#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dqe s VAL 2 N 0.00 5.03 -0.00 2.53 1.01 -1.26 -3.97 120.40 123.74 2dqe s VAL 2 Ca 0.00 0.82 0.02 0.00 0.00 0.00 0.00 61.98 62.81 2dqe s VAL 2 Cb 0.00 -3.71 -0.00 0.00 0.00 0.00 0.00 36.38 32.67 2dqe s VAL 2 CO 0.00 0.56 -0.05 -1.10 0.00 0.00 0.00 175.10 174.51 2dqe s GLN 3 N -1.13 0.41 0.03 2.72 -0.21 0.94 -4.98 119.66 117.43 2dqe s GLN 3 Ca 0.24 -0.17 0.06 0.00 0.02 0.00 0.00 55.36 55.51 2dqe s GLN 3 Cb -0.16 -0.40 -0.02 0.00 1.00 0.00 0.00 33.01 33.42 2dqe s GLN 3 CO 0.14 0.10 -0.18 -0.51 -2.12 0.00 0.00 175.29 172.71 2dqe s LEU 4 N -0.08 2.14 -0.17 2.90 1.02 -1.26 -0.54 118.68 122.68 2dqe s LEU 4 Ca 0.02 -0.46 -0.08 0.00 0.02 0.00 0.00 54.13 53.62 2dqe s LEU 4 Cb -0.02 -0.87 0.07 0.00 0.02 0.00 0.00 46.19 45.39 2dqe s LEU 4 CO -0.00 0.14 0.40 -1.58 0.02 0.00 0.00 176.35 175.33 2dqe s GLN 5 N -1.01 0.35 0.38 1.70 0.74 -0.79 -4.29 119.66 116.73 2dqe s GLN 5 Ca 0.06 0.86 -0.16 0.00 0.05 0.00 0.00 55.36 56.17 2dqe s GLN 5 Cb -0.08 0.09 -0.09 0.00 1.10 0.00 0.00 33.01 34.03 2dqe s GLN 5 CO 0.01 -0.20 0.82 -1.21 -0.55 0.00 0.00 175.29 174.16 2dqe s GLU 6 N 1.88 4.03 0.05 1.67 8.01 -1.26 -1.20 118.70 131.89 2dqe s GLU 6 Ca -0.06 0.79 -0.14 0.00 0.01 0.00 0.00 54.97 55.57 2dqe s GLU 6 Cb -0.10 -2.34 0.02 0.00 -4.31 0.00 0.00 34.13 27.41 2dqe s GLU 6 CO -0.12 0.05 0.31 -1.54 0.01 0.00 0.00 175.26 173.97 2dqe s SER 7 N -2.41 -0.12 0.00 -0.19 1.04 0.16 -4.97 113.70 107.21 2dqe s SER 7 Ca 0.56 -0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.77 2dqe s SER 7 Cb -0.10 0.37 0.00 0.00 0.10 0.00 0.00 66.02 66.39 2dqe s SER 7 CO 0.19 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.38 2dqe n GLY 8 N 0.47 1.67 3.76 7.32 0.00 -1.26 -1.01 105.19 116.14 2dqe n GLY 8 Ca -0.18 -1.80 -0.39 0.00 0.00 0.00 0.00 46.02 43.65 2dqe n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dqe s PRO 9 N -1.44 3.52 -0.00 1.61 0.04 -1.26 -4.95 135.00 132.52 2dqe s PRO 9 Ca 0.00 2.17 0.21 0.00 0.04 0.00 0.00 61.00 63.42 2dqe s PRO 9 Cb 0.00 -2.46 -0.22 0.00 0.04 0.00 0.00 34.50 31.86 2dqe s PRO 9 CO 0.00 -0.87 0.89 -1.13 0.04 0.00 0.00 177.00 175.94 2dqe n SER 10 N -0.54 0.95 -3.81 6.66 3.41 -1.26 -4.79 113.62 114.23 2dqe n SER 10 Ca 0.07 -0.94 -0.19 0.00 -0.26 0.00 0.00 58.87 57.55 2dqe n SER 10 Cb 0.45 1.02 -0.17 0.00 -0.26 0.00 0.00 64.21 65.25 2dqe n SER 10 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 2dqe s