30 0.05 0.00 0.52 0.00 0.00 34.95 35.14 2bqp s ARG 43 CO -0.06 0.02 0.19 0.00 0.02 0.00 0.00 175.30 175.47 2bqp s ALA 44 N -2.67 -0.35 0.24 2.13 0.00 -0.97 -1.31 121.76 118.84 2bqp s ALA 44 Ca 0.04 0.77 0.11 0.00 0.00 0.00 0.00 51.96 52.87 2bqp s ALA 44 Cb -0.01 -0.65 -0.05 0.00 0.00 0.00 0.00 23.12 22.41 2bqp s ALA 44 CO -0.02 -0.32 -0.15 -0.51 0.00 0.00 0.00 175.76 174.76 2bqp s LEU 45 N 1.61 2.76 -0.05 0.00 1.43 0.43 -0.92 118.68 123.93 2bqp s LEU 45 Ca -0.05 -0.84 -0.25 0.00 -1.03 0.00 0.00 54.13 51.96 2bqp s LEU 45 Cb -0.11 -1.34 -0.04 0.00 0.03 0.00 0.00 46.19 44.73 2bqp s LEU 45 CO -0.07 0.06 0.76 -0.47 0.23 0.00 0.00 176.35 176.86 2bqp s TYR 46 N -2.18 3.60 0.24 0.29 5.04 -0.81 -0.32 117.35 123.21 2bqp s TYR 46 Ca 0.28 1.36 -0.06 0.00 -2.44 0.00 0.00 57.07 56.21 2bqp s TYR 46 Cb -0.06 -2.87 0.44 0.00 0.35 0.00 0.00 41.96 39.81 2bqp s TYR 46 CO 0.15 0.07 1.68 0.66 -1.34 0.00 0.00 175.55 176.78 2bqp h SER 47 N 6.73 -0.01 -3.40 4.32 4.64 -1.14 -3.43 113.55 121.27 2bqp h SER 47 Ca -0.41 0.15 -0.53 0.00 -0.47 0.00 0.00 61.79 60.52 2bqp h SER 47 Cb 1.20 0.20 -0.01 0.00 -0.31 0.00 0.00 62.40 63.48 2bqp h SER 47 CO 0.75 -0.04 0.43 -0.55 -0.87 0.00 0.00 176.83 176.55 2bqp s SER 48 N -5.24 7.30 0.56 4.97 0.15 -1.26 -5.02 113.70 115.16 2bqp s SER 48 Ca -0.13 1.83 -0.20 0.00 0.70 0.00 0.00 55.95 58.15 2bqp s SER 48 Cb 0.21 -2.58 -0.04 0.00 -1.71 0.00 0.00 66.02 61.90 2bqp s SER 48 CO 0.75 -0.28 1.24 -2.84 1.20 0.00 0.00 173.24 173.32 2bqp s PRO 49 N 0.68 3.13 -0.07 5.44 0.02 -1.26 -4.83 135.00 138.11 2bqp s PRO 49 Ca 0.53 1.93 0.01 0.00 0.02 0.00 0.00 61.00 63.48 2bqp s PRO 49 Cb -0.25 -2.09 -0.03 0.00 0.02 0.00 0.00 34.50 32.16 2bqp s PRO 49 CO 0.29 -1.10 -0.07 0.42 -0.33 0.00 0.00 177.00 176.21 2bqp s ILE 50 N -1.50 3.68 -0.58 2.83 -1.09 0.41 -4.93 121.20 120.01 2bqp s ILE 50 Ca 0.74 -0.49 -0.22 0.00 -2.23 0.00 0.00 60.65 58.45 2bqp s ILE 50 Cb -0.33 -2.50 0.06 0.00 -1.58 0.00 0.00 42.46 38.11 2bqp s ILE 50 CO 0.37 0.60 0.84 -2.28 -1.23 0.00 0.00 174.94 173.24 2bqp s HIS 51 N -0.78 2.84 -0.15 3.97 2.46 -1.26 -1.81 115.29 120.56 2bqp s HIS 51 Ca 0.12 -0.44 0.18 0.00 0.47 0.00 0.00 55.06 55.39 2bqp s HIS 51 Cb -0.11 -4.01 -0.09 0.00 -0.13 0.00 0.00 32.58 28.24 2bqp s HIS 51 CO 0.01 -1.37 0.89 0.97 -2.47 0.00 0.00 174.74 172.78 2bqp h ILE 52 N 5.95 0.36 -2.64 0.89 6.09 -1.39 -3.44 117.51 123.33 2bqp h ILE 52 Ca -0.28 -1.72 0.02 0.00 -1.37 0.00 0.00 64.86 61.51 2bqp h ILE 52 Cb 1.08 1.89 -0.14 0.00 0.47 0.00 0.00 36.82 40.12 2bqp h ILE 52 CO 1.09 0.21 0.30 -1.66 -3.07 0.00 0.00 178.15 175.02 2bqp s TRP 53 N -3.05 -0.49 -0.16 2.19 1.48 -1.20 -1.50 118.94 116.22 2bqp s TRP 53 Ca -0.02 0.39 0.00 0.00 -1.06 0.00 0.00 56.10 55.42 2bqp s TRP 53 Cb 0.09 0.53 0.02 0.00 -1.16 0.00 0.00 33.47 32.96 2bqp s TRP 53 CO 0.80 -0.72 -0.14 0.34 -4.06 0.00 0.00 176.95 173.17 2bqp s ASP 54 N -2.44 2.79 0.14 -2.66 2.15 0.11 -4.61 116.67 112.15 2bqp s ASP 54 Ca 0.01 -0.54 -0.18 0.00 0.43 0.00 0.00 52.55 52.26 2bqp s ASP 54 Cb -0.01 -1.20 -0.03 0.00 -0.30 0.00 0.00 42.92 41.38 2bqp s ASP 54 CO -0.09 -0.06 1.79 0.08 -0.17 0.00 0.00 175.17 176.72 2bqp h ARG 55 N 8.04 0.36 -0.14 4.34 -0.00 -1.92 0.66 114.38 125.71 2bqp h ARG 55 Ca -0.38 -0.02 -0.04 0.00 -0.00 0.00 0.00 59.98 59.54 2bqp h ARG 55 Cb 1.13 -0.08 -0.01 0.00 -0.00 0.00 0.00 29.97 31.01 2bqp h ARG 55 CO 0.53 0.24 -0.11 1.05 -0.00 0.00 0.00 179.97 181.68 2bqp h GLU 56 N 0.37 0.22 0.00 0.08 4.11 -1.97 -3.11 114.58 114.28 2bqp h GLU 56 Ca 0.11 -0.05 -0.37 0.00 0.07 0.00 0.00 59.36 59.13 2bqp h GLU 56 Cb -0.03 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.12 2bqp h GLU 56 CO -0.03 0.34 -2.34 0.25 0.07 0.00 0.00 179.01 177.30 2bqp n THR 57 N -4.30 1.42 -0.21 -1.06 -2.24 -1.16 -4.97 114.28 101.75 2bqp n THR 57 Ca -0.01 -0.84 0.00 0.00 -2.27 0.00 0.00 64.05 60.94 2bqp n THR 57 Cb 0.25 -0.57 0.00 0.00 -2.10 0.00 0.00 70.33 67.90 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 1.77 0.93 3.77 3.38 0.00 0.23 -5.04 105.19 110.22 2bqp n GLY 58 Ca -0.33 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.91 6.19 0.14 1.61 -0.87 -1.17 -4.75 114.94 113.18 2bqp s ASN 59 Ca 0.00 2.65 0.10 0.00 -1.57 0.00 0.00 52.86 54.05 2bqp s ASN 59 Cb 0.00 -2.64 -0.04 0.00 -0.02 0.00 0.00 41.25 38.55 2bqp s ASN 59 CO 0.00 -0.94 -0.24 -0.69 -2.57 0.00 0.00 177.10 172.66 2bqp s VAL 60 N -1.28 2.12 0.21 1.60 1.01 -1.26 0.05 120.40 122.84 2bqp s VAL 60 Ca 0.59 -1.78 -0.06 0.00 0.00 0.00 0.00 61.98 60.73 2bqp s VAL 60 Cb -0.38 -1.91 -0.06 0.00 0.00 0.00 0.00 36.38 34.03 2bqp s VAL 60 CO 0.48 -0.02 0.47 0.00 0.00 0.00 0.00 175.10 176.03 2bqp s ALA 61 N -1.30 3.68 0.14 5.51 0.00 -0.56 -4.74 121.76 124.49 2bqp s ALA 61 Ca 0.14 -0.49 -0.14 0.00 0.00 0.00 0.00 51.96 51.47 2bqp s ALA 61 Cb -0.09 -2.26 -0.07 0.00 0.00 0.00 0.00 23.12 20.70 2bqp s ALA 61 CO 0.06 0.51 0.54 -0.80 0.00 0.00 0.00 175.76 176.07 2bqp s ASN 62 N -2.63 6.82 -0.00 0.00 -0.87 -0.68 -4.38 114.94 113.20 2bqp s ASN 62 Ca 0.44 1.06 -0.20 0.00 -1.57 0.00 0.00 52.86 52.59 2bqp s ASN 62 Cb -0.11 -2.28 0.04 0.00 -0.02 0.00 0.00 41.25 38.87 2bqp s ASN 62 CO 0.25 0.12 0.45 0.72 -2.57 0.00 0.00 177.10 176.06 2bqp s PHE 63 N -1.44 -0.34 0.00 2.20 -0.12 -1.07 -0.97 117.98 116.25 2bqp s PHE 63 Ca 0.37 0.48 -0.03 0.00 -0.05 0.00 0.00 56.93 57.69 2bqp s PHE 63 Cb -0.15 0.23 -0.01 0.00 -0.63 0.00 0.00 43.02 42.46 2bqp s PHE 63 CO 0.19 -0.52 0.05 0.08 -0.05 0.00 0.00 175.22 174.98 2bqp s VAL 64 N -1.72 0.08 -0.11 -2.49 1.01 -0.64 -0.68 120.40 115.85 2bqp s VAL 64 Ca -0.10 -0.65 -0.09 0.00 0.00 0.00 0.00 61.98 61.14 2bqp s VAL 64 Cb -0.02 -0.29 0.03 0.00 0.00 0.00 0.00 36.38 36.10 2bqp s VAL 64 CO 0.03 -0.36 0.29 0.28 0.00 0.00 0.00 175.10 175.35 2bqp s THR 65 N -1.14 -0.01 -0.04 3.92 -1.32 -0.71 -1.36 115.64 114.99 2bqp s THR 65 Ca -0.12 0.03 0.05 0.00 -1.21 0.00 0.00 61.69 60.43 2bqp s THR 65 Cb -0.07 -0.42 -0.01 0.00 -1.51 0.00 0.00 72.50 70.50 2bqp s THR 65 CO 0.00 0.01 -0.18 -0.44 -2.21 0.00 0.00 174.62 171.80 2bqp s SER 66 N 0.41 2.26 0.08 8.08 0.01 -0.73 -1.55 113.70 122.24 2bqp s SER 66 Ca -0.02 -0.37 -0.19 0.00 1.31 0.00 0.00 55.95 56.68 2bqp s SER 66 Cb -0.04 -0.58 0.04 0.00 0.21 0.00 0.00 66.02 65.66 2bqp s SER 66 CO -0.02 