#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dq6 s ASP 2 N 0.00 3.83 -0.31 0.00 1.01 -1.26 -5.01 116.67 114.92 1dq6 s ASP 2 Ca 0.00 2.23 -0.09 0.00 0.71 0.00 0.00 52.55 55.40 1dq6 s ASP 2 Cb 0.00 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.36 1dq6 s ASP 2 CO 0.00 -2.50 0.13 -0.89 0.21 0.00 0.00 175.17 172.12 1dq6 s THR 3 N -2.32 4.35 -0.04 -1.27 2.01 -1.26 -5.03 115.64 112.08 1dq6 s THR 3 Ca 0.70 -0.57 0.06 0.00 0.31 0.00 0.00 61.69 62.19 1dq6 s THR 3 Cb -0.25 -3.25 -0.01 0.00 0.01 0.00 0.00 72.50 68.99 1dq6 s THR 3 CO 0.51 0.04 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.63 1dq6 s ILE 4 N 1.56 1.78 -0.14 1.82 -1.09 -1.26 -3.50 121.20 120.37 1dq6 s ILE 4 Ca 0.04 -0.93 0.01 0.00 -2.23 0.00 0.00 60.65 57.53 1dq6 s ILE 4 Cb -0.17 -1.50 0.02 0.00 -1.58 0.00 0.00 42.46 39.23 1dq6 s ILE 4 CO 0.05 0.50 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.40 1dq6 s VAL 5 N -0.26 1.70 0.04 2.92 1.01 -0.91 -0.53 120.40 124.36 1dq6 s VAL 5 Ca 0.01 -0.73 -0.03 0.00 0.00 0.00 0.00 61.98 61.23 1dq6 s VAL 5 Cb -0.11 -1.56 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 1dq6 s VAL 5 CO 0.01 0.48 0.03 0.00 0.00 0.00 0.00 175.10 175.62 1dq6 s ALA 6 N 1.21 0.15 -0.33 5.51 0.00 -0.25 -0.73 121.76 127.32 1dq6 s ALA 6 Ca -0.00 -0.76 -0.07 0.00 0.00 0.00 0.00 51.96 51.13 1dq6 s ALA 6 Cb -0.14 0.23 0.03 0.00 0.00 0.00 0.00 23.12 23.25 1dq6 s ALA 6 CO -0.07 -0.30 0.10 0.08 0.00 0.00 0.00 175.76 175.58 1dq6 s VAL 7 N -2.72 3.85 0.07 0.00 1.01 -0.03 -1.27 120.40 121.30 1dq6 s VAL 7 Ca -0.04 -1.04 -0.11 0.00 0.00 0.00 0.00 61.98 60.80 1dq6 s VAL 7 Cb -0.01 -3.14 -0.06 0.00 0.00 0.00 0.00 36.38 33.18 1dq6 s VAL 7 CO -0.05 -0.13 0.40 -1.83 0.00 0.00 0.00 175.10 173.49 1dq6 s GLU 8 N 1.43 3.78 -0.75 2.72 -1.05 -0.43 -1.91 118.70 122.48 1dq6 s GLU 8 Ca -0.01 0.21 -0.05 0.00 -0.15 0.00 0.00 54.97 54.97 1dq6 s GLU 8 Cb -0.19 -3.03 0.19 0.00 -0.44 0.00 0.00 34.13 30.66 1dq6 s GLU 8 CO 0.03 0.58 0.61 -0.51 0.95 0.00 0.00 175.26 176.92 1dq6 s LEU 9 N -1.78 5.62 -0.33 1.83 1.02 0.14 -1.96 118.68 123.22 1dq6 s LEU 9 Ca 0.31 -3.08 -0.20 0.00 0.02 0.00 0.00 54.13 51.18 1dq6 s LEU 9 Cb -0.14 -1.94 -0.00 0.00 0.02 0.00 0.00 46.19 44.12 1dq6 s LEU 9 CO 0.17 -0.35 0.60 -0.62 0.02 0.00 0.00 176.35 176.17 1dq6 s ASP 10 N 0.74 6.42 0.08 2.29 -1.08 -0.42 -1.85 116.67 122.85 1dq6 s ASP 10 Ca 0.20 0.21 0.23 0.00 -0.52 0.00 0.00 52.55 52.68 1dq6 s ASP 10 Cb -0.15 -2.31 0.14 0.00 -1.46 0.00 0.00 42.92 39.14 1dq6 s ASP 10 CO -0.07 -0.51 1.11 0.35 0.52 0.00 0.00 175.17 176.57 1dq6 n THR 11 N 5.47 0.25 -4.45 1.71 -2.24 -0.63 -1.55 114.28 112.84 1dq6 n THR 11 Ca -0.02 -0.27 -0.30 0.00 -2.27 0.00 0.00 64.05 61.19 1dq6 n THR 11 Cb 0.49 0.06 -0.17 0.00 -2.10 0.00 0.00 70.33 68.62 1dq6 n THR 11 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1dq6 s TYR 12 N -3.20 2.16 -0.72 4.78 6.14 -1.25 -4.56 117.35 120.70 1dq6 s TYR 12 Ca 0.04 -1.06 -0.26 0.00 0.64 0.00 0.00 57.07 56.42 1dq6 s TYR 12 Cb 0.14 -1.54 0.01 0.00 0.42 0.00 0.00 41.96 40.99 1dq6 s TYR 12 CO 0.78 -0.53 1.55 -1.25 0.64 0.00 0.00 175.55 176.73 1dq6 s PRO 13 N 1.01 2.97 -1.13 4.97 0.04 -1.26 -4.92 135.00 136.68 1dq6 s PRO 13 Ca -0.05 0.02 -0.12 0.00 0.04 0.00 0.00 61.00 60.90 1dq6 s PRO 13 Cb -0.15 -4.38 0.23 0.00 0.04 0.00 0.00 34.50 30.24 1dq6 s PRO 13 CO -0.03 -2.44 1.22 -0.80 0.04 0.00 0.00 177.00 174.99 1dq6 s ASN 14 N 5.71 7.18 0.62 6.66 -0.87 -1.26 -4.83 114.94 128.14 1dq6 s ASN 14 Ca 0.50 -3.26 0.37 0.00 -1.57 0.00 0.00 52.86 48.90 1dq6 s ASN 14 Cb -0.09 -2.29 2.03 0.00 -0.02 0.00 0.00 41.25 40.88 1dq6 s ASN 14 CO 0.15 -0.51 2.26 0.71 -2.57 0.00 0.00 177.10 177.14 1dq6 h THR 15 N 4.19 0.23 0.00 1.60 1.35 -1.83 -1.38 112.91 117.06 1dq6 h THR 15 Ca 0.23 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.96 1dq6 h THR 15 Cb 0.89 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.41 1dq6 h THR 15 CO 1.09 0.02 0.00 -2.24 -0.25 0.00 0.00 175.52 174.14 1dq6 h ASP 16 N 0.00 0.00 -0.06 5.36 2.03 -1.88 -2.78 116.42 119.10 1dq6 h ASP 16 Ca -0.00 0.00 -0.01 0.00 -0.73 0.00 0.00 57.03 56.29 1dq6 h ASP 16 Cb 0.10 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 38.60 1dq6 h ASP 16 CO 0.00 0.00 -0.05 2.30 -1.03 0.00 0.00 179.24 180.47 1dq6 n ILE 17 N -2.61 2.01 -0.22 4.15 -5.35 -0.58 -4.97 119.36 111.79 1dq6 n ILE 17 Ca 0.02 -2.30 0.00 0.00 -0.27 0.00 0.00 62.75 60.19 1dq6 n ILE 17 Cb 0.28 -0.25 0.00 0.00 -1.74 0.00 0.00 39.64 37.93 1dq6 n ILE 17 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1dq6 n GLY 18 N -1.24 0.63 3.77 3.28 0.00 -1.05 -4.67 105.19 105.91 1dq6 n GLY 18 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 1dq6 n GLY 18 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1dq6 s ASP 19 N -2.93 6.29 1.14 1.61 1.11 -0.85 -4.93 116.67 118.10 1dq6 s ASP 19 Ca 0.00 2.33 -0.14 0.00 0.18 0.00 0.00 52.55 54.92 1dq6 s ASP 19 Cb 0.00 -2.61 0.26 0.00 1.07 0.00 0.00 42.92 41.64 1dq6 s ASP 19 CO 0.00 -0.84 1.05 -2.16 1.18 0.00 0.00 175.17 174.40 1dq6 s PRO 20 N -2.55 -0.70 0.00 8.23 0.04 -1.26 -3.92 135.00 134.84 1dq6 s PRO 20 Ca 0.61 0.50 0.00 0.00 0.04 0.00 0.00 61.00 62.16 1dq6 s PRO 20 Cb -0.30 -1.61 0.00 0.00 0.04 0.00 0.00 34.50 32.64 1dq6 s PRO 20 CO 0.36 -3.49 0.56 0.43 0.04 0.00 0.00 177.00 174.90 1dq6 n SER 21 N -4.70 0.52 -3.94 6.66 7.64 -1.26 -4.56 113.62 113.98 1dq6 n SER 21 Ca 0.06 -1.63 -0.10 0.00 1.01 0.00 0.00 58.87 58.21 1dq6 n SER 21 Cb 0.57 -0.26 -0.06 0.00 -1.01 0.00 0.00 64.21 63.44 1dq6 n SER 21 CO 0.00 0.00 0.00 -0.72 -3.01 0.00 0.00 175.04 171.31 1dq6 s TYR 22 N -1.36 0.32 0.37 1.43 -0.85 -1.26 -4.91 117.35 111.10 1dq6 s TYR 22 Ca 0.00 -0.68 -0.27 0.00 -0.52 0.00 0.00 57.07 55.60 1dq6 s TYR 22 Cb 0.00 0.05 -0.11 0.00 0.38 0.00 0.00 41.96 42.28 1dq6 s TYR 22 CO 0.00 -0.81 1.23 -2.30 -1.52 0.00 0.00 175.55 172.15 1dq6 n PRO 23 N -0.27 1.91 -3.79 -3.49 -0.02 -1.26 -4.59 135.00 123.49 1dq6 n PRO 23 Ca -0.06 0.68 -0.09 0.00 -2.02 0.00 0.00 63.50 62.00 1dq6 n PRO 23 Cb 0.63 -2.28 -0.04 0.00 -0.02 0.00 0.00 33.50 31.79 1dq6 n PRO 23 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 1dq6 s HIS 24 N -1.15 -0.03 0.01 6.00 -3.43 -0.59 -1.87 115.29 114.22 1dq6 s HIS 24 Ca 0.58 -0.32 0.03 0.00 -0.80 0.00 0.00 55.06 54.55 1dq6 s HIS 24 Cb -0.56 0.36 -0.04 0.00 -1.43 0.00 0.00 32.58 30.92 1dq6 s HIS 24 CO 0.60 -0.93 -0.03 0.96 -2.00 0.00 0.00 174.74 173.33 1dq6 s ILE 25 N -3.90 3.90 0.14 -5.38 -4.36 0.13 -1.30 121.20 110.42 1dq6 s ILE 25 Ca 0.11 -0.72 -0.11 0.00 -0.26 0.00 0.00 60.65 59.67 1dq6 s ILE 25 Cb -0.01 -2.73 0.00 0.00 1.25 0.00 0.00 42.46 40.98 1dq6 s ILE 25 CO -0.01 0.36 0.30 -0.83 0.24 0.00 0.00 174.94 175.01 1dq6 s GLY 26 N -1.55 0.19 -0.27 6.27 0.00 -0.83 -0.85 107.32 110.28 1dq6 s GLY 26 Ca 0.19 -0.61 -0.05 0.00 0.00 0.00 0.00 44.72 44.25 1dq6 s GLY 26 CO 0.10 -0.68 0.02 -0.42 0.00 0.00 0.00 173.10 172.11 1dq6 s ILE 27 N -3.90 3.61 -0.29 0.90 1.01 -0.46 -1.31 121.20 120.75 1dq6 s ILE 27 Ca 0.11 -0.70 -0.09 0.00 0.00 0.00 0.00 60.65 59.97 1dq6 s ILE 27 Cb 0.03 -2.80 -0.01 0.00 0.01 0.00 0.00 42.46 39.69 1dq6 s ILE 27 CO -0.05 0.19 0.12 -1.81 0.00 0.00 0.00 174.94 173.39 1dq6 s ASP 28 N 1.46 5.39 -0.42 3.58 1.01 -0.40 -0.31 116.67 126.98 1dq6 s ASP 28 Ca 0.03 -0.46 -0.05 0.00 0.71 0.00 0.00 52.55 52.77 1dq6 s ASP 28 Cb -0.16 -1.97 0.10 0.00 1.01 0.00 0.00 42.92 41.90 1dq6 s ASP 28 CO -0.00 -0.15 0.24 -0.63 0.21 0.00 0.00 175.17 174.84 1dq6 s ILE 29 N 1.60 3.67 -0.94 0.77 -1.09 -1.26 -1.09 121.20 122.85 1dq6 s ILE 29 Ca 0.05 -1.84 0.00 0.00 -2.23 0.00 0.00 60.65 56.63 1dq6 s ILE 29 Cb -0.17 -3.42 0.00 0.00 -1.58 0.00 0.00 42.46 37.30 1dq6 s ILE 29 CO 0.05 -0.65 0.00 0.29 -1.23 0.00 0.00 174.94 173.40 1dq6 n LYS 30 N 4.73 -1.74 -3.59 2.79 5.02 0.31 -4.92 118.16 120.76 1dq6 n LYS 30 Ca -0.06 0.77 -0.16 0.00 -2.02 0.00 0.00 58.31 56.85 1dq6 n LYS 30 Cb 0.42 -5.13 -0.07 0.00 -0.02 0.00 0.00 35.03 30.23 1dq6 n LYS 30 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1dq6 s SER 31 N -2.21 -0.59 0.18 4.39 0.15 -1.26 -4.90 113.70 109.45 1dq6 s SER 31 Ca 0.00 