LEU 11 N -3.06 1.00 0.13 1.04 2.96 -1.26 -0.62 118.68 118.86 2dqe s LEU 11 Ca 0.07 -0.06 0.02 0.00 -0.22 0.00 0.00 54.13 53.95 2dqe s LEU 11 Cb 0.16 -0.32 -0.04 0.00 0.50 0.00 0.00 46.19 46.49 2dqe s LEU 11 CO 0.87 -0.12 -0.05 0.68 -1.32 0.00 0.00 176.35 176.41 2dqe s VAL 12 N 1.29 0.73 0.13 1.68 -7.23 -0.58 -4.97 120.40 111.45 2dqe s VAL 12 Ca -0.06 -1.96 -0.02 0.00 -1.81 0.00 0.00 61.98 58.13 2dqe s VAL 12 Cb -0.13 -1.84 -0.05 0.00 0.56 0.00 0.00 36.38 34.92 2dqe s VAL 12 CO -0.02 -0.73 0.33 -0.54 -0.31 0.00 0.00 175.10 173.82 2dqe s LYS 13 N -3.85 3.53 0.50 4.82 -0.14 -1.26 -1.49 119.74 121.84 2dqe s LYS 13 Ca 0.16 -0.28 -0.23 0.00 -1.36 0.00 0.00 55.97 54.26 2dqe s LYS 13 Cb 0.05 -2.91 -0.07 0.00 -1.68 0.00 0.00 37.83 33.22 2dqe s LYS 13 CO -0.01 0.50 1.28 -2.30 -0.76 0.00 0.00 175.35 174.05 2dqe n PRO 14 N -0.07 1.72 0.00 -1.68 -0.02 -1.26 -2.35 135.00 131.34 2dqe n PRO 14 Ca -0.04 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.06 2dqe n PRO 14 Cb 0.52 -2.45 0.00 0.00 -0.02 0.00 0.00 33.50 31.55 2dqe n PRO 14 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 2dqe n SER 15 N -0.46 0.00 -4.55 2.55 2.88 0.17 -4.91 113.62 109.30 2dqe n SER 15 Ca 0.09 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.38 2dqe n SER 15 Cb 0.43 0.00 0.12 0.00 -0.75 0.00 0.00 64.21 64.01 2dqe n SER 15 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2dqe s GLN 16 N -0.09 1.45 -0.24 -1.46 -2.07 -0.99 -3.93 119.66 112.33 2dqe s GLN 16 Ca 0.00 -0.84 -0.12 0.00 -1.82 0.00 0.00 55.36 52.59 2dqe s GLN 16 Cb 0.00 -2.19 -0.05 0.00 -1.09 0.00 0.00 33.01 29.69 2dqe s GLN 16 CO 0.00 -1.68 0.22 0.99 -1.32 0.00 0.00 175.29 173.50 2dqe s THR 17 N -3.35 5.31 -0.13 3.63 2.01 -1.26 -1.94 115.64 119.91 2dqe s THR 17 Ca 0.68 0.31 -0.21 0.00 0.31 0.00 0.00 61.69 62.77 2dqe s THR 17 Cb -0.05 -3.56 -0.03 0.00 0.01 0.00 0.00 72.50 68.86 2dqe s THR 17 CO 0.47 0.30 0.63 -0.22 -0.69 0.00 0.00 174.62 175.11 2dqe s LEU 18 N 1.28 4.24 -0.07 4.42 0.20 -0.04 -4.89 118.68 123.81 2dqe s LEU 18 Ca 0.10 0.98 0.02 0.00 0.69 0.00 0.00 54.13 55.92 2dqe s LEU 18 Cb -0.14 -2.93 0.02 0.00 -0.43 0.00 0.00 46.19 42.70 2dqe s LEU 18 CO 0.06 -0.15 -0.10 -0.44 -0.29 0.00 0.00 176.35 175.43 2dqe s SER 19 N 0.91 1.72 0.18 3.68 0.01 -1.26 -0.37 113.70 118.57 2dqe s SER 19 Ca 0.32 -0.27 0.09 0.00 1.31 0.00 0.00 55.95 57.39 2dqe s SER 19 Cb -0.16 -0.77 -0.04 0.00 0.21 0.00 0.00 66.02 65.25 2dqe s SER 