0.17 0.45 0.72 0.41 0.00 0.00 173.24 174.97 2bqp s PHE 67 N -0.04 -0.31 -0.09 2.43 -0.12 -0.91 -0.60 117.98 118.34 2bqp s PHE 67 Ca -0.02 0.20 0.04 0.00 -0.05 0.00 0.00 56.93 57.09 2bqp s PHE 67 Cb -0.11 0.29 -0.01 0.00 -0.63 0.00 0.00 43.02 42.56 2bqp s PHE 67 CO 0.02 -0.65 -0.22 0.99 -0.05 0.00 0.00 175.22 175.31 2bqp s THR 68 N -2.95 2.31 0.11 -4.49 2.01 -1.12 -0.89 115.64 110.62 2bqp s THR 68 Ca -0.02 -0.95 0.03 0.00 0.31 0.00 0.00 61.69 61.05 2bqp s THR 68 Cb 0.00 -1.89 -0.04 0.00 0.01 0.00 0.00 72.50 70.58 2bqp s THR 68 CO -0.06 0.56 -0.08 0.72 -0.69 0.00 0.00 174.62 175.07 2bqp s PHE 69 N 0.12 1.02 -0.01 4.92 -0.71 -0.66 0.13 117.98 122.79 2bqp s PHE 69 Ca -0.11 -0.86 0.02 0.00 -1.04 0.00 0.00 56.93 54.94 2bqp s PHE 69 Cb -0.16 -0.56 0.00 0.00 -1.21 0.00 0.00 43.02 41.10 2bqp s PHE 69 CO 0.06 -0.07 -0.05 0.08 -1.34 0.00 0.00 175.22 173.90 2bqp s VAL 70 N -3.50 0.45 -0.15 -2.49 1.01 -0.29 -1.02 120.40 114.41 2bqp s VAL 70 Ca 0.13 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.92 2bqp s VAL 70 Cb 0.04 -0.41 0.00 0.00 0.00 0.00 0.00 36.38 36.02 2bqp s VAL 70 CO -0.03 0.15 -0.19 -0.63 0.00 0.00 0.00 175.10 174.40 2bqp s ILE 71 N 0.11 2.34 -0.28 2.22 1.01 -1.26 -1.81 121.20 123.53 2bqp s ILE 71 Ca -0.01 -0.88 0.01 0.00 0.00 0.00 0.00 60.65 59.77 2bqp s ILE 71 Cb -0.05 -1.96 0.06 0.00 0.01 0.00 0.00 42.46 40.51 2bqp s ILE 71 CO -0.00 0.53 -0.06 0.20 0.00 0.00 0.00 174.94 175.61 2bqp s ASN 72 N 0.83 4.65 -0.15 3.58 0.01 -0.24 -0.32 114.94 123.29 2bqp s ASN 72 Ca -0.06 -1.34 -0.05 0.00 -0.71 0.00 0.00 52.86 50.70 2bqp s ASN 72 Cb -0.15 -1.62 -0.03 0.00 0.41 0.00 0.00 41.25 39.85 2bqp s ASN 72 CO -0.01 -0.22 0.01 0.00 -1.51 0.00 0.00 177.10 175.37 2bqp s ALA 73 N 1.17 3.25 0.57 0.60 0.00 -1.26 -1.02 121.76 125.06 2bqp s ALA 73 Ca -0.07 -0.78 0.27 0.00 0.00 0.00 0.00 51.96 51.37 2bqp s ALA 73 Cb -0.20 -1.69 1.69 0.00 0.00 0.00 0.00 23.12 22.92 2bqp s ALA 73 CO -0.03 0.30 2.23 -1.35 0.00 0.00 0.00 175.76 176.91 2bqp h PRO 74 N 6.29 0.00 -3.31 0.00 0.11 -1.87 -3.37 132.00 129.84 2bqp h PRO 74 Ca -0.39 0.00 -0.42 0.00 0.11 0.00 0.00 66.00 65.31 2bqp h PRO 74 Cb 1.18 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.90 2bqp h PRO 74 CO 0.64 0.00 -0.75 1.21 -0.21 0.00 0.00 178.00 178.89 2bqp s ASN 75 N -6.36 1.70 0.09 -2.05 2.47 -1.26 -5.03 114.94 104.50 2bqp s ASN 75 Ca -0.05 -0.22 0.07 0.00 0.42 0.00 0.00 52.86 53.08 2bqp s ASN 75 Cb 0.15 -0.25 0.35 0.00 -1.45 0.00 0.00 41.25 40.06 2bqp s ASN 75 CO 0.58 -0.27 1.20 -1.54 -3.72 0.00 0.00 177.10 173.34 2bqp n SER 76 N 5.25 0.16 -0.02 -4.21 3.41 -1.26 -1.92 113.62 115.02 2bqp n SER 76 Ca -0.05 0.57 -0.17 0.00 -0.26 0.00 0.00 58.87 58.97 2bqp n SER 76 Cb 0.49 -0.60 -0.14 0.00 -0.26 0.00 0.00 64.21 63.71 2bqp n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2bqp n TYR 77 N -1.72 0.97 -3.56 7.33 9.36 -1.26 -4.74 117.16 123.55 2bqp n TYR 77 Ca -0.00 0.25 -0.41 0.00 3.32 0.00 0.00 57.90 61.06 2bqp n TYR 77 Cb 0.02 -1.14 -0.09 0.00 -0.63 0.00 0.00 39.34 37.50 2bqp n TYR 77 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 2bqp s ASN 78 N -6.61 5.69 -0.03 2.98 -0.87 -0.81 -5.05 114.94 110.24 2bqp s ASN 78 Ca -0.18 -1.92 0.01 0.00 -1.57 0.00 0.00 52.86 49.20 2bqp s ASN 78 Cb 0.07 -2.01 0.01 0.00 -0.02 0.00 0.00 41.25 39.31 2bqp s ASN 78 CO 0.77 -0.69 -0.04 -0.69 -2.57 0.00 0.00 177.10 173.88 2bqp s VAL 79 N 1.35 0.44 0.06 1.60 1.01 -1.26 -4.54 120.40 119.06 2bqp s VAL 79 Ca 0.06 -0.13 -0.26 0.00 0.00 0.00 0.00 61.98 61.65 2bqp s VAL 79 Cb -0.26 -0.44 0.08 0.00 0.00 0.00 0.00 36.38 35.76 2bqp s VAL 79 CO -0.01 0.17 0.72 0.00 0.00 0.00 0.00 175.10 175.99 2bqp s ALA 80 N 0.55 -1.71 -0.14 5.51 0.00 -1.26 -3.84 121.76 120.87 2bqp s ALA 80 Ca -0.07 0.83 0.07 0.00 0.00 0.00 0.00 51.96 52.79 2bqp s ALA 80 Cb -0.10 0.53 -0.14 0.00 0.00 0.00 0.00 23.12 23.41 2bqp s ALA 80 CO -0.00 -0.66 -0.04 -0.25 0.00 0.00 0.00 175.76 174.81 2bqp n ASP 81 N -0.10 2.23 0.00 0.00 8.00 -0.08 -3.14 116.55 123.47 2bqp n ASP 81 Ca -0.14 -0.04 0.00 0.00 0.71 0.00 0.00 54.79 55.32 2bqp n ASP 81 Cb 0.63 0.36 0.00 0.00 -0.02 0.00 0.00 41.12 42.08 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 2.43 -1.33 3.10 0.44 0.00 -1.23 -1.87 105.19 106.73 2bqp n GLY 82 Ca -0.24 -1.21 -0.12 0.00 0.00 0.00 0.00 46.02 44.45 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 -3.00 -0.15 0.05 1.61 2.19 -0.55 -3.07 117.98 115.06 2bqp s PHE 83 Ca 0.00 0.35 0.00 0.00 0.33 0.00 0.00 56.93 57.61 2bqp s PHE 83 Cb 0.00 0.05 -0.03 0.00 -1.31 0.00 0.00 43.02 41.72 2bqp s PHE 83 CO 0.00 -0.18 -0.05 0.95 1.83 0.00 0.00 175.22 177.78 2bqp s THR 84 N -0.39 0.35 -0.11 0.12 -4.23 0.16 -0.32 115.64 111.22 2bqp s THR 84 Ca -0.05 -1.48 0.02 0.00 -1.18 0.00 0.00 61.69 59.00 2bqp s THR 84 Cb -0.03 -1.07 -0.01 0.00 1.34 0.00 0.00 72.50 72.72 2bqp s THR 84 CO 0.01 -0.74 -0.18 0.12 -0.54 0.00 0.00 174.62 173.29 2bqp s PHE 85 N -2.78 2.68 0.07 3.99 5.36 -0.60 -1.67 117.98 125.03 2bqp s PHE 85 Ca -0.01 -0.78 -0.01 0.00 -0.96 0.00 0.00 56.93 55.18 2bqp s PHE 85 Cb -0.00 -1.76 -0.04 0.00 -0.34 0.00 0.00 43.02 40.88 2bqp s PHE 85 CO -0.05 -0.27 -0.01 -0.59 -1.46 0.00 0.00 175.22 172.84 2bqp s PHE 86 N 0.24 0.60 -0.13 10.12 -0.71 0.23 -1.01 117.98 127.33 2bqp s PHE 86 Ca -0.12 -1.11 0.01 0.00 -1.04 0.00 0.00 56.93 54.68 2bqp s PHE 86 Cb -0.16 -0.41 0.02 0.00 -1.21 0.00 0.00 43.02 41.25 2bqp s PHE 86 CO 0.06 -0.41 -0.16 0.42 -1.34 0.00 0.00 175.22 173.79 2bqp s ILE 87 N -3.95 1.64 0.31 -4.49 1.01 0.06 -1.47 121.20 114.32 2bqp s ILE 87 Ca 0.11 -0.71 -0.06 0.00 0.00 0.00 0.00 60.65 59.98 2bqp s ILE 87 Cb 0.08 -1.50 0.00 0.00 0.01 0.00 0.00 42.46 41.05 2bqp s ILE 87 CO -0.07 0.47 0.47 0.00 0.00 0.00 0.00 174.94 175.81 2bqp s ALA 88 N 1.10 0.41 0.77 9.38 0.00 -0.83 -1.71 121.76 130.86 2bqp s ALA 88 Ca -0.03 -1.30 -0.15 0.00 0.00 0.00 0.00 51.96 50.49 2bqp s ALA 88 Cb -0.14 1.11 0.05 0.00 0.00 0.00 0.00 23.12 24.14 2bqp s ALA 88 CO -0.04 -0.81 1.19 -2.30 0.00 0.00 0.00 175.76 173.80 2bqp n PRO 89 N -0.49 0.42 -0.29 0.00 -0.02 -1.25 -1.12 135.00 132.25 2bqp n PRO 89 Ca -0.00 0.21 0.09 0.00 -2.02 0.00 0.00 63.50 61.78 2bqp n PRO 89 Cb 0.62 -2.43 0.25 0.00 -0.02 0.00 0.00 33.50 31.91 2bqp n PRO 89 