0.78 0.21 0.00 0.70 0.00 0.00 55.95 57.64 1dq6 s SER 31 Cb 0.00 0.71 0.88 0.00 -1.71 0.00 0.00 66.02 65.90 1dq6 s SER 31 CO 0.00 -0.49 1.65 0.55 1.20 0.00 0.00 173.24 176.16 1dq6 n VAL 32 N 1.43 0.84 -2.67 4.45 3.14 -1.26 -4.31 118.33 119.96 1dq6 n VAL 32 Ca -0.18 0.20 -0.42 0.00 -2.96 0.00 0.00 64.34 60.98 1dq6 n VAL 32 Cb 0.56 -1.07 -0.03 0.00 -1.06 0.00 0.00 33.84 32.25 1dq6 n VAL 32 CO 0.00 0.00 0.00 -0.13 -6.46 0.00 0.00 176.83 170.24 1dq6 s ARG 33 N -3.21 3.52 0.30 1.45 0.52 -1.26 -4.98 118.95 115.29 1dq6 s ARG 33 Ca 0.06 -1.17 -0.27 0.00 -0.52 0.00 0.00 55.73 53.82 1dq6 s ARG 33 Cb 0.10 -5.06 -0.14 0.00 0.52 0.00 0.00 34.95 30.36 1dq6 s ARG 33 CO 0.37 -2.07 0.85 0.43 0.02 0.00 0.00 175.30 174.90 1dq6 n SER 34 N 8.29 0.51 0.15 0.23 7.64 -1.26 -4.84 113.62 124.33 1dq6 n SER 34 Ca 0.26 1.12 0.02 0.00 1.01 0.00 0.00 58.87 61.28 1dq6 n SER 34 Cb 0.50 -1.20 0.17 0.00 -1.01 0.00 0.00 64.21 62.66 1dq6 n SER 34 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 1dq6 h LYS 35 N 1.60 0.00 -2.63 1.43 1.79 -1.01 -3.45 116.57 114.30 1dq6 h LYS 35 Ca -0.38 0.00 -0.10 0.00 -2.18 0.00 0.00 60.65 57.99 1dq6 h LYS 35 Cb 1.37 0.00 -0.21 0.00 -1.58 0.00 0.00 32.23 31.80 1dq6 h LYS 35 CO 0.58 0.52 -0.13 0.21 -1.08 0.00 0.00 179.45 179.55 1dq6 s LYS 36 N -3.30 0.68 0.11 3.15 2.47 -1.23 -5.01 119.74 116.62 1dq6 s LYS 36 Ca 0.01 0.30 -0.02 0.00 -1.56 0.00 0.00 55.97 54.70 1dq6 s LYS 36 Cb 0.10 0.32 -0.03 0.00 -1.46 0.00 0.00 37.83 36.76 1dq6 s LYS 36 CO 0.73 -0.15 0.07 0.95 0.16 0.00 0.00 175.35 177.11 1dq6 s THR 37 N -0.54 0.13 -0.00 3.43 -4.23 -1.26 -1.36 115.64 111.81 1dq6 s THR 37 Ca -0.07 -1.78 -0.03 0.00 -1.18 0.00 0.00 61.69 58.63 1dq6 s THR 37 Cb -0.03 -1.86 -0.00 0.00 1.34 0.00 0.00 72.50 71.95 1dq6 s THR 37 CO 0.04 -0.58 0.06 0.00 -0.54 0.00 0.00 174.62 173.59 1dq6 s ALA 38 N -4.00 -0.13 0.34 3.99 0.00 -0.03 -4.95 121.76 116.98 1dq6 s ALA 38 Ca 0.18 -0.15 -0.28 0.00 0.00 0.00 0.00 51.96 51.71 1dq6 s ALA 38 Cb 0.07 0.03 -0.10 0.00 0.00 0.00 0.00 23.12 23.12 1dq6 s ALA 38 CO -0.02 -0.13 1.33 0.21 0.00 0.00 0.00 175.76 177.15 1dq6 s LYS 39 N -0.87 4.31 -0.11 0.00 2.20 -1.26 -0.70 119.74 123.31 1dq6 s LYS 39 Ca -0.10 2.25 0.01 0.00 -0.36 0.00 0.00 55.97 57.78 1dq6 s LYS 39 Cb -0.06 -3.04 0.02 0.00 -1.51 0.00 0.00 37.83 33.24 1dq6 s LYS 39 CO 0.00 -0.24 -0.13 -0.46 -0.36 0.00 0.00 175.35 174.16 1dq6 s TRP 40 N -1.15 1.87 -1.17 4.03 -0.00 -0.78 -4.76 118.94 116.98 1dq6 s TRP 40 Ca 0.50 -0.90 -0.15 0.00 -0.00 0.00 0.00 56.10 55.55 1dq6 s TRP 40 Cb -0.40 -1.38 0.16 0.00 -0.00 0.00 0.00 33.47 31.84 1dq6 s TRP 40 CO 0.54 -0.49 1.42 -0.80 -0.00 0.00 0.00 176.95 177.61 1dq6 s ASN 41 N 1.15 6.99 0.25 5.86 0.01 -1.26 -4.51 114.94 123.43 1dq6 s ASN 41 Ca -0.04 -2.81 -0.30 0.00 -0.71 0.00 0.00 52.86 49.00 1dq6 s ASN 41 Cb -0.14 -2.42 -0.11 0.00 0.41 0.00 0.00 41.25 38.99 1dq6 s ASN 41 CO -0.04 -0.83 1.57 -0.32 -1.51 0.00 0.00 177.10 175.97 1dq6 s MET 42 N 1.97 4.17 -0.32 -0.60 1.75 -1.26 -5.01 119.30 120.00 1dq6 s MET 42 Ca 0.42 2.49 0.01 0.00 -1.25 0.00 0.00 55.69 57.35 1dq6 s MET 42 Cb -0.03 -3.07 0.07 0.00 2.84 0.00 0.00 34.83 34.65 1dq6 s MET 42 CO -0.01 -0.59 0.02 -0.65 -0.65 0.00 0.00 175.02 173.14 1dq6 s GLN 43 N -0.05 2.09 0.12 4.11 -0.21 -1.26 -5.08 119.66 119.37 1dq6 s GLN 43 Ca 0.65 -1.53 -0.32 0.00 0.02 0.00 0.00 55.36 54.17 1dq6 s GLN 43 Cb -0.46 -3.19 -0.12 0.00 1.00 0.00 0.00 33.01 30.24 1dq6 s GLN 43 CO 0.43 -0.76 1.76 -1.71 -2.12 0.00 0.00 175.29 172.89 1dq6 n ASN 44 N 4.48 3.72 0.00 5.90 2.85 -1.26 -2.21 115.26 128.74 1dq6 n ASN 44 Ca -0.07 1.02 0.00 0.00 -0.11 0.00 0.00 54.58 55.42 1dq6 n ASN 44 Cb 0.42 -1.50 0.00 0.00 1.24 0.00 0.00 39.78 39.95 1dq6 n ASN 44 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1dq6 n GLY 45 N 4.01 1.44 3.84 8.20 0.00 0.11 -4.98 105.19 117.81 1dq6 n GLY 45 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 1dq6 n GLY 45 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1dq6 s LYS 46 N -0.18 3.15 -0.17 1.61 -0.14 -0.94 -4.94 119.74 118.12 1dq6 s LYS 46 Ca 0.00 -0.55 -0.26 0.00 -1.36 0.00 0.00 55.97 53.80 1dq6 s LYS 46 Cb 0.00 -2.88 -0.01 0.00 -1.68 0.00 0.00 37.83 33.25 1dq6 s LYS 46 CO 0.00 0.60 0.86 0.08 -0.76 0.00 0.00 175.35 176.13 1dq6 s VAL 47 N -1.41 4.86 0.45 3.17 1.01 -1.26 -4.13 120.40 123.08 1dq6 s VAL 47 Ca 0.31 1.69 0.07 0.00 0.00 0.00 0.00 61.98 64.04 1dq6 s VAL 47 Cb -0.13 -4.16 -0.01 0.00 0.00 0.00 0.00 36.38 32.08 1dq6 s VAL 47 CO 0.23 0.00 0.33 -0.83 0.00 0.00 0.00 175.10 174.84 1dq6 s GLY 48 N 1.17 2.26 -0.04 4.51 0.00 -0.12 -4.53 107.32 110.56 1dq6 s GLY 48 Ca 0.39 -1.79 0.01 0.00 0.00 0.00 0.00 44.72 43.33 1dq6 s GLY 48 CO 0.12 -1.82 -0.04 -1.59 0.00 0.00 0.00 173.10 169.77 1dq6 s THR 49 N -2.59 0.48 -0.08 0.90 2.01 -0.78 -1.75 115.64 113.83 1dq6 s THR 49 Ca 0.42 -0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.35 1dq6 s THR 49 Cb -0.01 -0.52 -0.02 0.00 0.01 0.00 0.00 72.50 71.95 1dq6 s THR 49 CO 0.25 0.22 -0.11 0.00 -0.69 0.00 0.00 174.62 174.29 1dq6 s ALA 50 N 0.97 2.79 -0.08 7.40 0.00 -0.33 -1.74 121.76 130.77 1dq6 s ALA 50 Ca -0.10 -0.91 0.03 0.00 0.00 0.00 0.00 51.96 50.97 1dq6 s ALA 50 Cb -0.14 -1.16 0.01 0.00 0.00 0.00 0.00 23.12 21.82 1dq6 s ALA 50 CO -0.00 0.46 -0.17 -1.01 0.00 0.00 0.00 175.76 175.04 1dq6 s HIS 51 N -0.40 1.87 -0.06 0.00 3.76 -0.47 -1.36 115.29 118.63 1dq6 s HIS 51 Ca 0.05 -0.71 0.03 0.00 -0.15 0.00 0.00 55.06 54.27 1dq6 s HIS 51 Cb -0.12 -1.30 0.01 0.00 1.11 0.00 0.00 32.58 32.27 1dq6 s HIS 51 CO 0.02 -0.32 -0.13 0.42 -0.85 0.00 0.00 174.74 173.88 1dq6 s ILE 52 N 0.50 1.19 0.06 0.60 1.01 0.21 -1.35 121.20 123.42 1dq6 s ILE 52 Ca -0.15 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 59.98 1dq6 s ILE 52 Cb -0.16 -1.07 -0.03 0.00 0.01 0.00 0.00 42.46 41.20 1dq6 s ILE 52 CO 0.06 0.36 -0.07 0.27 0.00 0.00 0.00 174.94 175.56 1dq6 s ILE 53 N 0.52 0.55 -0.07 2.92 -4.36 -0.50 -0.37 121.20 119.88 1dq6 s ILE 53 Ca -0.12 -1.37 -0.31 0.00 -0.26 0.00 0.00 60.65 58.60 1dq6 s ILE 53 Cb -0.15 -0.96 0.08 0.00 1.25 0.00 0.00 42.46 42.69 1dq6 s ILE 53 CO 0.03 -0.57 0.76 -0.47 0.24 0.00 0.00 174.94 174.93 1dq6 s TYR 54 N -2.19 -0.58 -0.03 1.37 5.04 -0.97 -2.08 117.35 117.91 1dq6 s TYR 54 Ca -0.03 0.98 -0.13 0.00 -2.44 0.00 0.00 57.07 55.45 1dq6 s TYR 54 Cb -0.05 0.42 0.02 0.00 0.35 0.00 0.00 41.96 42.71 1dq6 s TYR 54 CO -0.02 -0.55 0.28 0.54 -1.34 0.00 0.00 175.55 174.47 1dq6 s ASN 55 N -1.22 -0.19 0.07 4.32 2.20 -1.26 -1.91 114.94 116.95 1dq6 s ASN 55 Ca -0.08 0.15 0.19 0.00 -0.94 0.00 0.00 52.86 52.18 1dq6 s ASN 55 Cb -0.00 0.36 0.80 0.00 -2.00 0.00 0.00 41.25 40.41 1dq6 s ASN 55 CO 0.07 -0.37 1.61 -1.54 -2.94 0.00 0.00 177.10 173.93 1dq6 n SER 56 N 1.63 0.20 -0.06 3.54 3.41 0.72 -1.57 113.62 121.49 1dq6 n SER 56 Ca -0.20 0.54 -0.07 0.00 -0.26 0.00 0.00 58.87 58.88 1dq6 n SER 56 Cb 0.56 -0.59 -0.06 0.00 -0.26 0.00 0.00 64.21 63.86 1dq6 n SER 56 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1dq6 h VAL 57 N 0.00 0.84 -0.01 -3.33 2.07 -1.88 -3.38 116.25 110.56 1dq6 h VAL 57 Ca 0.00 -1.65 -0.16 0.00 0.82 0.00 0.00 66.70 65.71 1dq6 h VAL 57 Cb 0.34 1.60 -0.02 0.00 -1.52 0.00 0.00 31.29 31.69 1dq6 h VAL 57 CO 0.00 0.28 -0.75 0.44 0.02 0.00 0.00 177.57 177.57 1dq6 h ASP 58 N -1.00 0.09 -5.75 0.57 3.32 -1.97 -3.48 116.42 108.20 1dq6 h ASP 58 Ca -0.02 -0.06 -0.33 0.00 0.02 0.00 0.00 57.03 56.64 1dq6 h ASP 58 Cb 0.52 -0.03 0.14 0.00 0.22 0.00 0.00 39.33 40.19 1dq6 h ASP 58 CO -0.01 0.80 -0.84 0.29 -1.72 0.00 0.00 179.24 177.76 1dq6 n LYS 59 N -3.69 -4.00 -3.74 3.56 5.02 -0.61 -4.91 118.16 109.80 1dq6 n LYS 59 Ca -0.02 0.76 -0.19 0.00 -2.02 0.00 0.00 58.31 56.84 1dq6 n LYS 59 Cb 0.72 -5.48 -0.17 0.00 -0.02 0.00 0.00 35.03 30.08 1dq6 n LYS 59 CO 0.00 0.00 0.00 0.50 -0.52 0.00 0.00 177.40 177.38 1dq6 s ARG 60 N -5.23 0.06 -0.25 1.97 3.52 -1.26 -0.89 118.95 116.88 1dq6 s ARG 60 Ca 0.22 0.27 -0.15 0.00 -0.13 0.00 0.00 55.73 55.94 1dq6 s ARG 60 Cb -0.04 -0.51 -0.04 0.00 -1.56 0.00 0.00 34.95 32.80 1dq6 s ARG 60 CO 0.77 -0.27 0.38 -1.17 -0.81 0.00 0.00 175.30 174.20 1dq6 