19 CO 0.13 -0.01 -0.18 -0.76 0.41 0.00 0.00 173.24 172.84 2dqe s LEU 20 N 0.88 2.46 0.01 2.44 1.43 0.04 -4.42 118.68 121.53 2dqe s LEU 20 Ca -0.11 -0.89 0.07 0.00 -1.03 0.00 0.00 54.13 52.17 2dqe s LEU 20 Cb -0.15 -0.84 -0.02 0.00 0.03 0.00 0.00 46.19 45.21 2dqe s LEU 20 CO 0.01 -0.04 -0.21 -0.89 0.23 0.00 0.00 176.35 175.45 2dqe s THR 21 N -2.19 1.69 -0.22 5.49 2.01 -0.18 -1.55 115.64 120.70 2dqe s THR 21 Ca 0.18 -1.04 0.02 0.00 0.31 0.00 0.00 61.69 61.15 2dqe s THR 21 Cb -0.05 -1.43 0.04 0.00 0.01 0.00 0.00 72.50 71.07 2dqe s THR 21 CO 0.07 0.36 -0.13 0.00 -0.69 0.00 0.00 174.62 174.24 2dqe s SER 23 N 1.26 6.60 -0.17 0.00 0.01 -0.34 -1.92 113.70 119.14 2dqe s SER 23 Ca -0.03 0.71 -0.05 0.00 1.31 0.00 0.00 55.95 57.89 2dqe s SER 23 Cb -0.17 -2.26 -0.03 0.00 0.21 0.00 0.00 66.02 63.77 2dqe s SER 23 CO -0.08 -0.01 -0.00 -0.69 0.41 0.00 0.00 173.24 172.87 2dqe s VAL 24 N 0.77 4.12 -0.03 3.43 1.01 -0.87 -1.88 120.40 126.93 2dqe s VAL 24 Ca 0.23 -0.27 0.05 0.00 0.00 0.00 0.00 61.98 61.99 2dqe s VAL 24 Cb -0.15 -2.83 -0.01 0.00 0.00 0.00 0.00 36.38 33.39 2dqe s VAL 24 CO 0.09 0.47 -0.19 -0.89 0.00 0.00 0.00 175.10 174.58 2dqe s THR 25 N 0.53 1.54 0.00 3.92 2.01 0.30 -4.78 115.64 119.15 2dqe s THR 25 Ca -0.01 -0.80 0.00 0.00 0.31 0.00 0.00 61.69 61.19 2dqe s THR 25 Cb -0.14 -1.31 0.00 0.00 0.01 0.00 0.00 72.50 71.06 2dqe s THR 25 CO 0.02 0.44 0.00 0.61 -0.69 0.00 0.00 174.62 175.00 2dqe n GLY 26 N 2.93 2.51 3.60 4.40 0.00 -1.25 -0.04 105.19 117.33 2dqe n GLY 26 Ca -0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.80 2dqe n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2dqe s ASP 27 N -1.76 -0.23 0.33 1.61 2.15 -1.26 -4.70 116.67 112.81 2dqe s ASP 27 Ca 0.00 -0.12 -0.27 0.00 0.43 0.00 0.00 52.55 52.59 2dqe s ASP 27 Cb 0.00 0.33 -0.09 0.00 -0.30 0.00 0.00 42.92 42.86 2dqe s ASP 27 CO 0.00 -0.57 1.06 -0.55 -0.17 0.00 0.00 175.17 174.94 2dqe s SER 28 N -2.60 7.07 0.59 -0.34 0.15 -1.26 -4.92 113.70 112.39 2dqe s SER 28 Ca 0.09 2.13 0.38 0.00 0.70 0.00 0.00 55.95 59.25 2dqe s SER 28 Cb -0.00 -2.61 1.85 0.00 -1.71 0.00 0.00 66.02 63.55 2dqe s SER 28 CO -0.05 -0.27 2.15 0.16 1.20 0.00 0.00 173.24 176.43 2dqe h ILE 29 N 2.68 0.00 0.00 6.45 3.07 -1.91 -1.23 117.51 126.57 2dqe h ILE 29 Ca -0.47 -0.26 0.00 0.00 1.55 0.00 0.00 64.86 65.68 2dqe h ILE 29 Cb 1.21 1.24 0.00 0.00 -0.27 0.00 0.00 36.82 39.00 2dqe h ILE 29 CO 0.65 0.00 0.00 0.35 -1.05 0.00 0.00 