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2bqp h VAL 90 N -0.52 0.64 -0.09 -1.45 2.07 -1.84 -1.42 116.25 113.63 2bqp h VAL 90 Ca -0.47 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 66.87 2bqp h VAL 90 Cb 1.31 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 2bqp h VAL 90 CO 0.47 0.10 0.00 -0.90 0.02 0.00 0.00 177.57 177.26 2bqp n ASP 91 N -4.95 0.54 -4.48 0.57 5.75 -1.26 -4.79 116.55 107.93 2bqp n ASP 91 Ca 0.18 -2.00 -0.44 0.00 -0.01 0.00 0.00 54.79 52.52 2bqp n ASP 91 Cb 0.50 -0.08 -0.01 0.00 -1.03 0.00 0.00 41.12 40.51 2bqp n ASP 91 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 2bqp n THR 92 N -0.22 1.86 -4.18 2.12 5.66 -0.53 -5.02 114.28 113.97 2bqp n THR 92 Ca 0.03 -0.50 -0.11 0.00 -3.05 0.00 0.00 64.05 60.42 2bqp n THR 92 Cb 0.09 -0.55 -0.10 0.00 -1.55 0.00 0.00 70.33 68.22 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 -1.43 0.87 0.26 1.09 1.02 -1.26 -5.09 119.74 115.20 2bqp s LYS 93 Ca 0.62 -1.36 -0.31 0.00 0.02 0.00 0.00 55.97 54.95 2bqp s LYS 93 Cb -0.70 -0.27 -0.13 0.00 -0.52 0.00 0.00 37.83 36.21 2bqp s LYS 93 CO 0.58 -0.01 1.47 -2.30 -0.92 0.00 0.00 175.35 174.18 2bqp n PRO 94 N -0.07 2.27 0.00 -1.68 -0.02 -1.26 -4.97 135.00 129.27 2bqp n PRO 94 Ca -0.12 0.81 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2bqp n PRO 94 Cb 0.61 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.58 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 2.04 3.94 -2.01 -0.52 1.13 -0.11 -5.01 117.38 116.84 2bqp n GLN 95 Ca 0.10 0.00 -0.40 0.00 -1.94 0.00 0.00 57.00 54.76 2bqp n GLN 95 Cb 0.33 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 2.91 2.52 0.00 5.09 2.01 -1.08 -4.63 115.64 122.45 2bqp s THR 96 Ca 0.00 0.49 0.00 0.00 0.31 0.00 0.00 61.69 62.49 2bqp s THR 96 Cb 0.00 -3.29 0.00 0.00 0.01 0.00 0.00 72.50 69.22 2bqp s THR 96 CO 0.00 0.09 0.00 0.61 -0.69 0.00 0.00 174.62 174.63 2bqp n GLY 97 N 0.66 1.19 7.00 4.40 0.00 -1.26 -0.51 105.19 116.67 2bqp n GLY 97 Ca 0.03 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 44.31 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 3.13 0.00 -0.02 0.00 -1.25 -0.87 105.19 111.18 2bqp n GLY 98 Ca 0.00 -0.17 0.07 0.00 0.00 0.00 0.00 46.02 45.92 2bqp n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2bqp n GLY 99 N 0.00 -0.61 0.54 -0.02 0.00 -1.26 -1.89 105.19 101.95 2bqp n GLY 99 Ca 0.00 -0.08 0.11 0.00 0.00 0.00 0.00 46.02 46.05 2bqp n GLY 99 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2bqp n TYR 100 N -1.16 0.19 -1.27 1.61 4.01 -0.05 -4.94 117.16 115.55 2bqp n TYR 100 Ca 0.08 -0.10 -0.11 0.00 -0.16 0.00 0.00 57.90 57.62 2bqp n TYR 100 Cb 0.08 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.07 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 0.30 -0.74 0.00 7.72 4.32 -0.79 -1.80 117.00 126.01 2bqp n LEU 101 Ca 0.16 0.27 0.00 0.00 -0.02 0.00 0.00 56.01 56.43 2bqp n LEU 101 Cb 0.33 -1.90 0.00 0.00 -1.62 0.00 0.00 43.42 40.23 2bqp n LEU 101 CO 0.13 -0.65 0.00 0.61 -1.22 0.00 0.00 177.39 176.26 2bqp n GLY 102 N -0.13 0.38 0.00 -0.72 0.00 0.33 -4.31 105.19 100.74 2bqp n GLY 102 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 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 -2.49 0.00 -4.59 1.61 0.24 -0.75 -0.93 118.33 111.42 2bqp n VAL 103 Ca 0.00 0.00 -0.27 0.00 -2.04 0.00 0.00 64.34 62.03 2bqp n VAL 103 Cb 0.15 -0.41 -0.10 0.00 -1.47 0.00 0.00 33.84 32.01 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 -1.98 2.16 -0.05 6.34 0.08 -0.99 -4.80 117.98 118.74 2bqp s PHE 104 Ca 0.00 -0.87 0.02 0.00 0.12 0.00 0.00 56.93 56.19 2bqp s PHE 104 Cb 0.00 -1.54 -0.02 0.00 -0.57 0.00 0.00 43.02 40.89 2bqp s PHE 104 CO 0.00 0.20 0.06 0.09 -0.10 0.00 0.00 175.22 175.47 2bqp n ASN 105 N -0.99 1.65 -3.60 1.36 3.02 -1.26 -2.64 115.26 112.80 2bqp n ASN 105 Ca -0.07 -0.35 -0.05 0.00 -0.03 0.00 0.00 54.58 54.08 2bqp n ASN 105 Cb 0.67 1.03 -0.00 0.00 -0.61 0.00 0.00 39.78 40.86 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 -1.51 -0.14 0.00 6.41 1.04 -1.26 -4.98 113.70 113.26 2bqp s SER 106 Ca 0.00 -0.60 0.26 0.00 0.48 0.00 0.00 55.95 56.09 2bqp s SER 106 Cb 0.01 0.60 0.75 0.00 0.10 0.00 0.00 66.02 67.48 2bqp s SER 106 CO 0.07 -1.14 1.56 0.00 0.98 0.00 0.00 173.24 174.71 2bqp n ALA 107 N -0.51 2.99 -2.46 5.32 0.00 -1.26 -1.97 120.51 122.61 2bqp n ALA 107 Ca -0.05 -0.44 -0.32 0.00 0.00 0.00 0.00 53.44 52.63 2bqp n ALA 107 Cb 0.60 -1.11 -0.05 0.00 0.00 0.00 0.00 19.45 18.89 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 -2.38 3.76 0.18 0.00 2.02 -1.26 -4.37 118.70 116.66 2bqp s GLU 108 Ca 0.27 0.20 -0.31 0.00 0.02 0.00 0.00 54.97 55.15 2bqp s GLU 108 Cb 0.20 -2.68 -0.10 0.00 0.10 0.00 0.00 34.13 31.65 2bqp s GLU 108 CO 0.48 0.33 1.49 -0.47 0.02 0.00 0.00 175.26 177.11 2bqp s TYR 109 N -1.81 3.09 -0.28 1.61 5.04 -1.26 -4.62 117.35 119.12 2bqp s TYR 109 Ca 0.46 0.82 -0.03 0.00 -2.44 0.00 0.00 57.07 55.88 2bqp s TYR 109 Cb -0.11 -3.84 0.09 0.00 0.35 0.00 0.00 41.96 38.45 2bqp s TYR 109 CO 0.22 -2.96 0.11 0.34 -1.34 0.00 0.00 175.55 171.92 2bqp s ASP 110 N 0.88 3.53 0.41 4.32 2.15 -0.59 -5.02 116.67 122.35 2bqp s ASP 110 Ca 0.65 -1.30 0.12 0.00 0.43 0.00 0.00 52.55 52.46 2bqp s ASP 110 Cb -0.42 -0.51 0.95 0.00 -0.30 0.00 0.00 42.92 42.65 2bqp s ASP 110 CO 0.35 -0.41 1.97 0.50 -0.17 0.00 0.00 175.17 177.40 2bqp h LYS 111 N 8.31 0.49 0.00 4.34 3.64 -1.94 -1.69 116.57 129.71 2bqp h LYS 111 Ca -0.17 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 2bqp h LYS 111 Cb 1.03 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.74 2bqp h LYS 111 CO 0.43 0.32 0.00 0.25 -2.27 0.00 0.00 179.45 178.18 2bqp n THR 112 N -4.48 0.86 -0.08 1.00 -2.24 -1.26 -2.52 114.28 105.57 2bqp n THR 112 Ca 0.10 0.21 -0.09 0.00 -2.27 0.00 0.00 64.05 62.00 2bqp n THR 112 Cb 0.34 -1.03 0.07 0.00 -2.10 0.00 0.00 70.33 67.60 2bqp n THR 112 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2bqp h THR 113 N 0.00 1.28 -6.76 4.28 2.02 -1.67 -3.47 112.91 108.59 2bqp h THR 113 Ca 0.00 -1.42 -0.55 0.00 0.77 0.00 0.00 66.41 65.21 2bqp h THR 113 Cb 0.33 1.30 -0.11 0.00 -1.74 0.00 0.00 68.15 67.93 2bqp h THR 113 CO 0.00 0.47 -0.93 0.00 0.37 0.00 0.00 175.52 175.43 2bqp n GLN 114 N -4.09 -2.07 -4.17 6.66 6.02 -1.05 -4.75 117.38 