s LEU 61 N 1.77 4.07 0.10 -0.88 2.96 -0.48 -4.25 118.68 121.98 1dq6 s LEU 61 Ca 0.00 0.35 0.07 0.00 -0.22 0.00 0.00 54.13 54.34 1dq6 s LEU 61 Cb -0.12 -2.45 -0.03 0.00 0.50 0.00 0.00 46.19 44.09 1dq6 s LEU 61 CO -0.03 -0.15 -0.18 -0.44 -1.32 0.00 0.00 176.35 174.23 1dq6 s SER 62 N 1.45 2.29 -0.03 3.68 0.01 -0.88 -0.58 113.70 119.64 1dq6 s SER 62 Ca 0.16 -0.69 -0.06 0.00 1.31 0.00 0.00 55.95 56.67 1dq6 s SER 62 Cb -0.15 -0.11 0.01 0.00 0.21 0.00 0.00 66.02 65.97 1dq6 s SER 62 CO 0.09 -0.00 0.14 0.00 0.41 0.00 0.00 173.24 173.88 1dq6 s ALA 63 N -1.35 -0.33 -0.06 1.44 0.00 -0.62 -1.42 121.76 119.43 1dq6 s ALA 63 Ca 0.05 0.12 0.02 0.00 0.00 0.00 0.00 51.96 52.16 1dq6 s ALA 63 Cb -0.09 -0.07 0.01 0.00 0.00 0.00 0.00 23.12 22.98 1dq6 s ALA 63 CO 0.04 -0.14 -0.11 0.08 0.00 0.00 0.00 175.76 175.63 1dq6 s VAL 64 N -0.66 1.05 -0.08 0.00 1.01 -0.46 -1.84 120.40 119.42 1dq6 s VAL 64 Ca -0.07 -0.43 0.04 0.00 0.00 0.00 0.00 61.98 61.51 1dq6 s VAL 64 Cb -0.04 -0.97 0.00 0.00 0.00 0.00 0.00 36.38 35.37 1dq6 s VAL 64 CO 0.01 0.34 -0.21 -0.69 0.00 0.00 0.00 175.10 174.55 1dq6 s VAL 65 N 0.67 1.78 0.15 2.92 1.01 -0.05 -1.36 120.40 125.52 1dq6 s VAL 65 Ca -0.14 -0.87 -0.06 0.00 0.00 0.00 0.00 61.98 60.92 1dq6 s VAL 65 Cb -0.15 -1.55 -0.02 0.00 0.00 0.00 0.00 36.38 34.65 1dq6 s VAL 65 CO 0.03 0.50 0.20 -0.94 0.00 0.00 0.00 175.10 174.89 1dq6 s SER 66 N 0.36 0.14 0.06 3.32 1.04 -0.71 -0.74 113.70 117.17 1dq6 s SER 66 Ca -0.16 -1.00 0.05 0.00 0.48 0.00 0.00 55.95 55.32 1dq6 s SER 66 Cb -0.17 0.39 -0.03 0.00 0.10 0.00 0.00 66.02 66.31 1dq6 s SER 66 CO 0.07 -0.84 -0.14 -0.31 0.98 0.00 0.00 173.24 173.00 1dq6 s TYR 67 N -4.00 1.20 0.36 5.02 2.02 -1.26 -1.86 117.35 118.83 1dq6 s TYR 67 Ca 0.20 -0.44 -0.28 0.00 -0.37 0.00 0.00 57.07 56.18 1dq6 s TYR 67 Cb 0.05 -0.68 -0.12 0.00 -0.40 0.00 0.00 41.96 40.81 1dq6 s TYR 67 CO 0.01 0.05 1.32 -2.30 -1.57 0.00 0.00 175.55 173.05 1dq6 n PRO 68 N 1.40 2.18 -1.09 -1.71 -0.02 -1.26 -2.41 135.00 132.09 1dq6 n PRO 68 Ca -0.21 0.76 -0.03 0.00 -2.02 0.00 0.00 63.50 62.01 1dq6 n PRO 68 Cb 0.54 -2.39 -0.01 0.00 -0.02 0.00 0.00 33.50 31.62 1dq6 n PRO 68 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1dq6 n ASN 69 N 0.63 -4.74 -4.28 2.55 5.03 -1.26 -4.98 115.26 108.20 1dq6 n ASN 69 Ca 0.04 0.08 -0.16 0.00 0.87 0.00 0.00 54.58 55.42 1dq6 n ASN 69 Cb 0.37 -2.52 -0.10 0.00 -1.02 0.00 0.00 39.78 36.51 1dq6 n ASN 69 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1dq6 s ALA 70 N -1.66 1.64 0.50 5.41 0.00 -1.01 -5.14 121.76 121.50 1dq6 s ALA 70 Ca 0.00 -1.55 -0.20 0.00 0.00 0.00 0.00 51.96 50.21 1dq6 s ALA 70 Cb 0.00 0.01 -0.08 0.00 0.00 0.00 0.00 23.12 23.06 1dq6 s ALA 70 CO 0.00 -0.05 1.08 -0.51 0.00 0.00 0.00 175.76 176.28 1dq6 s ASP 71 N -3.22 6.13 0.45 0.00 1.01 -1.26 -4.59 116.67 115.20 1dq6 s ASP 71 Ca 0.19 2.04 0.04 0.00 0.71 0.00 0.00 52.55 55.53 1dq6 s ASP 71 Cb 0.02 -2.57 0.01 0.00 1.01 0.00 0.00 42.92 41.39 1dq6 s ASP 71 CO 0.03 -0.93 0.64 -0.94 0.21 0.00 0.00 175.17 174.18 1dq6 s SER 72 N -1.86 5.61 0.08 0.27 1.04 -1.26 -4.65 113.70 112.94 1dq6 s SER 72 Ca 0.69 -0.12 0.09 0.00 0.48 0.00 0.00 55.95 57.08 1dq6 s SER 72 Cb -0.20 -0.98 -0.04 0.00 0.10 0.00 0.00 66.02 64.90 1dq6 s SER 72 CO 0.23 -0.82 -0.20 0.00 0.98 0.00 0.00 173.24 173.43 1dq6 s ALA 73 N -2.49 2.57 -0.02 5.32 0.00 0.08 -4.96 121.76 122.26 1dq6 s ALA 73 Ca 0.53 -1.30 -0.07 0.00 0.00 0.00 0.00 51.96 51.12 1dq6 s ALA 73 Cb -0.10 -0.63 0.01 0.00 0.00 0.00 0.00 23.12 22.40 1dq6 s ALA 73 CO 0.35 0.57 0.15 -0.08 0.00 0.00 0.00 175.76 176.75 1dq6 s THR 74 N -1.02 0.05 -0.01 0.00 -1.32 -1.26 -0.87 115.64 111.21 1dq6 s THR 74 Ca 0.16 -0.43 -0.03 0.00 -1.21 0.00 0.00 61.69 60.17 1dq6 s THR 74 Cb -0.10 -0.36 -0.00 0.00 -1.51 0.00 0.00 72.50 70.53 1dq6 s THR 74 CO 0.07 -0.24 0.07 0.54 -2.21 0.00 0.00 174.62 172.85 1dq6 s VAL 75 N -0.83 0.05 0.02 5.08 0.11 -0.77 -4.78 120.40 119.28 1dq6 s VAL 75 Ca -0.09 -0.44 -0.01 0.00 -2.93 0.00 0.00 61.98 58.50 1dq6 s VAL 75 Cb -0.05 -0.24 -0.02 0.00 -1.53 0.00 0.00 36.38 34.54 1dq6 s VAL 75 CO 0.01 -0.24 0.00 -0.44 -3.33 0.00 0.00 175.10 171.10 1dq6 s SER 76 N -0.76 0.20 -0.09 3.54 0.01 -1.26 -1.59 113.70 113.75 1dq6 s SER 76 Ca -0.08 -0.44 -0.07 0.00 1.31 0.00 0.00 55.95 56.66 1dq6 s SER 76 Cb -0.05 0.12 0.03 0.00 0.21 0.00 0.00 66.02 66.33 1dq6 s SER 76 CO 0.00 -0.31 0.23 -0.47 0.41 0.00 0.00 173.24 173.10 1dq6 s TYR 77 N -1.44 -0.27 -0.28 2.43 5.04 0.26 -4.96 117.35 118.13 1dq6 s TYR 77 Ca -0.16 0.67 -0.29 0.00 -2.44 0.00 0.00 57.07 54.85 1dq6 s TYR 77 Cb -0.10 0.07 0.01 0.00 0.35 0.00 0.00 41.96 42.30 1dq6 s TYR 77 CO -0.01 -0.16 1.06 -0.51 -1.34 0.00 0.00 175.55 174.59 1dq6 s ASP 78 N 0.55 7.01 -0.22 4.32 1.01 -1.26 -1.38 116.67 126.70 1dq6 s ASP 78 Ca -0.03 1.21 -0.17 0.00 0.71 0.00 0.00 52.55 54.27 1dq6 s ASP 78 Cb -0.05 -2.54 0.06 0.00 1.01 0.00 0.00 42.92 41.40 1dq6 s ASP 78 CO -0.03 -0.78 0.56 0.54 0.21 0.00 0.00 175.17 175.67 1dq6 s VAL 79 N 3.43 -0.01 -0.54 -1.27 0.11 -0.07 -4.97 120.40 117.09 1dq6 s VAL 79 Ca 0.45 0.02 -0.21 0.00 -2.93 0.00 0.00 61.98 59.31 1dq6 s VAL 79 Cb -0.14 -0.79 0.06 0.00 -1.53 0.00 0.00 36.38 33.98 1dq6 s VAL 79 CO 0.11 0.01 0.74 -0.62 -3.33 0.00 0.00 175.10 172.00 1dq6 s ASP 80 N 0.83 6.24 0.56 3.54 -1.08 -1.26 -4.04 116.67 121.46 1dq6 s ASP 80 Ca -0.04 -0.84 0.34 0.00 -0.52 0.00 0.00 52.55 51.49 1dq6 s ASP 80 Cb -0.05 -2.34 1.59 0.00 -1.46 0.00 0.00 42.92 40.66 1dq6 s ASP 80 CO -0.07 -1.04 2.08 -0.07 0.52 0.00 0.00 175.17 176.59 1dq6 h LEU 81 N 10.17 0.00 -1.93 -1.34 3.38 -1.97 -1.81 115.31 121.82 1dq6 h LEU 81 Ca -0.27 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.67 1dq6 h LEU 81 Cb 1.09 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1dq6 h LEU 81 CO 1.03 0.05 -0.12 0.44 0.09 0.00 0.00 178.44 179.93 1dq6 h ASP 82 N 0.00 0.00 0.18 -0.43 3.32 -1.92 0.41 116.42 117.98 1dq6 h ASP 82 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1dq6 h ASP 82 Cb 0.38 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.93 1dq6 h ASP 82 CO 0.01 0.12 -0.24 0.59 -1.72 0.00 0.00 179.24 177.99 1dq6 n ASN 83 N -3.74 1.18 -0.02 6.45 3.02 -0.68 -4.42 115.26 117.05 1dq6 n ASN 83 Ca -0.02 -1.02 -0.03 0.00 -0.03 0.00 0.00 54.58 53.48 1dq6 n ASN 83 Cb 0.23 0.14 -0.02 0.00 -0.61 0.00 0.00 39.78 39.52 1dq6 n ASN 83 CO 0.00 0.00 0.00 0.52 -2.62 0.00 0.00 177.26 175.16 1dq6 n VAL 84 N -0.48 0.23 -4.09 2.41 0.31 -0.78 -5.08 118.33 110.85 1dq6 n VAL 84 Ca 0.13 -0.08 -0.22 0.00 -0.01 0.00 0.00 64.34 64.16 1dq6 n VAL 84 Cb 0.36 -0.85 -0.05 0.00 -0.91 0.00 0.00 33.84 32.39 1dq6 n VAL 84 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1dq6 s LEU 85 N -5.46 3.58 0.97 7.52 1.43 0.06 -4.98 118.68 121.81 1dq6 s LEU 85 Ca -0.05 -0.44 -0.12 0.00 -1.03 0.00 0.00 54.13 52.48 1dq6 s LEU 85 Cb 0.02 -2.12 0.17 0.00 0.03 0.00 0.00 46.19 44.29 1dq6 s LEU 85 CO 0.09 -0.13 1.09 -2.16 0.23 0.00 0.00 176.35 175.47 1dq6 s PRO 86 N -3.84 0.63 0.46 1.29 0.04 -1.26 -4.71 135.00 127.62 1dq6 s PRO 86 Ca 0.35 0.66 0.21 0.00 0.04 0.00 0.00 61.00 62.26 1dq6 s PRO 86 Cb -0.07 -1.75 1.14 0.00 0.04 0.00 0.00 34.50 33.87 1dq6 s PRO 86 CO 0.24 -2.63 1.98 1.49 0.04 0.00 0.00 177.00 178.12 1dq6 h GLU 87 N -1.82 0.00 -5.23 4.56 4.81 -1.94 -3.41 114.58 111.54 1dq6 h GLU 87 Ca -0.53 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.03 1dq6 h GLU 87 Cb 1.31 0.00 -0.32 0.00 0.63 0.00 0.00 28.75 30.38 1dq6 h GLU 87 CO 0.56 0.20 -0.83 -1.58 -0.73 0.00 0.00 179.01 176.63 1dq6 s TRP 88 N -4.24 2.71 0.33 0.92 0.52 -1.26 -1.03 118.94 116.89 1dq6 s TRP 88 Ca -0.03 -1.09 0.05 0.00 0.02 0.00 0.00 56.10 55.05 1dq6 s TRP 88 Cb 0.14 -1.83 -0.03 0.00 -1.15 0.00 0.00 33.47 30.60 1dq6 s TRP 88 CO 0.65 -0.48 0.21 0.14 0.02 0.00 0.00 176.95 177.48 1dq6 s VAL 89 N 0.69 0.21 0.09 4.03 -7.23 -0.36 -4.27 120.40 113.55 1dq6 s VAL 89 Ca -0.09 -2.00 0.09 0.00 -1.81 0.00 0.00 61.98 58.17 1dq6 s VAL 89 Cb -0.16 -2.46 -0.03 0.00 0.56 0.00 0.00 36.38 34.29 1dq6 s VAL 89 CO 0.02 0.00 -0.23 -0.13 -0.31 0.00 0.00 175.10 174.45 1dq6 s ARG 90 N -3.64 1.33 0.13 4.82 0.52 -0.51 0.40 118.95 122.01 1dq6 s ARG 90 Ca 0.35 -1.14 0.08 0.00 -0.52 0.00 0.00 55.73 54.50 1dq6 s ARG 90 Cb 0.03 -1.60 -0.04 0.00 0.52 0.00 0.00 34.95 33.86 1dq6 s ARG 90 CO 0.21 0.39 -0.10 0.14 0.02 0.00 0.00 175.30 175.96 1dq6 s VAL 91 N -1.00 3.28 0.10 3.52 -7.23 -1.26 -1.69 120.40 116.12 1dq6 s VAL 91 Ca 0.09 -1.40 -0.07 0.00 -1.81 0.00 0.00 61.98 58.78 1dq6 s VAL 91 Cb -0.10 -2.56 0.03 0.00 0.56 0.00 0.00 36.38 34.31 1dq6 s VAL 91 CO 0.04 0.04 0.36 0.61 -0.31 0.00 0.00 175.10 175.84 1dq6 n GLY 92 N 0.50 1.25 3.23 2.32 0.00 -0.33 -2.03 105.19 110.14 1dq6 n GLY 92 Ca -0.13 -1.05 -0.28 0.00 0.00 0.00 0.00 46.02 44.57 1dq6 n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dq6 s LEU 93 N 0.00 2.04 0.07 0.99 1.43 -0.62 -1.03 118.68 121.56 1dq6 s LEU 93 Ca 0.08 -0.39 0.02 0.00 -1.03 0.00 0.00 54.13 52.81 1dq6 s LEU 93 Cb -0.01 -1.10 -0.03 0.00 0.03 0.00 0.00 46.19 45.07 1dq6 s LEU 93 CO 0.03 0.26 -0.07 -0.55 0.23 0.00 0.00 176.35 176.26 1dq6 s SER 94 N -0.50 0.92 0.14 2.29 0.15 0.24 -1.32 113.70 115.63 1dq6 s SER 94 Ca 0.08 -0.79 -0.20 0.00 0.70 0.00 0.00 55.95 55.73 1dq6 s SER 94 Cb -0.08 0.08 0.06 0.00 -1.71 0.00 0.00 66.02 64.36 1dq6 s SER 94 CO -0.01 -0.36 0.52 0.00 1.20 0.00 0.00 173.24 174.59 1dq6 s ALA 95 N -2.62 -1.34 0.20 5.45 0.00 -0.74 -0.51 121.76 122.19 1dq6 s ALA 95 Ca 0.01 0.29 -0.12 0.00 0.00 0.00 0.00 51.96 52.14 1dq6 s ALA 95 Cb -0.02 0.80 0.00 0.00 0.00 0.00 0.00 23.12 23.91 1dq6 s ALA 95 CO -0.03 -0.71 0.40 -1.54 0.00 0.00 0.00 175.76 173.88 1dq6 s SER 96 N -2.75 -0.07 0.12 0.00 1.04 -1.14 -2.44 113.70 108.46 1dq6 s SER 96 Ca 0.02 -0.82 0.01 0.00 0.48 0.00 0.00 55.95 55.63 1dq6 s SER 96 Cb 0.00 0.52 -0.04 0.00 0.10 0.00 0.00 66.02 66.60 1dq6 s SER 96 CO -0.12 -1.02 -0.01 0.42 0.98 0.00 0.00 173.24 173.49 1dq6 s THR 97 N -3.97 0.49 0.00 2.02 -4.23 -0.28 -1.70 115.64 107.97 1dq6 s THR 97 Ca 0.18 -1.93 0.00 0.00 -1.18 0.00 0.00 61.69 58.76 1dq6 s THR 97 Cb 0.01 -1.89 0.00 0.00 1.34 0.00 0.00 72.50 71.96 1dq6 s THR 97 CO 0.03 -0.66 0.00 0.61 -0.54 0.00 0.00 174.62 174.06 1dq6 n GLY 98 N -0.10 4.23 0.17 3.99 0.00 -1.26 -0.69 105.19 111.53 1dq6 n GLY 98 Ca -0.09 -0.48 -0.06 0.00 0.00 0.00 0.00 46.02 45.39 1dq6 n GLY 98 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1dq6 h LEU 99 N 0.00 0.35-10.11 0.99 3.38 -1.97 -1.52 115.31 106.42 1dq6 h LEU 99 Ca 0.00 -0.20 -0.51 0.00 0.09 0.00 0.00 57.88 57.26 1dq6 h LEU 99 Cb 0.00 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1dq6 h LEU 99 CO 0.00 0.88 -0.36 -0.31 0.09 0.00 0.00 178.44 178.73 1dq6 s TYR 100 N -3.77 3.48 0.34 1.13 1.51 -1.26 -4.93 117.35 113.86 1dq6 s TYR 100 Ca -0.05 0.22 0.01 0.00 -1.01 0.00 0.00 57.07 56.24 1dq6 s TYR 100 Cb 0.12 -1.76 -0.01 0.00 -0.11 0.00 0.00 41.96 40.20 1dq6 s TYR 100 CO 0.81 0.39 0.41 -1.59 -1.11 0.00 0.00 175.55 174.46 1dq6 s LYS 101 N -3.57 1.88 -0.08 -0.62 -2.85 -1.26 -4.40 119.74 108.85 1dq6 s LYS 101 Ca 0.37 -1.87 -0.32 0.00 -1.00 0.00 0.00 55.97 53.15 1dq6 s LYS 101 Cb -0.10 0.41 0.12 0.00 -2.06 0.00 0.00 37.83 36.19 1dq6 s LYS 101 CO 0.30 -0.76 1.17 -1.83 0.10 0.00 0.00 175.35 174.34 1dq6 s GLU 102 N -3.14 0.48 0.27 1.78 -1.05 -1.21 -3.23 118.70 112.59 1dq6 s GLU 102 Ca 0.34 -0.22 -0.17 0.00 -0.15 0.00 0.00 54.97 54.77 1dq6 s GLU 102 Cb 0.00 0.19 -0.09 0.00 -0.44 0.00 0.00 34.13 33.80 1dq6 s GLU 102 CO 0.23 -0.21 0.72 0.95 0.95 0.00 0.00 175.26 177.90 1dq6 s THR 103 N -2.58 4.63 -0.57 1.83 -4.23 0.04 -4.70 115.64 110.06 1dq6 s THR 103 Ca 0.11 1.10 0.06 0.00 -1.18 0.00 0.00 61.69 61.78 1dq6 s THR 103 Cb 0.01 -3.74 0.27 0.00 1.34 0.00 0.00 72.50 70.38 1dq6 s THR 103 CO -0.04 0.02 0.73 0.59 -0.54 0.00 0.00 174.62 175.38 1dq6 n ASN 104 N 0.20 3.08 -4.76 3.99 4.13 -1.26 -3.77 115.26 116.87 1dq6 n ASN 104 Ca 0.00 -3.32 -0.39 0.00 1.68 0.00 0.00 54.58 52.55 1dq6 n ASN 104 Cb 0.52 -0.65 -0.05 0.00 -1.54 0.00 0.00 39.78 38.06 1dq6 n ASN 104 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1dq6 s THR 105 N -2.52 4.90 -0.20 3.41 2.01 -1.11 -2.24 115.64 119.89 1dq6 s THR 105 Ca 0.40 1.29 -0.04 0.00 0.31 0.00 0.00 61.69 63.66 1dq6 s THR 105 Cb 0.18 -3.96 -0.02 0.00 0.01 0.00 0.00 72.50 68.72 1dq6 s THR 105 CO -0.05 0.40 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.62 1dq6 s ILE 106 N -0.11 3.59 -0.11 1.82 -1.09 0.14 -1.36 121.20 124.08 1dq6 s ILE 106 Ca 0.32 -0.43 0.20 0.00 -2.23 0.00 0.00 60.65 58.51 1dq6 s ILE 106 Cb -0.18 -2.62 -0.25 0.00 -1.58 0.00 0.00 42.46 37.83 1dq6 s ILE 106 CO 0.18 0.44 0.49 0.18 -1.23 0.00 0.00 174.94 175.00 1dq6 n LEU 107 N 4.41 0.23 -3.45 2.97 4.32 -0.42 -1.45 117.00 123.62 1dq6 n LEU 107 Ca -0.18 0.10 -0.14 0.00 -0.02 0.00 0.00 56.01 55.77 1dq6 n LEU 107 Cb 0.51 0.13 -0.03 0.00 -1.62 0.00 0.00 43.42 42.41 1dq6 n LEU 107 CO 0.30 0.13 0.41 -0.94 -1.22 0.00 0.00 177.39 176.07 1dq6 s SER 108 N -5.05 -0.59 -0.23 -1.43 1.04 -1.23 -4.46 113.70 101.74 1dq6 s SER 108 Ca -0.07 0.19 -0.12 0.00 0.48 0.00 0.00 55.95 56.43 1dq6 s SER 108 Cb 0.11 0.58 0.08 0.00 0.10 0.00 0.00 66.02 66.89 1dq6 s SER 108 CO 0.86 -0.87 0.55 0.86 0.98 0.00 0.00 173.24 175.62 1dq6 s TRP 109 N -3.06 -0.88 0.07 5.02 -0.00 -0.11 -2.19 118.94 117.78 1dq6 s TRP 109 Ca -0.02 1.76 0.04 0.00 -0.00 0.00 0.00 56.10 57.87 1dq6 s TRP 109 Cb -0.01 0.47 -0.03 0.00 -0.00 0.00 0.00 33.47 33.91 1dq6 s TRP 109 CO -0.07 -0.46 -0.11 -1.54 -0.00 0.00 0.00 176.95 174.77 1dq6 s SER 110 N 1.71 1.35 -0.10 5.86 1.04 -0.36 -0.59 113.70 122.61 1dq6 s SER 110 Ca -0.09 -0.64 -0.08 0.00 0.48 0.00 0.00 55.95 55.62 1dq6 s SER 110 Cb -0.07 -0.01 0.03 0.00 0.10 0.00 0.00 66.02 66.07 1dq6 s SER 110 CO -0.16 -0.16 0.26 0.12 0.98 0.00 0.00 173.24 174.27 1dq6 s PHE 111 N -1.59 -0.30 -0.02 5.02 5.36 -0.48 -1.41 117.98 124.56 1dq6 s PHE 111 Ca -0.03 0.72 0.02 0.00 -0.96 0.00 0.00 56.93 56.68 1dq6 s PHE 111 Cb -0.08 0.09 0.01 0.00 -0.34 0.00 0.00 43.02 42.70 1dq6 s PHE 111 CO 0.01 -0.16 -0.05 0.99 -1.46 0.00 0.00 175.22 174.55 1dq6 s THR 112 N 0.38 0.50 -0.02 0.12 2.01 -0.54 -1.14 115.64 116.95 1dq6 s THR 112 Ca -0.02 -0.19 0.03 0.00 0.31 0.00 0.00 61.69 61.83 1dq6 s THR 112 Cb -0.04 -0.48 -0.00 0.00 0.01 0.00 0.00 72.50 71.99 1dq6 s THR 112 CO -0.02 0.18 -0.12 -0.55 -0.69 0.00 0.00 174.62 173.43 1dq6 s SER 113 N 0.39 1.46 0.00 3.53 0.15 0.46 -1.27 113.70 118.42 1dq6 s SER 113 Ca -0.05 -0.23 0.02 0.00 0.70 0.00 0.00 55.95 56.39 1dq6 s SER 113 Cb -0.09 -0.29 -0.01 0.00 -1.71 0.00 0.00 66.02 63.93 1dq6 s SER 113 CO -0.00 0.12 -0.05 -0.54 1.20 0.00 0.00 173.24 173.96 1dq6 s LYS 114 N -0.05 0.42 -0.20 5.44 1.02 -0.11 -1.61 119.74 124.65 1dq6 s LYS 114 Ca 0.00 -0.27 0.00 0.00 0.02 0.00 0.00 55.97 55.73 1dq6 s LYS 114 Cb -0.07 -0.37 0.05 0.00 -0.52 0.00 0.00 37.83 36.91 1dq6 s LYS 114 CO 0.00 0.10 -0.07 -0.51 -0.92 0.00 0.00 175.35 173.95 1dq6 s LEU 115 N -0.35 2.22 -0.29 3.17 1.43 -0.06 -1.51 118.68 123.29 1dq6 s LEU 115 Ca -0.00 -0.93 -0.10 0.00 -1.03 0.00 0.00 54.13 52.07 1dq6 s LEU 115 Cb -0.03 -1.14 -0.03 0.00 0.03 0.00 0.00 46.19 45.02 1dq6 s LEU 115 CO -0.00 -0.18 0.16 -0.54 0.23 0.00 0.00 176.35 176.02 1dq6 s LYS 116 N 1.45 3.69 0.71 1.70 1.02 0.42 -1.42 119.74 127.31 1dq6 s LYS 116 Ca -0.02 -0.48 -0.07 0.00 0.02 0.00 0.00 55.97 55.41 1dq6 s LYS 116 Cb -0.17 -3.58 0.06 0.00 -0.52 0.00 0.00 37.83 33.61 1dq6 s LYS 116 CO -0.07 -0.27 1.03 -1.12 -0.92 0.00 0.00 175.35 174.00 1dq6 s SER 117 N 1.69 4.89 0.00 2.83 0.01 0.11 0.01 113.70 123.24 1dq6 s SER 117 Ca 0.06 0.56 0.28 0.00 1.31 0.00 0.00 55.95 58.16 1dq6 s SER 117 Cb -0.16 -1.23 1.24 0.00 0.21 0.00 0.00 66.02 66.07 1dq6 s SER 117 CO 0.08 -1.57 1.91 -0.46 0.41 0.00 0.00 173.24 173.62 1dq6 n ASN 118 N -2.94 0.00 -4.78 2.44 2.04 -1.12 -4.58 115.26 106.32 1dq6 n ASN 118 Ca 0.08 0.41 -0.36 0.00 -0.44 0.00 0.00 54.58 54.26 1dq6 n ASN 118 Cb 0.60 -0.47 -0.03 0.00 -2.53 0.00 0.00 39.78 37.35 1dq6 n ASN 118 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 1dq6 s SER 119 N -2.94 6.54 0.09 0.53 0.01 -1.26 -4.93 113.70 111.74 1dq6 s SER 119 Ca 0.15 2.09 -0.31 0.00 1.31 0.00 0.00 55.95 59.20 1dq6 s SER 119 Cb 0.19 -2.59 -0.10 0.00 