113.94 2bqp n GLN 114 Ca -0.01 0.26 -0.19 0.00 -0.01 0.00 0.00 57.00 57.05 2bqp n GLN 114 Cb 0.47 -4.01 -0.16 0.00 1.02 0.00 0.00 30.24 27.56 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 -4.10 0.50 -0.11 5.09 2.01 -1.26 -3.97 115.64 113.80 2bqp s THR 115 Ca 0.04 -0.14 0.02 0.00 0.31 0.00 0.00 61.69 61.93 2bqp s THR 115 Cb -0.02 -0.51 -0.01 0.00 0.01 0.00 0.00 72.50 71.97 2bqp s THR 115 CO 0.94 0.20 -0.18 -0.69 -0.69 0.00 0.00 174.62 174.20 2bqp s VAL 116 N 0.69 2.58 0.07 3.82 1.01 -0.69 -1.39 120.40 126.48 2bqp s VAL 116 Ca -0.09 -0.84 0.00 0.00 0.00 0.00 0.00 61.98 61.05 2bqp s VAL 116 Cb -0.12 -2.03 -0.04 0.00 0.00 0.00 0.00 36.38 34.19 2bqp s VAL 116 CO 0.00 0.55 -0.05 0.00 0.00 0.00 0.00 175.10 175.60 2bqp s ALA 117 N 0.23 0.71 -0.17 5.51 0.00 -0.65 -0.76 121.76 126.63 2bqp s ALA 117 Ca -0.12 -1.24 0.01 0.00 0.00 0.00 0.00 51.96 50.61 2bqp s ALA 117 Cb -0.16 0.21 0.03 0.00 0.00 0.00 0.00 23.12 23.20 2bqp s ALA 117 CO 0.06 -0.29 -0.13 0.08 0.00 0.00 0.00 175.76 175.48 2bqp s VAL 118 N -3.61 1.66 0.14 0.00 1.01 -0.18 -0.94 120.40 118.48 2bqp s VAL 118 Ca 0.08 -0.81 0.04 0.00 0.00 0.00 0.00 61.98 61.29 2bqp s VAL 118 Cb 0.06 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.78 2bqp s VAL 118 CO -0.07 0.36 0.16 -1.83 0.00 0.00 0.00 175.10 173.72 2bqp s GLU 119 N 1.43 3.04 -0.53 2.72 -1.05 -0.21 -1.55 118.70 122.55 2bqp s GLU 119 Ca 0.03 -0.76 0.04 0.00 -0.15 0.00 0.00 54.97 54.12 2bqp s GLU 119 Cb -0.14 -2.75 0.15 0.00 -0.44 0.00 0.00 34.13 30.95 2bqp s GLU 119 CO -0.10 0.51 0.34 -0.06 0.95 0.00 0.00 175.26 176.90 2bqp s PHE 120 N -1.68 2.49 -0.26 4.83 0.40 0.56 -2.02 117.98 122.29 2bqp s PHE 120 Ca 0.32 -2.80 -0.24 0.00 -0.60 0.00 0.00 56.93 53.61 2bqp s PHE 120 Cb -0.11 -2.10 -0.00 0.00 0.51 0.00 0.00 43.02 41.32 2bqp s PHE 120 CO 0.25 -0.71 0.82 0.34 0.70 0.00 0.00 175.22 176.61 2bqp s ASP 121 N -0.37 6.79 0.00 1.36 -1.08 -0.65 -1.49 116.67 121.23 2bqp s ASP 121 Ca 0.23 0.94 0.18 0.00 -0.52 0.00 0.00 52.55 53.37 2bqp s ASP 121 Cb -0.13 -2.43 0.19 0.00 -1.46 0.00 0.00 42.92 39.09 2bqp s ASP 121 CO -0.09 -0.54 1.11 0.35 0.52 0.00 0.00 175.17 176.52 2bqp n THR 122 N 5.33 0.13 -4.40 1.71 -2.24 -0.78 -2.55 114.28 111.48 2bqp n THR 122 Ca 0.05 -0.57 -0.21 0.00 -2.27 0.00 0.00 64.05 61.05 2bqp n THR 122 Cb 0.48 1.26 -0.16 0.00 -2.10 0.00 0.00 70.33 69.80 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 -1.42 1.01 -0.36 4.78 5.36 -1.22 -4.51 117.98 121.62 2bqp s PHE 123 Ca 0.23 -0.28 -0.25 0.00 -0.96 0.00 0.00 56.93 55.67 2bqp s PHE 123 Cb 0.15 -0.74 0.01 0.00 -0.34 0.00 0.00 43.02 42.10 2bqp s PHE 123 CO 0.23 -0.14 0.90 -0.47 -1.46 0.00 0.00 175.22 174.27 2bqp s TYR 124 N 0.37 3.11 -0.39 10.12 5.04 -1.26 -5.00 117.35 129.33 2bqp s TYR 124 Ca -0.06 0.78 -0.10 0.00 -2.44 0.00 0.00 57.07 55.25 2bqp s TYR 124 Cb -0.11 -3.56 0.05 0.00 0.35 0.00 0.00 41.96 38.69 2bqp s TYR 124 CO 0.01 -0.77 0.22 -0.80 -1.34 0.00 0.00 175.55 172.86 2bqp s ASN 125 N 1.82 5.67 0.28 4.32 -0.87 -1.26 -4.98 114.94 119.92 2bqp s ASN 125 Ca 0.37 -1.18 0.00 0.00 -1.57 0.00 0.00 52.86 50.48 2bqp s ASN 125 Cb -0.12 -2.00 0.67 0.00 -0.02 0.00 0.00 41.25 39.78 2bqp s ASN 125 CO 0.17 -0.44 1.62 0.00 -2.57 0.00 0.00 177.10 175.89 2bqp h ALA 126 N 8.41 1.15 0.00 0.60 0.00 -1.94 0.37 119.26 127.85 2bqp h ALA 126 Ca -0.24 0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.92 2bqp h ALA 126 Cb 1.09 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.30 2bqp h ALA 126 CO 0.69 -0.49 0.00 0.00 0.00 0.00 0.00 179.25 179.45 2bqp h ALA 127 N 1.82 1.00 0.00 0.00 0.00 -2.03 -3.38 119.26 116.67 2bqp h ALA 127 Ca 0.54 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.45 2bqp h ALA 127 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 2bqp h ALA 127 CO -0.73 0.00 0.00 -2.67 0.00 0.00 0.00 179.25 175.85 2bqp n TRP 128 N -3.01 0.00 -2.00 0.00 2.14 -0.88 -5.08 117.44 108.61 2bqp n TRP 128 Ca -0.01 0.00 -0.33 0.00 2.07 0.00 0.00 57.50 59.22 2bqp n TRP 128 Cb 0.16 0.00 0.02 0.00 -0.81 0.00 0.00 31.31 30.68 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 -0.31 5.55 -0.01 -0.67 1.01 0.07 -4.81 116.67 117.49 2bqp s ASP 129 Ca 0.00 1.96 -0.37 0.00 0.71 0.00 0.00 52.55 54.85 2bqp s ASP 129 Cb 0.00 -2.55 -0.15 0.00 1.01 0.00 0.00 42.92 41.23 2bqp s ASP 129 CO 0.00 -1.33 1.54 -2.65 0.21 0.00 0.00 175.17 172.94 2bqp n PRO 130 N -1.99 1.43 -0.44 8.23 -0.02 -1.26 -4.85 135.00 136.10 2bqp n PRO 130 Ca 0.10 0.52 0.38 0.00 -2.02 0.00 0.00 63.50 62.48 2bqp n PRO 130 Cb 0.52 -2.22 0.71 0.00 -0.02 0.00 0.00 33.50 32.50 2bqp n PRO 130 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2bqp h SER 131 N 5.97 0.12 0.22 2.55 4.64 -1.94 0.20 113.55 125.30 2bqp h SER 131 Ca -0.47 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 2bqp h SER 131 Cb 1.31 0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.43 2bqp h SER 131 CO 0.86 -0.03 0.00 -0.46 -0.87 0.00 0.00 176.83 176.34 2bqp n ASN 132 N -4.29 0.35 -1.52 4.97 6.94 -1.26 -4.82 115.26 115.62 2bqp n ASN 132 Ca 0.33 0.64 -0.14 0.00 -0.02 0.00 0.00 54.58 55.38 2bqp n ASN 132 Cb 1.42 -0.69 -0.02 0.00 -2.36 0.00 0.00 39.78 38.13 2bqp n ASN 132 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2bqp n ARG 133 N -1.94 -1.11 -3.60 -3.83 1.74 0.69 -5.00 116.66 103.60 2bqp n ARG 133 Ca 0.00 0.76 -0.34 0.00 -0.77 0.00 0.00 57.85 57.50 2bqp n ARG 133 Cb 0.08 -5.02 -0.05 0.00 -1.02 0.00 0.00 32.46 26.45 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 -2.46 6.61 0.51 0.55 1.11 -1.26 -4.86 116.67 116.88 2bqp s ASP 134 Ca 0.00 0.75 -0.22 0.00 0.18 0.00 0.00 52.55 53.26 2bqp s ASP 134 Cb 0.00 -2.16 -0.06 0.00 1.07 0.00 0.00 42.92 41.77 2bqp s ASP 134 CO 0.00 0.17 1.28 -0.13 1.18 0.00 0.00 175.17 177.66 2bqp s ARG 135 N -1.97 3.38 0.21 8.23 0.52 -1.26 -4.87 118.95 123.19 2bqp s ARG 135 Ca 0.33 2.04 -0.15 0.00 -0.52 0.00 0.00 55.73 57.43 2bqp s ARG 135 Cb -0.14 -2.31 0.01 0.00 0.52 0.00 0.00 34.95 33.04 2bqp s ARG 135 CO 0.18 -0.94 0.49 -3.38 0.02 0.00 0.00 175.30 171.68 2bqp s HIS 136 N -1.41 0.08 -0.10 -0.53 -3.43 -1.06 -0.37 115.29 108.48 2bqp s HIS 136 Ca 0.69 -0.44 -0.03 0.00 -0.80 0.00 0.00 55.06 54.48 2bqp s HIS 136 Cb -0.35 0.30 -0.03 0.00 -1.43 0.00 0.00 32.58 31.06 2bqp