0.21 0.00 0.00 66.02 63.73 1dq6 s SER 119 CO 0.50 -0.65 1.91 0.28 0.41 0.00 0.00 173.24 175.69 1dq6 s THR 120 N -1.68 2.72 -0.12 1.44 -1.32 -1.26 -2.10 115.64 113.32 1dq6 s THR 120 Ca 0.61 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 61.09 1dq6 s THR 120 Cb -0.23 -3.00 0.00 0.00 -1.51 0.00 0.00 72.50 67.76 1dq6 s THR 120 CO 0.28 -0.00 0.00 1.41 -2.21 0.00 0.00 174.62 174.10 1dq6 n HIS 121 N 6.55 0.00 -2.75 9.09 8.25 -1.26 -4.97 115.22 130.13 1dq6 n HIS 121 Ca 0.19 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.22 1dq6 n HIS 121 Cb 0.39 -0.87 -0.03 0.00 1.12 0.00 0.00 29.99 30.60 1dq6 n HIS 121 CO 0.00 0.00 0.00 -2.00 0.64 0.00 0.00 176.34 174.98 1dq6 s GLU 122 N -1.02 3.48 -0.09 -0.41 2.56 -0.89 -4.97 118.70 117.35 1dq6 s GLU 122 Ca 0.00 -1.24 0.03 0.00 0.00 0.00 0.00 54.97 53.77 1dq6 s GLU 122 Cb 0.00 -4.90 0.00 0.00 2.00 0.00 0.00 34.13 31.23 1dq6 s GLU 122 CO 0.00 -1.97 -0.21 0.99 -0.56 0.00 0.00 175.26 173.51 1dq6 s THR 123 N 4.02 1.79 -0.12 -1.70 2.01 -1.26 0.10 115.64 120.48 1dq6 s THR 123 Ca 0.36 -0.86 -0.03 0.00 0.31 0.00 0.00 61.69 61.47 1dq6 s THR 123 Cb -0.05 -1.56 -0.03 0.00 0.01 0.00 0.00 72.50 70.86 1dq6 s THR 123 CO -0.04 0.50 -0.02 0.20 -0.69 0.00 0.00 174.62 174.57 1dq6 s ASN 124 N 0.43 5.01 0.05 3.53 -0.87 -0.51 -4.98 114.94 117.61 1dq6 s ASN 124 Ca -0.18 0.01 -0.06 0.00 -1.57 0.00 0.00 52.86 51.06 1dq6 s ASN 124 Cb -0.17 -1.60 -0.01 0.00 -0.02 0.00 0.00 41.25 39.45 1dq6 s ASN 124 CO 0.07 0.27 0.10 0.00 -2.57 0.00 0.00 177.10 174.98 1dq6 s ALA 125 N -0.26 -0.03 -0.04 0.60 0.00 -1.26 -0.88 121.76 119.89 1dq6 s ALA 125 Ca 0.05 -0.64 -0.02 0.00 0.00 0.00 0.00 51.96 51.35 1dq6 s ALA 125 Cb -0.12 0.30 0.02 0.00 0.00 0.00 0.00 23.12 23.31 1dq6 s ALA 125 CO 0.02 -0.36 0.08 -1.17 0.00 0.00 0.00 175.76 174.33 1dq6 s LEU 126 N -2.36 1.24 -0.07 0.00 2.96 -0.63 -4.99 118.68 114.82 1dq6 s LEU 126 Ca -0.02 0.16 -0.04 0.00 -0.22 0.00 0.00 54.13 54.01 1dq6 s LEU 126 Cb 0.01 0.18 0.03 0.00 0.50 0.00 0.00 46.19 46.91 1dq6 s LEU 126 CO -0.06 -0.09 0.16 -2.28 -1.32 0.00 0.00 176.35 172.76 1dq6 s HIS 127 N 0.69 -0.19 0.03 5.38 5.65 -1.26 -0.41 115.29 125.19 1dq6 s HIS 127 Ca -0.05 0.50 0.01 0.00 0.25 0.00 0.00 55.06 55.76 1dq6 s HIS 127 Cb -0.08 -0.01 -0.02 0.00 -1.18 0.00 0.00 32.58 31.29 1dq6 s HIS 127 CO -0.03 -0.14 -0.05 -0.59 -0.65 0.00 0.00 174.74 173.28 1dq6 s PHE 128 N 0.79 0.42 -0.11 3.88 -0.12 -0.29 -5.00 117.98 117.55 1dq6 s PHE 128 Ca -0.06 -0.57 -0.05 0.00 -0.05 0.00 0.00 56.93 56.20 1dq6 s PHE 128 Cb -0.08 -0.28 0.05 0.00 -0.63 0.00 0.00 43.02 42.09 1dq6 s PHE 128 CO -0.04 -0.17 0.24 1.41 -0.05 0.00 0.00 175.22 176.61 1dq6 s MET 129 N -1.75 0.18 -0.17 1.99 1.75 -1.26 -1.38 119.30 118.65 1dq6 s MET 129 Ca -0.12 0.58 -0.00 0.00 -1.25 0.00 0.00 55.69 54.90 1dq6 s MET 129 Cb -0.08 -0.11 0.00 0.00 2.84 0.00 0.00 34.83 37.48 1dq6 s MET 129 CO -0.01 -0.20 -0.15 -0.06 -0.65 0.00 0.00 175.02 173.95 1dq6 s PHE 130 N 1.58 2.81 -0.28 4.11 0.08 0.24 -4.93 117.98 121.59 1dq6 s PHE 130 Ca -0.06 -1.23 0.05 0.00 0.12 0.00 0.00 56.93 55.81 1dq6 s PHE 130 Cb -0.11 -1.94 -0.04 0.00 -0.57 0.00 0.00 43.02 40.36 1dq6 s PHE 130 CO -0.08 -0.60 0.25 0.09 -0.10 0.00 0.00 175.22 174.78 1dq6 n ASN 131 N 4.38 0.35 -3.72 1.36 3.02 -1.26 -0.94 115.26 118.45 1dq6 n ASN 131 Ca -0.20 -0.68 -0.12 0.00 -0.03 0.00 0.00 54.58 53.56 1dq6 n ASN 131 Cb 0.51 0.90 -0.13 0.00 -0.61 0.00 0.00 39.78 40.45 1dq6 n ASN 131 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1dq6 s GLN 132 N -1.37 0.21 -0.11 3.52 0.74 -1.26 -4.75 119.66 116.65 1dq6 s GLN 132 Ca 0.02 0.55 -0.02 0.00 0.05 0.00 0.00 55.36 55.96 1dq6 s GLN 132 Cb 0.04 -0.11 -0.03 0.00 1.10 0.00 0.00 33.01 34.00 1dq6 s GLN 132 CO 0.19 -0.17 -0.02 -0.06 -0.55 0.00 0.00 175.29 174.68 1dq6 s PHE 133 N 1.30 3.08 0.29 1.67 0.40 -0.39 -5.03 117.98 119.31 1dq6 s PHE 133 Ca -0.09 0.02 0.07 0.00 -0.60 0.00 0.00 56.93 56.33 1dq6 s PHE 133 Cb -0.10 -1.84 -0.03 0.00 0.51 0.00 0.00 43.02 41.56 1dq6 s PHE 133 CO -0.09 0.28 0.27 -1.54 0.70 0.00 0.00 175.22 174.84 1dq6 s SER 134 N -0.45 5.52 0.33 1.36 1.04 -1.26 -3.56 113.70 116.68 1dq6 s SER 134 Ca 0.08 -0.32 0.07 0.00 0.48 0.00 0.00 55.95 56.26 1dq6 s SER 134 Cb -0.12 -1.26 0.77 0.00 0.10 0.00 0.00 66.02 65.51 1dq6 s SER 134 CO 0.02 -0.19 1.83 0.11 0.98 0.00 0.00 173.24 175.99 1dq6 h LYS 135 N 1.33 0.73 -3.27 4.02 6.56 -1.84 -3.24 116.57 120.86 1dq6 h LYS 135 Ca -0.47 -0.04 -0.63 0.00 -1.06 0.00 0.00 60.65 58.44 1dq6 h LYS 135 Cb 1.25 -0.16 -0.41 0.00 -0.57 0.00 0.00 32.23 32.33 1dq6 h LYS 135 CO 0.59 0.48 -0.65 0.34 -2.06 0.00 0.00 179.45 178.15 1dq6 s ASP 136 N -5.62 4.18 -0.95 0.86 2.15 -1.26 -4.70 116.67 111.34 1dq6 s ASP 136 Ca -0.11 -2.99 -0.15 0.00 0.43 0.00 0.00 52.55 49.73 1dq6 s ASP 136 Cb 0.23 -1.50 0.19 0.00 -0.30 0.00 0.00 42.92 41.54 1dq6 s ASP 136 CO 0.80 -0.23 1.03 -1.58 -0.17 0.00 0.00 175.17 175.02 1dq6 s GLN 137 N -0.24 3.74 0.00 4.34 2.00 -1.22 -4.92 119.66 123.36 1dq6 s GLN 137 Ca 0.18 -2.30 0.10 0.00 -2.00 0.00 0.00 55.36 51.33 1dq6 s GLN 137 Cb -0.24 -4.71 0.41 0.00 0.80 0.00 0.00 33.01 29.26 1dq6 s GLN 137 CO -0.01 -1.53 1.30 1.63 -0.50 0.00 0.00 175.29 176.18 1dq6 n LYS 138 N 5.02 0.00 -0.37 1.67 5.02 -1.26 -2.60 118.16 125.65 1dq6 n LYS 138 Ca 0.22 0.33 0.08 0.00 -2.02 0.00 0.00 58.31 56.92 1dq6 n LYS 138 Cb 0.46 -1.50 0.26 0.00 -0.02 0.00 0.00 35.03 34.23 1dq6 n LYS 138 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1dq6 n ASP 139 N -1.50 3.34 -4.31 4.39 5.75 -1.26 -4.88 116.55 118.08 1dq6 n ASP 139 Ca 0.02 -2.14 -0.28 0.00 -0.01 0.00 0.00 54.79 52.38 1dq6 n ASP 139 Cb 0.11 -0.43 -0.14 0.00 -1.03 0.00 0.00 41.12 39.63 1dq6 n ASP 139 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 1dq6 s LEU 140 N -1.22 2.19 -0.28 -2.12 1.43 -1.07 -0.89 118.68 116.71 1dq6 s LEU 140 Ca 0.38 -0.58 -0.09 0.00 -1.03 0.00 0.00 54.13 52.81 1dq6 s LEU 140 Cb 0.22 -1.13 -0.02 0.00 0.03 0.00 0.00 46.19 45.29 1dq6 s LEU 140 CO 0.23 0.20 0.13 -0.63 0.23 0.00 0.00 176.35 176.51 1dq6 s ILE 141 N -0.84 4.59 -0.17 -0.59 1.01 0.37 -4.84 121.20 120.72 1dq6 s ILE 141 Ca 0.10 -0.26 -0.08 0.00 0.00 0.00 0.00 60.65 60.41 1dq6 s ILE 141 Cb -0.09 -3.25 -0.04 0.00 0.01 0.00 0.00 42.46 39.08 1dq6 s ILE 141 CO 0.02 0.19 0.10 -0.76 0.00 0.00 0.00 174.94 174.49 1dq6 s LEU 142 N 1.63 4.06 0.07 2.97 1.43 -1.26 -0.69 118.68 126.89 1dq6 s LEU 142 Ca 0.06 0.21 0.07 0.00 -1.03 0.00 0.00 54.13 53.44 1dq6 s LEU 142 Cb -0.16 -2.03 -0.03 0.00 0.03 0.00 0.00 46.19 44.00 1dq6 s LEU 142 CO 0.06 0.23 -0.20 -1.10 0.23 0.00 0.00 176.35 175.57 1dq6 s GLN 143 N 0.07 1.20 5.57 1.70 -0.21 -0.16 -4.98 119.66 122.86 1dq6 s GLN 143 Ca 0.08 -1.01 0.00 0.00 0.02 0.00 0.00 55.36 54.45 1dq6 s GLN 143 Cb -0.12 -1.36 0.00 0.00 1.00 0.00 0.00 33.01 32.53 1dq6 s GLN 143 CO -0.00 0.33 0.00 0.41 -2.12 0.00 0.00 175.29 173.91 1dq6 n GLY 144 N 1.52 2.22 0.47 3.09 0.00 -1.26 -1.82 105.19 109.40 1dq6 n GLY 144 Ca -0.18 -0.52 0.07 0.00 0.00 0.00 0.00 46.02 45.39 1dq6 n GLY 144 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1dq6 n ASP 145 N 2.32 1.38 -4.76 1.61 8.00 0.72 -4.92 116.55 120.90 1dq6 n ASP 145 Ca 0.00 -1.86 -0.41 0.00 0.71 0.00 0.00 54.79 53.22 1dq6 n ASP 145 Cb 0.00 -0.14 -0.02 0.00 -0.02 0.00 0.00 41.12 40.94 1dq6 n ASP 145 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1dq6 s ALA 146 N -1.71 3.56 0.05 2.24 0.00 -1.15 -4.40 121.76 120.35 1dq6 s ALA 146 Ca 0.23 1.31 0.00 0.00 0.00 0.00 0.00 51.96 53.50 1dq6 s ALA 146 Cb 0.12 -3.53 -0.03 0.00 0.00 0.00 0.00 23.12 19.68 1dq6 s ALA 146 CO 0.17 -0.71 -0.04 0.95 0.00 0.00 0.00 175.76 176.12 1dq6 s THR 147 N -0.55 0.31 0.36 0.00 -4.23 0.08 -4.73 115.64 106.89 1dq6 s THR 147 Ca 0.54 -1.50 0.07 0.00 -1.18 0.00 0.00 61.69 59.62 1dq6 s THR 147 Cb -0.41 -1.09 -0.07 0.00 1.34 0.00 0.00 72.50 72.27 1dq6 s THR 147 CO 0.48 -0.76 -0.01 0.42 -0.54 0.00 0.00 174.62 174.21 1dq6 s THR 148 N -2.88 1.82 0.00 3.99 -4.23 -1.26 -0.78 115.64 112.30 1dq6 s THR 148 Ca -0.01 -2.05 0.00 0.00 -1.18 0.00 0.00 61.69 58.45 1dq6 s THR 148 Cb 0.00 -2.83 0.00 0.00 1.34 0.00 0.00 72.50 71.02 1dq6 s THR 148 CO -0.05 -0.07 0.00 0.61 -0.54 0.00 0.00 174.62 174.57 1dq6 n GLY 149 N -0.83 3.44 3.56 3.99 0.00 -0.80 -4.35 105.19 110.20 1dq6 n GLY 149 Ca -0.04 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.58 1dq6 n GLY 149 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1dq6 s THR 150 N -2.76 3.49 -0.77 2.61 2.01 -1.24 -2.89 115.64 116.08 1dq6 s THR 150 Ca 0.00 0.35 0.00 0.00 0.31 0.00 0.00 61.69 62.35 1dq6 s THR 150 Cb 0.00 -4.08 0.00 0.00 0.01 0.00 0.00 72.50 68.43 1dq6 s THR 150 CO 0.00 -0.97 0.00 0.47 -0.69 0.00 0.00 174.62 173.43 1dq6 n ASP 151 N 11.53 -4.27 -0.80 3.53 8.00 -1.26 -1.87 116.55 131.41 1dq6 n ASP 151 Ca 0.18 0.18 -0.09 0.00 0.71 0.00 0.00 54.79 55.77 1dq6 n ASP 151 Cb 0.51 -2.41 -0.03 0.00 -0.02 0.00 0.00 41.12 39.17 1dq6 n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dq6 n GLY 152 N -1.58 0.70 3.71 0.44 0.00 -1.14 -4.98 105.19 102.35 1dq6 n GLY 152 Ca -0.07 -0.59 -0.25 0.00 0.00 0.00 0.00 46.02 45.10 1dq6 n GLY 152 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1dq6 s ASN 153 N -2.80 4.30 -0.26 1.61 0.01 -0.78 -1.26 114.94 115.76 1dq6 s ASN 153 Ca 0.00 -1.15 -0.07 0.00 -0.71 0.00 0.00 52.86 50.93 1dq6 s ASN 153 Cb 0.00 -0.45 -0.02 0.00 0.41 0.00 0.00 41.25 41.19 1dq6 s ASN 153 CO 0.00 -0.53 0.08 -0.22 -1.51 0.00 0.00 177.10 174.92 1dq6 s LEU 154 N -3.86 3.54 -0.44 0.60 2.96 -0.53 -1.90 118.68 119.05 1dq6 s LEU 154 Ca 0.39 -0.31 -0.11 0.00 -0.22 0.00 0.00 54.13 53.88 1dq6 s LEU 154 Cb 0.05 -1.92 0.08 0.00 0.50 0.00 0.00 46.19 44.90 1dq6 s LEU 154 CO 0.21 -0.07 0.31 -1.61 -1.32 0.00 0.00 176.35 173.87 1dq6 s GLU 155 N 1.59 2.73 0.27 1.98 0.41 0.04 0.24 118.70 125.97 1dq6 s GLU 155 Ca 0.06 -1.42 0.08 0.00 -0.41 0.00 0.00 54.97 53.27 1dq6 s GLU 155 Cb -0.16 -3.90 0.36 0.00 -1.78 0.00 0.00 34.13 28.66 1dq6 s GLU 155 CO 0.03 -0.98 1.63 -0.07 -0.49 0.00 0.00 175.26 175.38 1dq6 h LEU 156 N 8.52 0.15 -8.86 1.80 3.38 -1.71 0.25 115.31 118.85 1dq6 h LEU 156 Ca -0.25 -0.08 -0.45 0.00 0.09 0.00 0.00 57.88 57.20 1dq6 h LEU 156 Cb 1.09 -0.04 -0.15 0.00 0.09 0.00 0.00 40.66 41.65 1dq6 h LEU 156 CO 0.80 0.68 -0.74 0.42 0.09 0.00 0.00 178.44 179.69 1dq6 s THR 157 N -3.81 1.70 0.29 0.22 -4.23 -1.26 -2.90 115.64 105.65 1dq6 s THR 157 Ca -0.03 -2.17 -0.30 0.00 -1.18 0.00 0.00 61.69 58.01 1dq6 s THR 157 Cb 0.13 -2.00 -0.11 0.00 1.34 0.00 0.00 72.50 71.85 1dq6 s THR 157 CO 0.77 -0.58 1.59 -0.60 -0.54 0.00 0.00 174.62 175.27 1dq6 s ARG 158 N -3.55 4.12 -0.06 3.99 3.52 -1.26 -4.73 118.95 120.97 1dq6 s ARG 158 Ca 0.21 2.58 0.02 0.00 -0.13 0.00 0.00 55.73 58.41 1dq6 s ARG 158 Cb -0.01 -3.02 0.02 0.00 -1.56 0.00 0.00 34.95 30.37 1dq6 s ARG 158 CO 0.06 -0.63 -0.10 0.08 -0.81 0.00 0.00 175.30 173.90 1dq6 s VAL 159 N -0.02 0.97 0.63 7.11 1.01 -1.26 -1.36 120.40 127.49 1dq6 s VAL 159 Ca 0.63 -0.39 -0.10 0.00 0.00 0.00 0.00 61.98 62.13 1dq6 s VAL 159 Cb -0.48 -0.91 -0.01 0.00 0.00 0.00 0.00 36.38 34.98 1dq6 s VAL 159 CO 0.48 0.32 1.01 -0.94 0.00 0.00 0.00 175.10 175.96 1dq6 s SER 160 N 0.71 5.83 0.30 3.32 1.04 0.57 -4.84 113.70 120.63 1dq6 s SER 160 Ca -0.14 1.14 0.01 0.00 0.48 0.00 0.00 55.95 57.44 1dq6 s SER 160 Cb -0.15 -2.11 0.72 0.00 0.10 0.00 0.00 66.02 64.57 1dq6 s SER 160 CO 0.03 -1.05 1.58 0.28 0.98 0.00 0.00 173.24 175.06 1dq6 h SER 161 N -0.36 -0.48 0.07 7.02 0.02 -2.01 1.59 113.55 119.39 1dq6 h SER 161 Ca -0.45 0.27 0.00 0.00 -0.84 0.00 0.00 61.79 60.78 1dq6 h SER 161 Cb 1.23 0.48 0.00 0.00 0.14 0.00 0.00 62.40 64.25 1dq6 h SER 161 CO 0.62 -0.34 0.00 -0.46 -1.14 0.00 0.00 176.83 175.52 1dq6 n ASN 162 N -5.48 0.00 0.00 3.07 2.04 -1.26 -4.79 115.26 108.84 1dq6 n ASN 162 Ca 0.22 0.27 0.00 0.00 -0.44 0.00 0.00 54.58 54.64 1dq6 n ASN 162 Cb 0.73 -0.31 0.00 0.00 -2.53 0.00 0.00 39.78 37.66 1dq6 n ASN 162 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1dq6 n GLY 163 N -1.03 0.76 3.79 4.83 0.00 0.54 -5.07 105.19 109.01 1dq6 n GLY 163 Ca 0.01 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.58 1dq6 n GLY 163 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1dq6 s SER 164 N -2.06 7.20 0.33 1.61 0.01 -1.10 -4.72 113.70 114.98 1dq6 s SER 164 Ca 0.00 1.43 -0.26 0.00 1.31 0.00 0.00 55.95 58.42 1dq6 s SER 164 Cb 0.00 -2.43 -0.09 0.00 0.21 0.00 0.00 66.02 63.71 1dq6 s SER 164 CO 0.00 0.21 1.02 -2.16 0.41 0.00 0.00 173.24 172.71 1dq6 s PRO 165 N -0.93 4.47 0.08 12.44 0.04 -1.26 0.21 135.00 150.05 1dq6 s PRO 165 Ca 0.33 1.52 0.02 0.00 0.04 0.00 0.00 61.00 62.91 1dq6 s PRO 165 Cb -0.21 -2.84 -0.04 0.00 0.04 0.00 0.00 34.50 31.45 1dq6 s PRO 165 CO 0.22 0.13 0.15 -0.65 0.04 0.00 0.00 177.00 176.89 1dq6 s GLN 166 N -1.99 3.14 0.86 4.56 -1.52 -0.46 -4.82 119.66 119.41 1dq6 s GLN 166 Ca 0.51 -0.60 -0.11 0.00 -1.95 0.00 0.00 55.36 53.22 1dq6 s GLN 166 Cb -0.24 -2.86 0.16 0.00 -0.22 0.00 0.00 33.01 29.85 1dq6 s GLN 166 CO 0.30 0.58 1.19 0.20 -0.25 0.00 0.00 175.29 177.31 1dq6 s GLY 167 N -2.52 1.75 -1.25 3.09 0.00 -1.26 -4.40 107.32 102.72 1dq6 s GLY 167 Ca 0.32 -1.26 -0.23 0.00 0.00 0.00 0.00 44.72 43.54 1dq6 s GLY 167 CO 0.25 -0.61 0.44 1.44 0.00 0.00 0.00 173.10 174.62 1dq6 n SER 168 N -3.39 -2.39 -4.38 1.64 7.64 -0.57 -4.84 113.62 107.33 1dq6 n SER 168 Ca 0.14 -1.24 -0.27 0.00 1.01 0.00 0.00 58.87 58.51 1dq6 n SER 168 Cb 0.60 -1.50 -0.12 0.00 -1.01 0.00 0.00 64.21 62.18 1dq6 n SER 168 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1dq6 s SER 169 N -3.83 3.16 -0.11 6.43 0.15 -1.16 -4.94 113.70 113.41 1dq6 s SER 169 Ca 0.33 -0.80 -0.09 0.00 0.70 0.00 0.00 55.95 56.09 1dq6 s SER 169 Cb -0.18 -0.21 0.03 0.00 -1.71 0.00 0.00 66.02 63.95 1dq6 s SER 169 CO 0.93 0.11 0.28 0.54 1.20 0.00 0.00 173.24 176.31 1dq6 s VAL 170 N -1.41 -0.01 -0.01 4.45 0.11 -1.26 -1.13 120.40 121.15 1dq6 s VAL 170 Ca 0.15 0.03 -0.22 0.00 -2.93 0.00 0.00 61.98 59.01 1dq6 s VAL 170 Cb -0.09 -0.41 0.05 0.00 -1.53 0.00 0.00 36.38 34.40 1dq6 s VAL 170 CO 0.07 0.01 0.48 -0.83 -3.33 0.00 0.00 175.10 171.50 1dq6 s GLY 171 N 0.39 -0.36 0.03 6.54 0.00 -1.02 -0.20 107.32 112.70 1dq6 s GLY 171 Ca -0.02 0.69 -0.00 0.00 0.00 0.00 0.00 44.72 45.38 1dq6 s GLY 171 CO -0.02 0.41 -0.03 0.50 0.00 0.00 0.00 173.10 173.96 1dq6 s ARG 172 N -1.67 0.38 -0.08 2.90 0.52 -0.76 -1.80 118.95 118.44 1dq6 s ARG 172 Ca -0.10 -0.74 0.01 0.00 -0.52 0.00 0.00 55.73 54.38 1dq6 s ARG 172 Cb -0.02 0.13 0.02 0.00 0.52 0.00 0.00 34.95 35.60 1dq6 s ARG 172 CO 0.04 -0.06 -0.08 0.00 0.02 0.00 0.00 175.30 175.21 1dq6 s ALA 173 N -1.98 1.15 0.05 2.13 0.00 -0.43 -0.99 121.76 121.69 1dq6 s ALA 173 Ca -0.11 -0.39 0.09 0.00 0.00 0.00 0.00 51.96 51.55 1dq6 s ALA 173 Cb -0.06 -0.69 -0.03 0.00 0.00 0.00 0.00 23.12 22.34 1dq6 s ALA 173 CO -0.03 -0.16 -0.26 -0.51 0.00 0.00 0.00 175.76 174.81 1dq6 s LEU 174 N 1.21 2.17 0.21 0.00 1.02 0.14 -1.59 118.68 121.84 1dq6 s LEU 174 Ca -0.05 -0.59 -0.30 0.00 0.02 0.00 0.00 54.13 53.21 1dq6 s LEU 174 Cb -0.14 -1.25 -0.09 0.00 0.02 0.00 0.00 46.19 44.73 1dq6 s LEU 174 CO -0.02 0.25 1.38 0.12 0.02 0.00 0.00 176.35 178.09 1dq6 s PHE 175 N -0.81 3.15 0.21 0.29 5.36 -0.86 -0.48 117.98 124.84 1dq6 s PHE 175 Ca 0.11 1.10 -0.09 0.00 -0.96 0.00 0.00 56.93 57.09 1dq6 s PHE 175 Cb -0.10 -3.71 0.29 0.00 -0.34 0.00 0.00 43.02 39.16 1dq6 s PHE 175 CO 0.02 -2.30 1.74 -0.92 -1.46 0.00 0.00 175.22 172.30 1dq6 h TYR 176 N 5.36 0.41 -3.48 10.12 3.20 -1.34 -3.43 116.97 127.81 1dq6 h TYR 176 Ca -0.45 0.03 -0.53 0.00 3.14 0.00 0.00 58.73 60.92 1dq6 h TYR 176 Cb 1.21 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 39.36 1dq6 h TYR 176 CO 0.61 0.10 0.17 0.00 -1.64 0.00 0.00 178.16 177.41 1dq6 s ALA 177 N -6.09 3.42 0.68 1.82 0.00 -1.26 -5.03 121.76 115.30 1dq6 s ALA 177 Ca -0.13 0.33 -0.17 0.00 0.00 0.00 0.00 51.96 51.99 1dq6 s ALA 177 Cb 0.17 -2.97 0.01 0.00 0.00 0.00 0.00 23.12 20.33 1dq6 s ALA 177 CO 0.75 0.20 1.27 -2.14 0.00 0.00 0.00 175.76 175.84 1dq6 s PRO 178 N -0.70 2.37 -0.09 0.00 0.02 -1.26 -4.83 135.00 130.51 1dq6 s PRO 178 Ca 0.37 1.99 0.03 0.00 0.02 0.00 0.00 61.00 63.41 1dq6 s PRO 178 Cb -0.22 -1.83 -0.01 0.00 0.02 0.00 0.00 34.50 32.45 