s HIS 136 CO 0.42 -0.94 0.01 0.42 -2.00 0.00 0.00 174.74 172.65 2bqp s ILE 137 N -3.93 4.39 0.07 -5.38 1.01 0.22 -1.64 121.20 115.94 2bqp s ILE 137 Ca 0.14 -0.21 -0.06 0.00 0.00 0.00 0.00 60.65 60.52 2bqp s ILE 137 Cb -0.01 -2.87 -0.01 0.00 0.01 0.00 0.00 42.46 39.58 2bqp s ILE 137 CO 0.02 0.59 0.12 -0.83 0.00 0.00 0.00 174.94 174.83 2bqp s GLY 138 N -0.70 0.19 -0.27 6.18 0.00 -0.86 -0.76 107.32 111.11 2bqp s GLY 138 Ca 0.11 -0.72 -0.04 0.00 0.00 0.00 0.00 44.72 44.07 2bqp s GLY 138 CO 0.02 -0.87 0.01 -0.42 0.00 0.00 0.00 173.10 171.83 2bqp s ILE 139 N -3.54 3.45 -0.12 0.90 1.01 -1.00 -1.04 121.20 120.87 2bqp s ILE 139 Ca 0.03 -0.80 -0.03 0.00 0.00 0.00 0.00 60.65 59.85 2bqp s ILE 139 Cb 0.04 -2.74 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 2bqp s ILE 139 CO -0.09 0.17 0.01 -1.81 0.00 0.00 0.00 174.94 173.23 2bqp s ASP 140 N 1.43 5.31 -0.27 3.58 1.01 -0.11 0.01 116.67 127.63 2bqp s ASP 140 Ca 0.02 0.11 -0.01 0.00 0.71 0.00 0.00 52.55 53.38 2bqp s ASP 140 Cb -0.17 -1.65 0.08 0.00 1.01 0.00 0.00 42.92 42.20 2bqp s ASP 140 CO -0.01 0.31 0.06 -0.69 0.21 0.00 0.00 175.17 175.04 2bqp s VAL 141 N -0.47 0.91 -1.58 -1.27 1.01 -1.26 -1.64 120.40 116.11 2bqp s VAL 141 Ca 0.09 -1.16 0.00 0.00 0.00 0.00 0.00 61.98 60.91 2bqp s VAL 141 Cb -0.12 -1.53 0.00 0.00 0.00 0.00 0.00 36.38 34.73 2bqp s VAL 141 CO 0.02 -0.45 0.00 0.59 0.00 0.00 0.00 175.10 175.26 2bqp n ASN 142 N 4.86 -4.47 -3.61 3.32 5.03 -0.49 -4.85 115.26 115.06 2bqp n ASN 142 Ca -0.05 0.28 -0.09 0.00 0.87 0.00 0.00 54.58 55.58 2bqp n ASN 142 Cb 0.44 -3.93 -0.06 0.00 -1.02 0.00 0.00 39.78 35.21 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 -2.23 -0.37 0.00 6.41 0.15 -1.26 -1.54 113.70 114.86 2bqp s SER 143 Ca 0.00 0.55 0.23 0.00 0.70 0.00 0.00 55.95 57.44 2bqp s SER 143 Cb 0.00 0.51 1.08 0.00 -1.71 0.00 0.00 66.02 65.90 2bqp s SER 143 CO 0.00 -0.23 1.76 0.00 1.20 0.00 0.00 173.24 175.97 2bqp n ILE 144 N 1.37 0.34 -2.95 6.45 0.13 -0.83 -4.38 119.36 119.48 2bqp n ILE 144 Ca -0.11 0.08 -0.44 0.00 -1.10 0.00 0.00 62.75 61.19 2bqp n ILE 144 Cb 0.57 -0.69 -0.04 0.00 -0.84 0.00 0.00 39.64 38.64 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 -2.82 3.13 0.55 9.51 2.20 -1.26 -4.93 119.74 126.12 2bqp s LYS 145 Ca 0.16 -1.09 -0.18 0.00 -0.36 0.00 0.00 55.97 54.50 2bqp s LYS 145 Cb 0.16 -4.30 -0.10 0.00 -1.51 0.00 0.00 37.83 32.08 2bqp s LYS 145 CO 0.40 -1.72 0.46 0.43 -0.36 0.00 0.00 175.35 174.55 2bqp n SER 146 N 7.13 -1.31 0.05 1.43 7.64 -1.26 -4.73 113.62 122.57 2bqp n SER 146 Ca -0.03 0.74 -0.08 0.00 1.01 0.00 0.00 58.87 60.51 2bqp n SER 146 Cb 0.45 -1.13 -0.12 0.00 -1.01 0.00 0.00 64.21 62.39 2bqp n SER 146 CO 0.00 0.00 0.00 1.62 -3.01 0.00 0.00 175.04 173.65 2bqp h VAL 147 N 0.26 1.61 -3.13 0.44 3.04 -0.76 -3.47 116.25 114.25 2bqp h VAL 147 Ca -0.45 -3.33 -0.08 0.00 -1.01 0.00 0.00 66.70 61.83 2bqp h VAL 147 Cb 1.41 2.81 -0.17 0.00 -2.01 0.00 0.00 31.29 33.33 2bqp h VAL 147 CO 0.47 0.92 -0.16 0.21 -1.01 0.00 0.00 177.57 178.00 2bqp s ASN 148 N -6.67 -0.22 0.23 3.17 3.84 -1.24 -5.02 114.94 109.02 2bqp s ASN 148 Ca 0.00 -0.07 -0.11 0.00 0.21 0.00 0.00 52.86 52.89 2bqp s ASN 148 Cb 0.10 0.40 -0.01 0.00 -0.55 0.00 0.00 41.25 41.19 2bqp s ASN 148 CO 0.82 -0.64 0.43 0.42 -2.79 0.00 0.00 177.10 175.34 2bqp s THR 149 N -2.47 0.01 -0.23 -5.21 -4.23 -1.26 -2.36 115.64 99.88 2bqp s THR 149 Ca -0.05 -1.45 -0.11 0.00 -1.18 0.00 0.00 61.69 58.90 2bqp s THR 149 Cb -0.01 -2.19 0.09 0.00 1.34 0.00 0.00 72.50 71.73 2bqp s THR 149 CO -0.02 -0.03 0.54 -0.75 -0.54 0.00 0.00 174.62 173.82 2bqp s LYS 150 N -4.03 0.50 0.31 3.99 2.47 0.06 -4.95 119.74 118.09 2bqp s LYS 150 Ca 0.23 1.11 -0.30 0.00 -1.56 0.00 0.00 55.97 55.46 2bqp s LYS 150 Cb 0.00 0.30 -0.12 0.00 -1.46 0.00 0.00 37.83 36.55 2bqp s LYS 150 CO 0.08 -0.19 1.48 0.43 0.16 0.00 0.00 175.35 177.32 2bqp n SER 151 N 4.81 3.42 -3.78 1.43 7.64 -1.26 -0.61 113.62 125.27 2bqp n SER 151 Ca -0.16 1.17 -0.16 0.00 1.01 0.00 0.00 58.87 60.73 2bqp n SER 151 Cb 0.53 -1.54 -0.16 0.00 -1.01 0.00 0.00 64.21 62.03 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 -0.41 0.14 -0.30 1.43 -0.00 0.50 -4.84 118.94 115.46 2bqp s TRP 152 Ca 0.61 0.09 -0.21 0.00 -0.00 0.00 0.00 56.10 56.60 2bqp s TRP 152 Cb -0.54 -0.33 -0.01 0.00 -0.00 0.00 0.00 33.47 32.60 2bqp s TRP 152 CO 0.54 -0.12 0.65 0.21 -0.00 0.00 0.00 176.95 178.23 2bqp s LYS 153 N 1.17 3.93 0.18 5.86 2.20 -1.26 -4.19 119.74 127.63 2bqp s LYS 153 Ca -0.08 0.36 -0.30 0.00 -0.36 0.00 0.00 55.97 55.59 2bqp s LYS 153 Cb -0.13 -3.72 -0.09 0.00 -1.51 0.00 0.00 37.83 32.38 2bqp s LYS 153 CO -0.03 -0.57 1.34 -1.17 -0.36 0.00 0.00 175.35 174.56 2bqp s LEU 154 N 2.64 4.40 -0.50 5.43 2.96 -1.26 -4.97 118.68 127.38 2bqp s LEU 154 Ca 0.26 2.41 -0.05 0.00 -0.22 0.00 0.00 54.13 56.53 2bqp s LEU 154 Cb -0.15 -3.61 0.13 0.00 0.50 0.00 0.00 46.19 43.07 2bqp s LEU 154 CO 0.11 -0.57 0.33 -1.10 -1.32 0.00 0.00 176.35 173.81 2bqp s GLN 155 N 0.12 2.35 0.08 1.98 -0.21 -1.26 -5.06 119.66 117.67 2bqp s GLN 155 Ca 0.59 -2.01 -0.34 0.00 0.02 0.00 0.00 55.36 53.61 2bqp s GLN 155 Cb -0.37 -3.76 -0.14 0.00 1.00 0.00 0.00 33.01 29.74 2bqp s GLN 155 CO 0.37 -1.14 1.62 -1.71 -2.12 0.00 0.00 175.29 172.31 2bqp n ASN 156 N 4.38 2.99 0.00 5.90 4.05 -1.26 -2.18 115.26 129.13 2bqp n ASN 156 Ca -0.01 1.06 0.00 0.00 0.45 0.00 0.00 54.58 56.09 2bqp n ASN 156 Cb 0.40 -1.38 0.00 0.00 1.23 0.00 0.00 39.78 40.04 2bqp n ASN 156 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 2bqp n GLY 157 N 3.56 0.70 3.90 8.20 0.00 0.56 -5.00 105.19 117.11 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 -0.29 3.57 0.07 1.61 2.02 -0.93 -4.87 118.70 119.89 2bqp s GLU 158 Ca 0.00 -0.18 -0.31 0.00 0.02 0.00 0.00 54.97 54.51 2bqp s GLU 158 Cb 0.00 -2.93 -0.06 0.00 0.10 0.00 0.00 34.13 31.25 2bqp s GLU 158 CO 0.00 0.52 1.20 -1.21 0.02 0.00 0.00 175.26 175.79 2bqp s GLU 159 N -2.52 4.44 -0.11 1.61 2.02 -1.26 -4.44 118.70 118.44 2bqp s GLU 159 Ca 0.38 1.78 0.02 0.00 0.02 0.00 0.00 54.97 57.17 2bqp s GLU 159 Cb -0.12 -3.34 -0.01 0.00 0.10 0.00 0.00 34.13 30.76 2bqp s GLU 159 CO 0.25 -0.24 -0.18 0.00 0.02 0.00 0.00 175.26 175.10 2bqp s ALA 160 N 0.97 2.41 -0.21 5.21 0.00 -0.19 -4.31 121.76 125.64 2bqp s ALA 160 Ca 0.58 -0.93 -0.14 0.00 0.00 0.00 0.00 51.96 51.47 2bqp s ALA 160 Cb -0.30 -1.01 -0.04 0.00 0.00 0.00 0.00 23.12 21.77 2bqp s ALA 160 CO 0.30 0.29 0.30 -0.80 0.00 0.00 0.00 175.76 175.84 2bqp s ASN 161 N 0.27 6.32 0.08 0.00 -0.87 -0.51 -1.66 114.94 118.57 2bqp s ASN 161 Ca -0.13 0.36 0.09 0.00 -1.57 0.00 0.00 52.86 51.61 2bqp s ASN 161 Cb -0.16 -2.18 -0.03 0.00 -0.02 0.00 0.00 41.25 38.86 2bqp s ASN 161 CO 0.07 -0.00 -0.23 -0.69 -2.57 0.00 0.00 177.10 173.68 2bqp s VAL 162 N 1.11 1.85 -0.05 1.60 1.01 -0.07 -1.58 120.40 124.27 2bqp s VAL 162 Ca 0.14 -1.46 -0.01 0.00 0.00 0.00 0.00 61.98 60.66 2bqp s VAL 162 Cb -0.14 -1.64 0.03 0.00 0.00 0.00 0.00 36.38 34.63 2bqp s VAL 162 CO 0.06 0.10 -0.00 -0.69 0.00 0.00 0.00 175.10 174.57 2bqp s VAL 163 N -0.99 0.31 -0.17 2.92 1.01 -0.98 -2.13 120.40 120.36 2bqp s VAL 163 Ca 0.09 0.10 0.01 0.00 0.00 0.00 0.00 61.98 62.18 2bqp s VAL 163 Cb -0.10 -0.44 0.01 0.00 0.00 0.00 0.00 36.38 35.86 2bqp s VAL 163 CO 0.04 0.22 -0.19 -0.63 0.00 0.00 0.00 175.10 174.54 2bqp s ILE 164 N 1.60 2.19 -0.02 2.22 1.01 -0.60 -1.55 121.20 126.05 2bqp s ILE 164 Ca -0.01 -0.91 0.05 0.00 0.00 0.00 0.00 60.65 59.79 2bqp s ILE 164 Cb -0.13 -1.92 -0.01 0.00 0.01 0.00 0.00 42.46 40.41 2bqp s ILE 164 CO -0.03 0.53 -0.18 0.00 0.00 0.00 0.00 174.94 175.26 2bqp s ALA 165 N 1.17 1.51 -0.18 9.38 0.00 -0.07 -1.74 121.76 131.84 2bqp s ALA 165 Ca 0.02 -0.76 -0.00 0.00 0.00 0.00 0.00 51.96 51.22 2bqp s ALA 165 Cb -0.14 -0.42 0.01 0.00 0.00 0.00 0.00 23.12 22.57 2bqp s ALA 165 CO -0.09 0.34 -0.15 0.12 0.00 0.00 0.00 175.76 175.98 2bqp s PHE 166 N -0.30 2.81 -0.36 0.00 5.36 0.15 -0.58 117.98 125.06 2bqp s PHE 166 Ca 0.04 -1.26 -0.12 0.00 -0.96 0.00 0.00 56.93 54.62 2bqp s PHE 166 Cb -0.08 -1.94 0.01 0.00 -0.34 0.00 0.00 43.02 40.66 2bqp s PHE 166 CO 0.00 -0.62 0.23 1.21 -1.46 0.00 0.00 175.22 174.58 2bqp s ASN 167 N 1.13 5.88 0.49 6.13 3.04 -0.29 -2.59 114.94 128.73 2bqp s ASN 167 Ca 0.01 -0.75 0.21 0.00 0.04 0.00 0.00 52.86 52.38 2bqp s ASN 167 Cb -0.14 -2.08 1.25 0.00 -1.54 0.00 0.00 41.25 38.73 2bqp s ASN 167 CO -0.06 -0.33 2.04 0.00 -3.04 0.00 0.00 177.10 175.71 2bqp h ALA 168 N 8.49 1.47 -0.24 1.71 0.00 -1.88 0.20 119.26 129.01 2bqp h ALA 168 Ca -0.29 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 54.44 2bqp h ALA 168 Cb 1.13 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2bqp h ALA 168 CO 0.67 0.19 -0.03 0.00 0.00 0.00 0.00 179.25 180.08 2bqp h ALA 169 N 1.85 0.33 -0.01 0.00 0.00 -1.93 -3.30 119.26 116.20 2bqp h ALA 169 Ca -0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 2bqp h ALA 169 Cb 0.33 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.03 2bqp h ALA 169 CO 0.02 0.09 -0.64 0.25 0.00 0.00 0.00 179.25 178.97 2bqp n THR 170 N -4.60 0.00 -1.94 0.00 -2.24 -1.17 -4.98 114.28 99.36 2bqp n THR 170 Ca -0.04 -0.18 -0.17 0.00 -2.27 0.00 0.00 64.05 61.40 2bqp n THR 170 Cb 0.27 1.11 -0.04 0.00 -2.10 0.00 0.00 70.33 69.57 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 -0.79 -4.98 -4.69 3.42 5.03 0.71 -4.91 115.26 109.06 2bqp n ASN 171 Ca 0.06 0.18 -0.38 0.00 0.87 0.00 0.00 54.58 55.30 2bqp n ASN 171 Cb 0.34 -4.02 -0.07 0.00 -1.02 0.00 0.00 39.78 35.01 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 -2.74 5.18 -0.20 2.41 1.01 -1.13 -0.98 120.40 123.95 2bqp s VAL 172 Ca 0.00 0.85 -0.08 0.00 0.00 0.00 0.00 61.98 62.75 2bqp s VAL 172 Cb 0.00 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 2bqp s VAL 172 CO 0.00 0.27 0.08 -0.22 0.00 0.00 0.00 175.10 175.23 2bqp s LEU 173 N 1.11 3.81 0.06 3.92 2.96 -0.26 -1.14 118.68 129.14 2bqp s LEU 173 Ca 0.23 0.04 0.06 0.00 -0.22 0.00 0.00 54.13 54.24 2bqp s LEU 173 Cb -0.15 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.53 2bqp s LEU 173 CO 0.09 0.12 -0.17 0.42 -1.32 0.00 0.00 176.35 175.49 2bqp s THR 174 N 0.68 1.35 -0.01 3.68 -4.23 0.26 -2.06 115.64 115.31 2bqp s THR 174 Ca 0.04 -1.21 0.05 0.00 -1.18 0.00 0.00 61.69 59.39 2bqp s THR 174 Cb -0.13 -1.23 -0.01 0.00 1.34 0.00 0.00 72.50 72.47 2bqp s THR 174 CO 0.02 -0.01 -0.16 -0.69 -0.54 0.00 0.00 174.62 173.24 2bqp s VAL 175 N -0.98 1.23 -0.01 2.29 1.01 0.89 -0.89 120.40 123.93 2bqp s VAL 175 Ca 0.03 -0.70 0.02 0.00 0.00 0.00 0.00 61.98 61.33 2bqp s VAL 175 Cb -0.09 -1.03 -0.00 0.00 0.00 0.00 0.00 36.38 35.25 2bqp s VAL 175 CO 0.02 0.32 -0.08 -0.44 0.00 0.00 0.00 175.10 174.92 2bqp s SER 176 N -0.44 0.96 -0.03 3.32 0.01 -0.60 -1.09 113.70 115.83 2bqp s SER 176 Ca 0.06 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.19 2bqp s SER 176 Cb -0.06 -0.13 0.01 0.00 0.21 0.00 0.00 66.02 66.05 2bqp s SER 176 CO -0.00 0.09 -0.06 -0.22 0.41 0.00 0.00 173.24 173.46 2bqp s LEU 177 N -0.11 1.57 -0.00 2.44 0.20 0.17 -2.32 118.68 120.62 2bqp s LEU 177 Ca 0.02 -0.14 0.04 0.00 0.69 0.00 0.00 54.13 54.73 2bqp s LEU 177 Cb -0.04 -0.45 -0.01 0.00 -0.43 0.00 0.00 46.19 45.26 2bqp s LEU 177 CO -0.00 -0.00 -0.11 -0.89 -0.29 0.00 0.00 176.35 175.05 2bqp s THR 178 N 0.54 0.90 0.05 3.68 2.01 -0.62 -0.72 115.64 121.49 2bqp s THR 178 Ca -0.07 -0.53 0.06 0.00 0.31 0.00 0.00 61.69 61.46 2bqp s THR 178 Cb -0.11 -0.76 -0.04 0.00 0.01 0.00 0.00 72.50 71.60 2bqp s THR 178 CO 0.00 0.23 -0.10 -0.31 -0.69 0.00 0.00 174.62 173.75 2bqp s TYR 179 N -0.32 2.77 0.20 4.92 2.02 0.21 -1.42 117.35 125.72 2bqp s TYR 179 Ca 0.04 -0.13 -0.13 0.00 -0.37 0.00 0.00 57.07 56.48 2bqp s TYR 179 Cb -0.05 -1.51 0.23 0.00 -0.40 0.00 0.00 41.96 40.23 2bqp s TYR 179 CO -0.00 0.37 1.65 -1.35 -1.57 0.00 0.00 175.55 174.65 2bqp h PRO 180 N 4.14 0.04 -4.67 -1.71 0.11 -1.88 -2.84 132.00 125.18 2bqp h PRO 180 Ca -0.48 -0.00 -0.67 0.00 0.11 0.00 0.00 66.00 64.95 2bqp h PRO 180 Cb 1.16 -0.01 -0.37 0.00 0.11 0.00 0.00 31.00 31.89 2bqp h PRO 180 CO 0.52 0.03 -0.68 -0.80 -0.21 0.00 0.00 178.00 176.85 2bqp s ASN 181 N -5.23 4.87 -0.67 -2.05 0.01 -1.26 -4.64 114.94 105.97 2bqp s ASN 181 Ca -0.14 -1.92 -0.26 0.00 -0.71 0.00 0.00 52.86 49.83 2bqp s ASN 181 Cb 0.18 -1.68 -0.02 0.00 0.41 0.00 0.00 41.25 40.14 2bqp s ASN 181 CO 0.73 -0.38 1.82 -0.69 -1.51 0.00 0.00 177.10 177.06 2bqp s VAL 188 N 1.03 3.41 -0.14 1.60 1.01 -1.26 -5.02 120.40 121.03 2bqp s VAL 188 Ca 0.06 0.13 -0.06 0.00 0.00 0.00 0.00 61.98 62.10 2bqp s VAL 188 Cb -0.20 -4.05 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2bqp s VAL 188 CO -0.06 -1.01 0.09 -0.89 0.00 0.00 0.00 175.10 173.23 2bqp s THR 189 N 8.86 5.06 0.07 3.92 2.01 -1.07 -4.95 115.64 129.54 2bqp s THR 189 Ca 0.64 0.05 0.03 0.00 0.31 0.00 0.00 61.69 62.72 2bqp s THR 189 Cb -0.11 -3.22 -0.03 0.00 0.01 0.00 0.00 72.50 69.14 2bqp s THR 189 CO 0.17 0.55 -0.09 -0.55 -0.69 0.00 0.00 174.62 174.01 2bqp s SER 190 N -0.44 1.20 0.01 3.53 0.15 -1.26 -0.62 113.70 116.27 2bqp s SER 190 Ca 0.10 -0.72 0.00 0.00 0.70 0.00 0.00 55.95 56.04 2bqp s SER 190 Cb -0.12 0.03 -0.01 0.00 -1.71 0.00 0.00 66.02 64.20 2bqp s SER 190 CO 0.02 -0.25 -0.02 -0.31 1.20 0.00 0.00 173.24 173.87 2bqp s TYR 191 N -2.08 0.21 -0.04 3.44 1.51 0.10 -4.99 117.35 115.51 2bqp s TYR 191 Ca -0.00 -0.35 -0.10 0.00 -1.01 0.00 0.00 57.07 55.60 2bqp s TYR 191 Cb -0.05 -0.15 0.02 0.00 -0.11 0.00 0.00 41.96 41.67 2bqp s TYR 191 CO -0.00 -0.12 0.24 -0.08 -1.11 0.00 0.00 175.55 174.48 2bqp s THR 192 N -0.95 0.04 -0.03 -0.71 -1.32 -1.26 -0.66 115.64 110.75 2bqp s THR 192 Ca -0.10 -0.36 -0.19 0.00 -1.21 0.00 0.00 61.69 59.83 2bqp s THR 192 Cb -0.07 -0.47 0.04 0.00 -1.51 0.00 0.00 72.50 70.49 2bqp s THR 192 CO -0.01 -0.20 0.41 -0.22 -2.21 0.00 0.00 174.62 172.40 2bqp s LEU 193 N -0.79 0.43 0.16 9.08 2.96 -0.25 -4.99 118.68 125.28 2bqp s LEU 193 Ca -0.09 0.30 -0.22 0.00 -0.22 0.00 0.00 54.13 53.90 2bqp s LEU 193 Cb -0.05 1.61 0.07 0.00 0.50 0.00 0.00 46.19 48.32 2bqp s LEU 193 CO 0.02 -0.47 0.59 -0.94 -1.32 0.00 0.00 176.35 174.23 2bqp s SER 194 N -1.19 -0.53 0.10 3.68 1.04 -1.26 -0.08 113.70 115.46 2bqp s SER 194 Ca -0.12 -0.05 -0.26 0.00 0.48 0.00 0.00 55.95 56.00 2bqp s SER 194 Cb -0.04 0.60 0.08 0.00 0.10 0.00 0.00 66.02 66.76 2bqp s SER 194 CO 0.05 -0.98 0.93 -0.62 0.98 0.00 0.00 173.24 173.61 2bqp s ASP 195 N -2.76 -0.24 -0.20 7.02 -1.08 -0.88 -5.00 116.67 113.53 2bqp s ASP 195 Ca 0.02 -0.27 -0.14 0.00 -0.52 0.00 0.00 52.55 51.64 2bqp s ASP 195 Cb -0.01 0.45 -0.04 0.00 -1.46 0.00 0.00 42.92 41.86 2bqp s ASP 195 CO -0.12 -0.81 0.32 0.68 0.52 0.00 0.00 175.17 175.77 2bqp s VAL 196 N -3.23 5.26 -0.12 1.11 -7.23 -1.26 -1.10 120.40 113.82 2bqp s VAL 196 Ca 0.10 0.56 0.03 0.00 -1.81 0.00 0.00 61.98 60.86 2bqp s VAL 196 Cb -0.01 -3.66 0.01 0.00 0.56 0.00 0.00 36.38 33.27 2bqp s VAL 196 CO -0.02 0.30 -0.23 -0.69 -0.31 0.00 0.00 175.10 174.15 2bqp s VAL 197 N 1.10 2.04 -1.19 1.32 1.01 -0.15 -4.96 120.40 119.56 2bqp s VAL 197 Ca 0.16 -0.99 -0.16 0.00 0.00 0.00 0.00 61.98 60.99 2bqp s VAL 197 Cb -0.14 -1.78 0.13 0.00 0.00 0.00 0.00 36.38 34.59 2bqp s VAL 197 CO 0.06 0.55 1.49 -0.55 0.00 0.00 0.00 175.10 176.65 2bqp s SER 198 N 0.58 6.93 0.26 3.32 0.15 -1.26 -4.74 113.70 118.93 2bqp s SER 198 Ca -0.13 -2.65 -0.03 0.00 0.70 0.00 0.00 55.95 53.83 2bqp s SER 198 Cb -0.17 -2.46 0.53 0.00 -1.71 0.00 0.00 66.02 62.21 2bqp s SER 198 CO 0.04 -0.94 1.67 -0.07 1.20 0.00 0.00 173.24 175.14 2bqp h LEU 199 N 10.77 0.00 -2.23 3.45 3.38 -1.96 -0.93 115.31 127.80 2bqp h LEU 199 Ca 0.33 0.16 0.05 0.00 0.09 0.00 0.00 57.88 58.51 2bqp h LEU 199 Cb 0.90 0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.86 2bqp h LEU 199 CO 1.30 -0.07 0.19 0.50 0.09 0.00 0.00 178.44 180.45 2bqp h LYS 200 N 0.26 0.00 0.00 1.13 3.64 -1.87 -1.47 116.57 118.25 2bqp h LYS 200 Ca 0.45 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.83 2bqp h LYS 200 Cb 0.81 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.63 2bqp h LYS 200 CO -0.55 0.00 -1.39 -0.25 -2.27 0.00 0.00 179.45 174.99 2bqp n ASP 201 N -3.86 0.52 -0.10 4.20 8.00 -0.37 -4.61 116.55 120.34 2bqp n ASP 201 Ca 0.01 0.20 -0.16 0.00 0.71 0.00 0.00 54.79 55.56 2bqp n ASP 201 Cb 0.31 1.04 -0.06 0.00 -0.02 0.00 0.00 41.12 42.39 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 -2.52 1.49 -3.58 2.53 0.31 -0.75 -5.02 118.33 110.79 2bqp n VAL 202 Ca -0.02 -0.01 -0.21 0.00 -0.01 0.00 0.00 64.34 64.10 2bqp n VAL 202 Cb 0.56 -2.17 -0.01 0.00 -0.91 0.00 0.00 33.84 31.31 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 -2.49 4.71 0.90 2.52 -7.23 -0.63 -4.44 120.40 113.75 2bqp s VAL 203 Ca -0.27 -0.83 -0.13 0.00 -1.81 0.00 0.00 61.98 58.93 2bqp s VAL 203 Cb 0.07 -3.68 0.14 0.00 0.56 0.00 0.00 36.38 33.47 2bqp s VAL 203 CO 0.43 -0.32 1.19 -2.16 -0.31 0.00 0.00 175.10 173.93 2bqp s PRO 204 N -4.18 1.17 0.20 4.82 0.04 -1.26 -4.75 135.00 131.05 2bqp s PRO 204 Ca 0.40 0.05 -0.11 0.00 0.04 0.00 0.00 61.00 61.38 2bqp s PRO 204 Cb -0.09 -1.87 0.22 0.00 0.04 0.00 0.00 34.50 32.80 2bqp s PRO 204 CO 0.32 -2.13 1.78 0.93 0.04 0.00 0.00 177.00 177.94 2bqp h GLU 205 N -1.44 0.51 -6.10 4.56 5.08 -1.95 -3.41 114.58 111.82 2bqp h GLU 205 Ca -0.47 -0.03 -0.67 0.00 -1.00 0.00 0.00 59.36 57.19 2bqp h GLU 205 Cb 1.31 -0.12 -0.14 0.00 0.50 0.00 0.00 28.75 30.30 2bqp h GLU 205 CO 0.56 0.34 -0.63 -1.58 -1.00 0.00 0.00 179.01 176.70 2bqp s TRP 206 N -6.11 3.11 0.27 4.33 0.52 -1.26 -1.05 118.94 118.75 2bqp s TRP 206 Ca -0.13 0.11 -0.04 0.00 0.02 0.00 0.00 56.10 56.07 2bqp s TRP 206 Cb 0.16 -1.70 -0.02 0.00 -1.15 0.00 0.00 33.47 30.76 2bqp s TRP 206 CO 0.75 0.47 0.35 0.14 0.02 0.00 0.00 176.95 178.68 2bqp s VAL 207 N -1.04 0.00 0.03 4.03 -7.23 -0.75 -4.23 120.40 111.21 2bqp s VAL 207 Ca 0.18 -1.70 0.06 0.00 -1.81 0.00 0.00 61.98 58.71 2bqp s VAL 207 Cb -0.11 -2.46 -0.02 0.00 0.56 0.00 0.00 36.38 34.35 2bqp s VAL 207 CO 0.08 0.00 -0.17 -0.13 -0.31 0.00 0.00 175.10 174.57 2bqp s ARG 208 N -3.70 1.20 0.14 4.82 0.52 -0.27 -0.45 118.95 121.20 2bqp s ARG 208 Ca 0.32 -0.80 0.08 0.00 -0.52 0.00 0.00 55.73 54.81 2bqp s ARG 208 Cb 0.02 -1.24 -0.04 0.00 0.52 0.00 0.00 34.95 34.21 2bqp s ARG 208 CO 0.15 0.32 -0.13 0.96 0.02 0.00 0.00 175.30 176.62 2bqp s ILE 209 N -0.73 3.08 0.00 1.52 -4.36 -1.26 -1.97 121.20 117.47 2bqp s ILE 209 Ca 0.05 -1.51 0.00 0.00 -0.26 0.00 0.00 60.65 58.93 2bqp s ILE 209 Cb -0.08 -2.46 0.00 0.00 1.25 0.00 0.00 42.46 41.17 2bqp s ILE 209 CO 0.01 0.03 0.00 0.61 0.24 0.00 0.00 174.94 175.83 2bqp n GLY 210 N 0.51 0.96 3.55 6.27 0.00 -0.54 -1.92 105.19 114.03 2bqp n GLY 210 Ca -0.13 -0.74 -0.24 0.00 0.00 0.00 0.00 46.02 44.91 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 -2.88 2.45 -0.05 1.61 0.08 -0.10 -0.60 117.98 118.49 2bqp s