1dq6 s PRO 178 CO 0.25 -1.72 -0.18 0.08 -0.33 0.00 0.00 177.00 175.10 1dq6 s VAL 179 N -1.56 2.66 -0.38 3.83 1.01 0.16 -4.93 120.40 121.19 1dq6 s VAL 179 Ca 0.80 -0.83 -0.19 0.00 0.00 0.00 0.00 61.98 61.76 1dq6 s VAL 179 Cb -0.35 -2.06 0.01 0.00 0.00 0.00 0.00 36.38 33.98 1dq6 s VAL 179 CO 0.42 0.56 0.58 -2.28 0.00 0.00 0.00 175.10 174.37 1dq6 s HIS 180 N -0.01 3.14 -1.92 5.22 2.46 -1.26 -1.22 115.29 121.70 1dq6 s HIS 180 Ca -0.06 0.15 0.16 0.00 0.47 0.00 0.00 55.06 55.78 1dq6 s HIS 180 Cb -0.15 -3.08 0.19 0.00 -0.13 0.00 0.00 32.58 29.41 1dq6 s HIS 180 CO 0.05 -0.65 1.09 0.44 -2.47 0.00 0.00 174.74 173.19 1dq6 n ILE 181 N 5.57 0.19 -3.68 0.89 -5.35 -0.20 -4.88 119.36 111.90 1dq6 n ILE 181 Ca -0.03 -0.59 -0.14 0.00 -0.27 0.00 0.00 62.75 61.71 1dq6 n ILE 181 Cb 0.48 1.18 -0.08 0.00 -1.74 0.00 0.00 39.64 39.49 1dq6 n ILE 181 CO 0.00 0.00 0.00 0.86 -1.76 0.00 0.00 176.55 175.65 1dq6 s TRP 182 N -1.30 -0.45 -0.16 4.28 -0.00 -1.24 -4.92 118.94 115.15 1dq6 s TRP 182 Ca 0.22 0.93 -0.14 0.00 -0.00 0.00 0.00 56.10 57.11 1dq6 s TRP 182 Cb 0.14 0.21 0.04 0.00 -0.00 0.00 0.00 33.47 33.87 1dq6 s TRP 182 CO 0.21 -0.39 0.42 -2.00 -0.00 0.00 0.00 176.95 175.19 1dq6 s GLU 183 N -0.60 0.48 0.52 5.86 -6.30 -1.26 -4.91 118.70 112.49 1dq6 s GLU 183 Ca -0.07 0.61 0.21 0.00 -2.50 0.00 0.00 54.97 53.22 1dq6 s GLU 183 Cb -0.03 0.21 1.33 0.00 0.00 0.00 0.00 34.13 35.64 1dq6 s GLU 183 CO 0.04 -0.07 2.06 0.66 0.02 0.00 0.00 175.26 177.97 1dq6 h SER 184 N 5.68 0.02 -0.68 -1.70 4.64 -2.03 0.15 113.55 119.62 1dq6 h SER 184 Ca -0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.04 1dq6 h SER 184 Cb 1.18 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 1dq6 h SER 184 CO 0.25 0.01 0.00 -1.54 -0.87 0.00 0.00 176.83 174.68 1dq6 n SER 185 N -4.44 4.48 -4.75 4.97 3.41 -1.26 -4.98 113.62 111.04 1dq6 n SER 185 Ca 0.05 -2.29 -0.41 0.00 -0.26 0.00 0.00 58.87 55.96 1dq6 n SER 185 Cb 0.40 -0.55 -0.03 0.00 -0.26 0.00 0.00 64.21 63.77 1dq6 n SER 185 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dq6 s ALA 186 N -1.55 3.49 -0.19 7.33 0.00 0.04 -2.80 121.76 128.09 1dq6 s ALA 186 Ca 0.50 1.10 0.18 0.00 0.00 0.00 0.00 51.96 53.75 1dq6 s ALA 186 Cb 0.30 -3.45 -0.26 0.00 0.00 0.00 0.00 23.12 19.71 1dq6 s ALA 186 CO 0.28 -0.49 0.11 1.33 0.00 0.00 0.00 175.76 176.99 1dq6 n VAL 187 N 1.96 1.30 -3.74 0.00 0.24 0.10 -4.90 118.33 113.30 1dq6 n VAL 187 Ca 0.03 -0.83 -0.12 0.00 -2.04 0.00 0.00 64.34 61.38 1dq6 n VAL 187 Cb 0.43 -0.44 -0.12 0.00 -1.47 0.00 0.00 33.84 32.24 1dq6 n VAL 187 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1dq6 s VAL 188 N -2.56 -0.02 -0.07 3.34 0.11 -1.16 -4.84 120.40 115.20 1dq6 s VAL 188 Ca -0.10 0.08 0.05 0.00 -2.93 0.00 0.00 61.98 59.09 1dq6 s VAL 188 Cb 0.07 -0.44 -0.00 0.00 -1.53 0.00 0.00 36.38 34.47 1dq6 s VAL 188 CO 0.84 0.03 -0.22 0.00 -3.33 0.00 0.00 175.10 172.42 1dq6 s ALA 189 N 0.91 1.97 0.17 1.54 0.00 -1.26 -0.43 121.76 124.65 1dq6 s ALA 189 Ca -0.06 -0.91 -0.12 0.00 0.00 0.00 0.00 51.96 50.87 1dq6 s ALA 189 Cb -0.07 -0.66 0.00 0.00 0.00 0.00 0.00 23.12 22.39 1dq6 s ALA 189 CO -0.06 0.34 0.35 -1.54 0.00 0.00 0.00 175.76 174.84 1dq6 s SER 190 N 0.06 -0.05 0.14 0.00 1.04 -0.57 -0.20 113.70 114.12 1dq6 s SER 190 Ca -0.08 -0.72 -0.10 0.00 0.48 0.00 0.00 55.95 55.53 1dq6 s SER 190 Cb -0.14 0.47 -0.00 0.00 0.10 0.00 0.00 66.02 66.45 1dq6 s SER 190 CO 0.05 -0.93 0.27 0.72 0.98 0.00 0.00 173.24 174.34 1dq6 s PHE 191 N -3.93 0.26 -0.16 5.02 -0.12 -0.80 -0.94 117.98 117.31 1dq6 s PHE 191 Ca 0.13 -0.64 -0.14 0.00 -0.05 0.00 0.00 56.93 56.24 1dq6 s PHE 191 Cb 0.02 -0.01 0.04 0.00 -0.63 0.00 0.00 43.02 42.44 1dq6 s PHE 191 CO -0.02 -0.67 0.41 -1.83 -0.05 0.00 0.00 175.22 173.05 1dq6 s GLU 192 N -3.92 0.47 0.01 1.99 -1.05 -0.40 -2.30 118.70 113.50 1dq6 s GLU 192 Ca 0.12 0.59 0.02 0.00 -0.15 0.00 0.00 54.97 55.56 1dq6 s GLU 192 Cb 0.03 0.20 -0.01 0.00 -0.44 0.00 0.00 34.13 33.91 1dq6 s GLU 192 CO -0.04 -0.07 -0.07 0.00 0.95 0.00 0.00 175.26 176.03 1dq6 s ALA 193 N 0.36 0.56 -0.00 -0.84 0.00 0.50 -1.46 121.76 120.88 1dq6 s ALA 193 Ca -0.01 -0.43 0.01 0.00 0.00 0.00 0.00 51.96 51.53 1dq6 s ALA 193 Cb -0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 23.12 23.00 1dq6 s ALA 193 CO -0.01 0.09 -0.04 0.99 0.00 0.00 0.00 175.76 176.79 1dq6 s THR 194 N -0.52 0.31 0.02 0.00 2.01 -0.50 -0.62 115.64 116.34 1dq6 s THR 194 Ca -0.01 -0.20 -0.11 0.00 0.31 0.00 0.00 61.69 61.68 1dq6 s THR 194 Cb -0.05 -0.28 0.01 0.00 0.01 0.00 0.00 72.50 72.20 1dq6 s THR 194 CO 0.00 0.07 0.22 0.72 -0.69 0.00 0.00 174.62 174.94 1dq6 s PHE 195 N -0.15 -0.02 -0.04 4.92 -0.71 -0.46 -1.22 117.98 120.30 1dq6 s PHE 195 Ca 0.01 -0.08 0.06 0.00 -1.04 0.00 0.00 56.93 55.88 1dq6 s PHE 195 Cb -0.02 0.01 -0.02 0.00 -1.21 0.00 0.00 43.02 41.78 1dq6 s PHE 195 CO -0.00 -0.39 -0.23 0.95 -1.34 0.00 0.00 175.22 174.21 1dq6 s THR 196 N -1.98 2.29 0.10 -4.49 -4.23 -0.93 -1.19 115.64 105.21 1dq6 s THR 196 Ca -0.09 -1.00 0.03 0.00 -1.18 0.00 0.00 61.69 59.44 1dq6 s THR 196 Cb -0.04 -1.83 -0.04 0.00 1.34 0.00 0.00 72.50 71.93 1dq6 s THR 196 CO -0.01 0.58 -0.08 0.72 -0.54 0.00 0.00 174.62 175.29 1dq6 s PHE 197 N -0.49 0.97 -0.24 3.99 -0.71 -0.72 -1.30 117.98 119.49 1dq6 s PHE 197 Ca 0.06 -0.80 -0.01 0.00 -1.04 0.00 0.00 56.93 55.15 1dq6 s PHE 197 Cb -0.11 -0.54 0.07 0.00 -1.21 0.00 0.00 43.02 41.23 1dq6 s PHE 197 CO 0.01 -0.07 0.02 -1.17 -1.34 0.00 0.00 175.22 172.66 1dq6 s LEU 198 N -2.81 2.01 -0.27 -1.99 2.96 -0.46 -0.94 118.68 117.18 1dq6 s LEU 198 Ca 0.09 -1.16 -0.08 0.00 -0.22 0.00 0.00 54.13 52.77 1dq6 s LEU 198 Cb 0.02 -0.89 -0.02 0.00 0.50 0.00 0.00 46.19 45.79 1dq6 s LEU 198 CO -0.02 -0.30 0.09 -0.63 -1.32 0.00 0.00 176.35 174.16 1dq6 s ILE 199 N 1.61 4.33 -0.02 6.68 1.01 -1.26 -2.77 121.20 130.78 1dq6 s ILE 199 Ca -0.00 -0.27 0.02 0.00 0.00 0.00 0.00 60.65 60.39 1dq6 s ILE 199 Cb -0.18 -3.08 0.01 0.00 0.01 0.00 0.00 42.46 39.22 1dq6 s ILE 199 CO -0.11 0.26 -0.05 -0.75 0.00 0.00 0.00 174.94 174.29 1dq6 s LYS 200 N 1.60 0.63 -0.03 2.79 2.20 -1.25 0.07 119.74 125.76 1dq6 s LYS 200 Ca 0.06 -0.17 -0.04 0.00 -0.36 0.00 0.00 55.97 55.46 1dq6 s LYS 200 Cb -0.16 -0.63 0.01 0.00 -1.51 0.00 0.00 37.83 35.54 1dq6 s LYS 200 CO 0.04 0.05 0.09 0.45 -0.36 0.00 0.00 175.35 175.62 1dq6 s SER 201 N 0.30 -0.05 0.28 1.43 0.15 -1.26 -0.78 113.70 113.78 1dq6 s SER 201 Ca -0.04 0.07 0.24 0.00 0.70 0.00 0.00 55.95 56.93 1dq6 s SER 201 Cb -0.08 0.19 1.01 0.00 -1.71 0.00 0.00 66.02 65.44 1dq6 s SER 201 CO -0.00 -0.11 1.74 1.55 1.20 0.00 0.00 173.24 177.62 1dq6 h PRO 202 N 5.62 0.00 -6.20 5.44 0.13 -1.98 -3.45 132.00 131.56 1dq6 h PRO 202 Ca -0.26 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.36 1dq6 h PRO 202 Cb 1.20 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.32 1dq6 h PRO 202 CO 0.44 0.00 -0.38 -0.51 -0.23 0.00 0.00 178.00 177.31 1dq6 s ASP 203 N -4.37 6.34 0.41 1.44 1.01 -1.26 -5.02 116.67 115.22 1dq6 s ASP 203 Ca 0.04 0.24 0.21 0.00 0.71 0.00 0.00 52.55 53.75 1dq6 s ASP 203 Cb 0.09 -1.94 0.84 0.00 1.01 0.00 0.00 42.92 42.93 1dq6 s ASP 203 CO 0.41 -0.06 1.80 0.28 0.21 0.00 0.00 175.17 177.82 1dq6 h SER 204 N 1.63 0.00 -2.94 0.27 0.02 -1.97 -3.35 113.55 107.21 1dq6 h SER 204 Ca -0.50 0.00 -0.62 0.00 -0.84 0.00 0.00 61.79 59.84 1dq6 h SER 204 Cb 1.21 0.00 -0.42 0.00 0.14 0.00 0.00 62.40 63.33 1dq6 h SER 204 CO 0.65 0.29 -0.60 1.41 -1.14 0.00 0.00 176.83 177.45 1dq6 n HIS 205 N -3.52 3.09 -1.61 3.45 8.25 -1.26 -5.10 115.22 118.52 1dq6 n HIS 205 Ca -0.00 -4.25 -0.33 0.00 -0.26 0.00 0.00 57.72 52.88 1dq6 n HIS 205 Cb 0.45 -0.58 0.06 0.00 1.12 0.00 0.00 29.99 31.04 1dq6 n HIS 205 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1dq6 s PRO 206 N -1.52 2.61 -0.02 -0.41 0.04 -1.26 -4.39 135.00 130.06 1dq6 s PRO 206 Ca 0.27 1.37 -0.27 0.00 0.04 0.00 0.00 61.00 62.41 1dq6 s PRO 206 Cb -0.01 -1.93 0.06 0.00 0.04 0.00 0.00 34.50 32.66 1dq6 s PRO 206 CO -0.15 -1.39 0.60 0.00 0.04 0.00 0.00 177.00 176.10 1dq6 s ALA 207 N -2.44 -1.57 -0.07 8.56 0.00 -1.20 -4.10 121.76 120.93 1dq6 s ALA 207 Ca 0.66 1.04 0.07 0.00 