PHE 211 Ca 0.00 -0.34 -0.15 0.00 0.12 0.00 0.00 56.93 56.55 2bqp s PHE 211 Cb 0.00 -1.18 0.03 0.00 -0.57 0.00 0.00 43.02 41.30 2bqp s PHE 211 CO 0.00 0.63 0.34 0.45 -0.10 0.00 0.00 175.22 176.55 2bqp s SER 212 N -3.60 -0.26 -0.03 1.36 0.15 -0.67 -2.28 113.70 108.36 2bqp s SER 212 Ca 0.32 0.29 -0.23 0.00 0.70 0.00 0.00 55.95 57.02 2bqp s SER 212 Cb -0.03 0.44 0.05 0.00 -1.71 0.00 0.00 66.02 64.76 2bqp s SER 212 CO 0.17 -0.37 0.50 0.00 1.20 0.00 0.00 173.24 174.74 2bqp s ALA 213 N -0.93 -1.29 0.09 5.45 0.00 -0.66 -0.67 121.76 123.75 2bqp s ALA 213 Ca -0.10 0.82 -0.12 0.00 0.00 0.00 0.00 51.96 52.56 2bqp s ALA 213 Cb -0.04 0.06 0.01 0.00 0.00 0.00 0.00 23.12 23.15 2bqp s ALA 213 CO 0.04 -0.33 0.27 0.95 0.00 0.00 0.00 175.76 176.69 2bqp s THR 214 N -1.33 0.11 0.26 0.00 -4.23 -1.17 -1.44 115.64 107.84 2bqp s THR 214 Ca -0.12 -0.90 0.03 0.00 -1.18 0.00 0.00 61.69 59.52 2bqp s THR 214 Cb -0.02 -1.20 -0.05 0.00 1.34 0.00 0.00 72.50 72.57 2bqp s THR 214 CO 0.07 -0.49 0.05 0.42 -0.54 0.00 0.00 174.62 174.12 2bqp s THR 215 N -3.55 0.87 0.00 3.99 -4.23 -0.13 -0.90 115.64 111.70 2bqp s THR 215 Ca 0.02 -2.01 0.00 0.00 -1.18 0.00 0.00 61.69 58.52 2bqp s THR 215 Cb 0.03 -2.57 0.00 0.00 1.34 0.00 0.00 72.50 71.30 2bqp s THR 215 CO -0.10 -0.12 0.00 0.61 -0.54 0.00 0.00 174.62 174.47 2bqp n GLY 216 N -0.50 4.06 0.25 3.99 0.00 -1.26 -3.14 105.19 108.59 2bqp n GLY 216 Ca -0.02 -0.37 -0.00 0.00 0.00 0.00 0.00 46.02 45.62 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 1.40 1.35 -3.39 4.61 0.00 -1.96 -0.30 119.26 120.96 2bqp h ALA 217 Ca 0.00 -0.24 -0.66 0.00 0.00 0.00 0.00 54.91 54.01 2bqp h ALA 217 Cb 0.00 -0.12 -0.14 0.00 0.00 0.00 0.00 17.79 17.53 2bqp h ALA 217 CO 0.00 0.44 -0.66 -1.21 0.00 0.00 0.00 179.25 177.83 2bqp s GLU 218 N -4.77 2.68 0.30 0.00 2.02 -1.26 -4.93 118.70 112.74 2bqp s GLU 218 Ca -0.07 -0.70 0.03 0.00 0.02 0.00 0.00 54.97 54.25 2bqp s GLU 218 Cb 0.15 -2.61 -0.03 0.00 0.10 0.00 0.00 34.13 31.75 2bqp s GLU 218 CO 0.76 0.59 0.29 1.52 0.02 0.00 0.00 175.26 178.45 2bqp s TYR 219 N -1.15 1.45 -0.27 1.61 -0.85 -1.25 -4.14 117.35 112.75 2bqp s TYR 219 Ca 0.21 -1.50 -0.36 0.00 -0.52 0.00 0.00 57.07 54.90 2bqp s TYR 219 Cb -0.12 -0.53 0.16 0.00 0.38 0.00 0.00 41.96 41.86 2bqp s TYR 219 CO 0.13 -0.88 1.34 0.00 -1.52 0.00 0.00 175.55 174.61 2bqp s ALA 220 N -3.54 -2.15 -0.03 9.51 0.00 -1.19 -4.15 121.76 120.21 2bqp s ALA 220 Ca 0.38 1.84 -0.20 0.00 0.00 0.00 0.00 51.96 53.98 2bqp s ALA 220 Cb 0.03 -0.61 -0.05 0.00 0.00 0.00 0.00 23.12 22.48 2bqp s ALA 220 CO 0.22 -0.48 0.59 0.00 0.00 0.00 0.00 175.76 176.09 2bqp s ALA 221 N -1.86 3.47 -0.19 0.00 0.00 -0.19 -4.34 121.76 118.66 2bqp s ALA 221 Ca 0.10 0.00 0.01 0.00 0.00 0.00 0.00 51.96 52.08 2bqp s ALA 221 Cb -0.01 -2.75 0.03 0.00 0.00 0.00 0.00 23.12 20.39 2bqp s ALA 221 CO -0.04 0.11 -0.16 -1.01 0.00 0.00 0.00 175.76 174.66 2bqp s HIS 222 N 0.04 2.67 0.10 0.00 3.76 -1.12 -1.08 115.29 119.65 2bqp s HIS 222 Ca 0.31 -1.65 0.07 0.00 -0.15 0.00 0.00 55.06 53.64 2bqp s HIS 222 Cb -0.18 -1.81 -0.03 0.00 1.11 0.00 0.00 32.58 31.67 2bqp s HIS 222 CO 0.16 -0.78 -0.17 -1.21 -0.85 0.00 0.00 174.74 171.89 2bqp s GLU 223 N 1.32 0.98 -0.10 1.40 2.02 -0.75 -1.03 118.70 122.54 2bqp s GLU 223 Ca 0.02 -1.10 0.02 0.00 0.02 0.00 0.00 54.97 53.93 2bqp s GLU 223 Cb -0.14 -1.07 -0.01 0.00 0.10 0.00 0.00 34.13 33.00 2bqp s GLU 223 CO -0.11 0.24 -0.17 0.08 0.02 0.00 0.00 175.26 175.32 2bqp s VAL 224 N -1.41 2.68 -0.12 2.63 1.01 0.22 -1.13 120.40 124.27 2bqp s VAL 224 Ca 0.04 -0.81 0.20 0.00 0.00 0.00 0.00 61.98 61.40 2bqp s VAL 224 Cb -0.09 -2.08 -0.22 0.00 0.00 0.00 0.00 36.38 33.99 2bqp s VAL 224 CO 0.03 0.55 0.54 0.18 0.00 0.00 0.00 175.10 176.40 2bqp n LEU 225 N 3.29 0.33 -3.51 3.92 4.32 0.12 -1.41 117.00 124.07 2bqp n LEU 225 Ca -0.18 0.14 -0.09 0.00 -0.02 0.00 0.00 56.01 55.86 2bqp n LEU 225 Cb 0.53 0.14 -0.02 0.00 -1.62 0.00 0.00 43.42 42.44 2bqp n LEU 225 CO 0.29 0.14 0.57 -0.94 -1.22 0.00 0.00 177.39 176.22 2bqp s SER 226 N -5.20 -0.43 -0.28 -1.43 1.04 -1.24 -4.49 113.70 101.67 2bqp s SER 226 Ca -0.06 -0.06 -0.20 0.00 0.48 0.00 0.00 55.95 56.10 2bqp s SER 226 Cb 0.10 0.49 0.08 0.00 0.10 0.00 0.00 66.02 66.79 2bqp s SER 226 CO 0.85 -0.82 0.72 0.86 0.98 0.00 0.00 173.24 175.83 2bqp s TRP 227 N -3.42 -0.92 0.04 5.02 -0.00 -0.20 -2.79 118.94 116.67 2bqp s TRP 227 Ca 0.04 2.01 0.01 0.00 -0.00 0.00 0.00 56.10 58.15 2bqp s TRP 227 Cb -0.01 0.45 -0.03 0.00 -0.00 0.00 0.00 33.47 33.88 2bqp s TRP 227 CO -0.09 -0.45 -0.05 -1.54 -0.00 0.00 0.00 176.95 174.82 2bqp s SER 228 N 1.01 0.56 -0.08 5.86 1.04 0.23 -0.19 113.70 122.14 2bqp s SER 228 Ca -0.05 -0.67 -0.17 0.00 0.48 0.00 0.00 55.95 55.54 2bqp s SER 228 Cb -0.05 0.10 0.04 0.00 0.10 0.00 0.00 66.02 66.21 2bqp s SER 228 CO -0.10 -0.35 0.40 0.12 0.98 0.00 0.00 173.24 174.29 2bqp s PHE 229 N -2.18 -0.35 -0.15 5.02 2.19 -0.17 -1.78 117.98 120.56 2bqp s PHE 229 Ca -0.07 0.72 -0.07 0.00 0.33 0.00 0.00 56.93 57.84 2bqp s PHE 229 Cb -0.05 0.16 0.06 0.00 -1.31 0.00 0.00 43.02 41.89 2bqp s PHE 229 CO -0.03 -0.35 0.34 -1.58 1.83 0.00 0.00 175.22 175.43 2bqp s HIS 230 N -0.70 -0.51 0.11 10.12 2.46 -0.46 -1.62 115.29 124.68 2bqp s HIS 230 Ca -0.08 1.11 0.05 0.00 0.47 0.00 0.00 55.06 56.62 2bqp s HIS 230 Cb -0.04 0.16 -0.04 0.00 -0.13 0.00 0.00 32.58 32.54 2bqp s HIS 230 CO 0.04 -0.32 -0.13 -1.54 -2.47 0.00 0.00 174.74 170.31 2bqp s SER 231 N 1.62 1.86 -0.14 9.88 1.04 -0.31 -1.62 113.70 126.03 2bqp s SER 231 Ca -0.07 -0.79 -0.04 0.00 0.48 0.00 0.00 55.95 55.52 2bqp s SER 231 Cb -0.10 -0.05 0.07 0.00 0.10 0.00 0.00 66.02 66.04 2bqp s SER 231 CO -0.11 -0.16 0.26 -0.70 0.98 0.00 0.00 173.24 173.51 2bqp s GLU 232 N -2.60 0.16 -0.20 4.02 2.12 -0.14 -2.20 118.70 119.85 2bqp s GLU 232 Ca 0.07 0.65 -0.02 0.00 0.36 0.00 0.00 54.97 56.03 2bqp s GLU 232 Cb -0.05 -0.24 0.00 0.00 0.26 0.00 0.00 34.13 34.10 2bqp s GLU 232 CO 0.02 -0.36 -0.11 -1.17 -0.54 0.00 0.00 175.26 173.10 2bqp s LEU 233 N 2.41 2.57 0.00 2.70 2.96 -0.06 -1.68 118.68 127.58 2bqp s LEU 233 Ca 0.03 -0.50 0.31 0.00 -0.22 0.00 0.00 54.13 53.75 2bqp s LEU 233 Cb -0.13 -1.63 1.78 0.00 0.50 0.00 0.00 46.19 46.71 2bqp s LEU 233 CO -0.09 -0.01 2.16 -1.20 -1.32 0.00 0.00 176.35 175.88