0.00 0.00 0.00 51.96 53.73 1dq6 s ALA 207 Cb -0.20 0.12 -0.09 0.00 0.00 0.00 0.00 23.12 22.94 1dq6 s ALA 207 CO 0.45 -0.40 0.03 -0.25 0.00 0.00 0.00 175.76 175.59 1dq6 n ASP 208 N 0.81 3.15 0.00 0.00 8.00 -0.69 -3.34 116.55 124.48 1dq6 n ASP 208 Ca -0.19 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.31 1dq6 n ASP 208 Cb 0.58 0.69 0.00 0.00 -0.02 0.00 0.00 41.12 42.36 1dq6 n ASP 208 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1dq6 n GLY 209 N 2.54 1.06 3.13 0.44 0.00 -1.24 -1.60 105.19 109.52 1dq6 n GLY 209 Ca -0.12 -1.82 -0.20 0.00 0.00 0.00 0.00 46.02 43.88 1dq6 n GLY 209 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1dq6 s ILE 210 N -1.29 1.07 0.01 -0.61 1.01 -0.77 -2.88 121.20 117.74 1dq6 s ILE 210 Ca 0.00 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.72 1dq6 s ILE 210 Cb 0.00 -0.96 -0.01 0.00 0.01 0.00 0.00 42.46 41.50 1dq6 s ILE 210 CO 0.00 0.02 -0.04 0.00 0.00 0.00 0.00 174.94 174.92 1dq6 s ALA 211 N -0.80 0.30 -0.13 9.38 0.00 0.33 0.25 121.76 131.09 1dq6 s ALA 211 Ca 0.01 -0.39 -0.15 0.00 0.00 0.00 0.00 51.96 51.43 1dq6 s ALA 211 Cb -0.07 0.01 -0.05 0.00 0.00 0.00 0.00 23.12 23.01 1dq6 s ALA 211 CO 0.01 -0.01 0.36 0.12 0.00 0.00 0.00 175.76 176.24 1dq6 s PHE 212 N -0.71 3.51 0.13 0.00 5.36 -0.80 -0.59 117.98 124.87 1dq6 s PHE 212 Ca -0.05 0.73 -0.00 0.00 -0.96 0.00 0.00 56.93 56.64 1dq6 s PHE 212 Cb -0.05 -2.40 -0.04 0.00 -0.34 0.00 0.00 43.02 40.19 1dq6 s PHE 212 CO -0.00 0.26 0.03 -0.59 -1.46 0.00 0.00 175.22 173.46 1dq6 s PHE 213 N 0.34 0.92 -0.06 10.12 -0.71 -0.20 -0.85 117.98 127.55 1dq6 s PHE 213 Ca 0.20 -1.14 0.02 0.00 -1.04 0.00 0.00 56.93 54.97 1dq6 s PHE 213 Cb -0.14 -0.53 0.01 0.00 -1.21 0.00 0.00 43.02 41.15 1dq6 s PHE 213 CO 0.07 -0.40 -0.11 0.42 -1.34 0.00 0.00 175.22 173.85 1dq6 s ILE 214 N -3.91 1.07 0.31 -4.49 1.01 0.09 -1.19 121.20 114.09 1dq6 s ILE 214 Ca 0.21 -0.45 -0.01 0.00 0.00 0.00 0.00 60.65 60.41 1dq6 s ILE 214 Cb 0.07 -0.98 -0.01 0.00 0.01 0.00 0.00 42.46 41.54 1dq6 s ILE 214 CO 0.01 0.34 0.37 -0.94 0.00 0.00 0.00 174.94 174.72 1dq6 s SER 215 N 0.65 0.88 0.73 3.58 1.04 -0.68 -2.15 113.70 117.75 1dq6 s SER 215 Ca -0.14 -1.48 -0.16 0.00 0.48 0.00 0.00 55.95 54.66 1dq6 s SER 215 Cb -0.15 0.59 0.02 0.00 0.10 0.00 0.00 66.02 66.58 1dq6 s SER 215 CO 0.03 -1.15 1.13 -0.46 0.98 0.00 0.00 173.24 173.77 1dq6 n ASN 216 N -1.16 1.10 0.25 7.02 6.94 -1.23 -1.42 115.26 126.77 1dq6 n ASN 216 Ca 0.02 0.69 0.08 0.00 -0.02 0.00 0.00 54.58 55.35 1dq6 n ASN 216 Cb 0.62 -1.48 0.63 0.00 -2.36 0.00 0.00 39.78 37.19 1dq6 n ASN 216 CO 0.00 0.00 0.00 0.16 -1.03 0.00 0.00 177.26 176.39 1dq6 h ILE 217 N -0.23 0.98 -0.54 1.53 3.07 -1.86 -2.47 117.51 118.00 1dq6 h ILE 217 Ca -0.48 -0.20 -0.04 0.00 1.55 0.00 0.00 64.86 65.70 1dq6 h ILE 217 Cb 1.33 1.11 -0.02 0.00 -0.27 0.00 0.00 36.82 38.96 1dq6 h ILE 217 CO 0.48 0.05 0.05 -0.90 -1.05 0.00 0.00 178.15 176.79 1dq6 n ASP 218 N -4.39 5.05 -4.71 2.16 5.75 -1.26 -4.82 116.55 114.33 1dq6 n ASP 218 Ca -0.03 -2.87 -0.40 0.00 -0.01 0.00 0.00 54.79 51.48 1dq6 n ASP 218 Cb 0.14 -0.68 0.02 0.00 -1.03 0.00 0.00 41.12 39.57 1dq6 n ASP 218 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1dq6 n SER 219 N 0.42 2.59 -4.12 -1.12 2.88 -0.93 -5.02 113.62 108.32 1dq6 n SER 219 Ca 0.27 1.07 -0.08 0.00 -1.33 0.00 0.00 58.87 58.79 1dq6 n SER 219 Cb 1.13 -1.52 -0.10 0.00 -0.75 0.00 0.00 64.21 62.96 1dq6 n SER 219 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 1dq6 s SER 220 N -0.64 0.42 0.02 -3.46 1.04 -1.26 -5.08 113.70 104.74 1dq6 s SER 220 Ca 0.64 -1.09 -0.30 0.00 0.48 0.00 0.00 55.95 55.67 1dq6 s SER 220 Cb -0.48 0.24 -0.08 0.00 0.10 0.00 0.00 66.02 65.81 1dq6 s SER 220 CO 0.56 -0.66 1.83 -0.63 0.98 0.00 0.00 173.24 175.32 1dq6 s ILE 221 N -3.97 3.15 0.41 -1.02 1.01 -1.26 -4.95 121.20 114.56 1dq6 s ILE 221 Ca 0.15 0.27 -0.26 0.00 0.00 0.00 0.00 60.65 60.81 1dq6 s ILE 221 Cb 0.08 -3.18 -0.09 0.00 0.01 0.00 0.00 42.46 39.29 1dq6 s ILE 221 CO -0.05 -0.02 1.28 -2.84 0.00 0.00 0.00 174.94 173.32 1dq6 s PRO 222 N 4.01 3.96 0.36 2.79 0.02 -1.26 -4.94 135.00 139.93 1dq6 s PRO 222 Ca 0.82 2.10 -0.28 0.00 0.02 0.00 0.00 61.00 63.66 1dq6 s PRO 222 Cb -0.40 -2.73 -0.12 0.00 0.02 0.00 0.00 34.50 31.27 1dq6 s PRO 222 CO 0.37 -0.48 1.40 0.43 -0.33 0.00 0.00 177.00 178.38 1dq6 n SER 223 N 0.09 3.30 -2.15 2.53 7.64 -1.26 -2.54 113.62 121.23 1dq6 n SER 223 Ca 0.04 1.22 -0.17 0.00 1.01 0.00 0.00 58.87 60.97 1dq6 n SER 223 Cb 0.44 -1.55 0.01 0.00 -1.01 0.00 0.00 64.21 62.10 1dq6 n SER 223 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1dq6 n GLY 224 N 0.64 -0.27 1.89 0.23 0.00 -1.26 -4.79 105.19 101.63 1dq6 n GLY 224 Ca 0.03 -0.13 0.03 0.00 0.00 0.00 0.00 46.02 45.94 1dq6 n GLY 224 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dq6 n SER 225 N -1.34 5.35 -3.96 1.61 3.41 -1.05 -4.93 113.62 112.70 1dq6 n SER 225 Ca -0.13 -3.05 -0.30 0.00 -0.26 0.00 0.00 58.87 55.13 1dq6 n SER 225 Cb 0.62 -0.70 0.22 0.00 -0.26 0.00 0.00 64.21 64.09 1dq6 n SER 225 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1dq6 s THR 226 N -2.86 1.71 0.00 6.66 -4.23 -1.26 -0.74 115.64 114.92 1dq6 s THR 226 Ca 0.54 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.05 1dq6 s THR 226 Cb 0.42 -2.59 0.00 0.00 1.34 0.00 0.00 72.50 71.67 1dq6 s THR 226 CO 0.15 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.84 1dq6 n GLY 227 N -1.53 2.62 0.12 3.99 0.00 0.13 -3.12 105.19 107.41 1dq6 n GLY 227 Ca 0.13 -0.37 0.10 0.00 0.00 0.00 0.00 46.02 45.87 1dq6 n GLY 227 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1dq6 n ARG 228 N 13.54 0.14 -0.21 1.61 1.85 -1.26 -2.69 116.66 129.64 1dq6 n ARG 228 Ca 0.00 0.51 0.09 0.00 -1.00 0.00 0.00 57.85 57.45 1dq6 n ARG 228 Cb 0.00 -1.84 0.25 0.00 -1.05 0.00 0.00 32.46 29.81 1dq6 n ARG 228 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1dq6 n LEU 229 N -2.12 2.55 -1.24 2.89 4.77 -1.18 -4.96 117.00 117.70 1dq6 n LEU 229 Ca 0.00 -1.21 -0.12 0.00 -0.03 0.00 0.00 56.01 54.65 1dq6 n LEU 229 Cb 0.12 -0.27 -0.05 0.00 -2.33 0.00 0.00 43.42 40.88 1dq6 n LEU 229 CO 0.13 0.61 -0.11 0.18 -1.33 0.00 0.00 177.39 176.86 1dq6 n LEU 230 N 0.89 -0.81 0.00 2.23 4.77 -1.10 -1.88 117.00 121.10 1dq6 n LEU 230 Ca 0.17 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.45 1dq6 n LEU 230 Cb 0.42 -2.00 0.00 0.00 -2.33 0.00 0.00 43.42 39.51 1dq6 n LEU 230 CO 0.12 -0.70 0.00 0.61 -1.33 0.00 0.00 177.39 176.09 1dq6 n GLY 231 N -0.16 0.39 0.06 -0.72 0.00 0.08 -3.89 105.19 100.96 1dq6 n GLY 231 Ca -0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.82 1dq6 n GLY 231 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1dq6 n LEU 232 N 0.00 2.18 -4.44 0.99 4.77 -0.79 -4.41 117.00 115.31 1dq6 n LEU 232 Ca 0.00 -0.05 -0.29 0.00 -0.03 0.00 0.00 56.01 55.64 1dq6 n LEU 232 Cb 0.11 -0.27 -0.12 0.00 -2.33 0.00 0.00 43.42 40.81 1dq6 n LEU 232 CO 0.00 0.60 -0.53 -0.36 -1.33 0.00 0.00 177.39 175.76 1dq6 s PHE 233 N -2.26 2.42 -0.30 -1.77 0.08 -1.11 -4.78 117.98 110.27 1dq6 s PHE 233 Ca -0.14 -0.32 0.22 0.00 0.12 0.00 0.00 56.93 56.80 1dq6 s PHE 233 Cb 0.04 -1.31 0.36 0.00 -0.57 0.00 0.00 43.02 41.55 1dq6 s PHE 233 CO 0.33 0.35 1.60 -1.00 -0.10 0.00 0.00 175.22 176.41 1dq6 h PRO 234 N 3.87 0.00 -3.26 0.24 0.13 -1.90 -3.40 132.00 127.68 1dq6 h PRO 234 Ca -0.50 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.58 1dq6 h PRO 234 Cb 1.17 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.27 1dq6 h PRO 234 CO 0.43 0.15 0.14 0.16 -0.23 0.00 0.00 178.00 178.65 1dq6 s ASP 235 N -6.24 0.09 -0.27 1.44 1.47 -1.26 -4.88 116.67 107.02 1dq6 s ASP 235 Ca 0.05 -1.07 0.06 0.00 1.18 0.00 0.00 52.55 52.78 1dq6 s ASP 235 Cb 0.06 0.77 0.54 0.00 -0.34 0.00 0.00 42.92 43.95 1dq6 s ASP 235 CO 0.68 -1.49 1.58 0.00 0.68 0.00 0.00 175.17 176.61 1dq6 n ALA 236 N -0.51 4.30 1.78 2.11 0.00 -1.26 -4.69 120.51 122.23 1dq6 n ALA 236 Ca -0.05 -1.85 0.15 0.00 0.00 0.00 0.00 53.44 51.69 1dq6 n ALA 236 Cb 0.60 -1.24 0.76 0.00 0.00 0.00 0.00 19.45 19.57 1dq6 n ALA 236 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59