178.15 178.10 2dqe n THR 30 N -3.04 0.28 -1.10 0.16 -2.24 -1.26 -3.23 114.28 103.84 2dqe n THR 30 Ca -0.01 0.07 0.01 0.00 -2.27 0.00 0.00 64.05 61.85 2dqe n THR 30 Cb 0.19 -0.76 0.27 0.00 -2.10 0.00 0.00 70.33 67.93 2dqe n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2dqe n SER 31 N -1.18 4.04 -3.52 3.42 7.64 -0.46 -4.95 113.62 118.60 2dqe n SER 31 Ca 0.11 -3.24 -0.03 0.00 1.01 0.00 0.00 58.87 56.72 2dqe n SER 31 Cb 0.12 -0.64 0.00 0.00 -1.01 0.00 0.00 64.21 62.68 2dqe n SER 31 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2dqe s ASP 32 N -1.68 -0.07 -0.07 6.43 -1.08 -1.20 -5.04 116.67 113.96 2dqe s ASP 32 Ca 0.48 -0.54 -0.04 0.00 -0.52 0.00 0.00 52.55 51.92 2dqe s ASP 32 Cb 0.40 0.48 -0.04 0.00 -1.46 0.00 0.00 42.92 42.30 2dqe s ASP 32 CO 0.09 -0.92 0.13 -0.31 0.52 0.00 0.00 175.17 174.67 2dqe s TYR 33 N -2.62 3.48 -0.02 -5.34 1.51 -1.26 -4.34 117.35 108.76 2dqe s TYR 33 Ca 0.18 0.39 0.06 0.00 -1.01 0.00 0.00 57.07 56.69 2dqe s TYR 33 Cb -0.02 -1.86 -0.01 0.00 -0.11 0.00 0.00 41.96 39.96 2dqe s TYR 33 CO 0.04 0.65 -0.22 -1.58 -1.11 0.00 0.00 175.55 173.33 2dqe s TRP 34 N -1.12 1.96 0.30 2.71 0.52 -0.14 -1.22 118.94 121.95 2dqe s TRP 34 Ca 0.19 -0.41 0.02 0.00 0.02 0.00 0.00 56.10 55.93 2dqe s TRP 34 Cb -0.12 -1.27 -0.05 0.00 -1.15 0.00 0.00 33.47 30.88 2dqe s TRP 34 CO 0.09 -0.06 0.10 -1.54 0.02 0.00 0.00 176.95 175.57 2dqe s SER 35 N -0.43 1.70 -0.04 2.95 1.04 -0.36 -0.50 113.70 118.07 2dqe s SER 35 Ca 0.06 -1.45 0.03 0.00 0.48 0.00 0.00 55.95 55.07 2dqe s SER 35 Cb -0.09 0.19 0.01 0.00 0.10 0.00 0.00 66.02 66.22 2dqe s SER 35 CO -0.00 -0.76 -0.11 0.26 0.98 0.00 0.00 173.24 173.62 2dqe s TRP 36 N -3.56 1.16 0.03 5.02 0.52 -0.65 -2.41 118.94 119.05 2dqe s TRP 36 Ca 0.36 -0.33 0.03 0.00 0.02 0.00 0.00 56.10 56.17 2dqe s TRP 36 Cb 0.07 -0.83 -0.02 0.00 -1.15 0.00 0.00 33.47 31.54 2dqe s TRP 36 CO 0.15 -0.15 -0.08 0.42 0.02 0.00 0.00 176.95 177.30 2dqe s ILE 37 N 0.32 0.63 0.06 2.03 1.09 -0.18 -1.04 121.20 124.11 2dqe s ILE 37 Ca -0.06 -0.82 0.03 0.00 -1.10 0.00 0.00 60.65 58.70 2dqe s ILE 37 Cb -0.11 -0.62 -0.03 0.00 -1.06 0.00 0.00 42.46 40.64 2dqe s ILE 37 CO 0.01 -0.15 -0.09 0.00 -0.10 0.00 0.00 174.94 174.61 2dqe s ARG 38 N -1.07 0.66 -0.18 2.79 1.70 -0.58 -0.02 118.95 122.25 2dqe s ARG 38 Ca -0.04 -0.93 -0.00 0.00 -0.47 0.00 0.00 55.73 54.29 2dqe s ARG 38 Cb -0.07 -0.40 0.01 0.00 -0.57 0.00 0.00 34.95 33.92 2dqe s ARG 38 CO 0.00 0.07 -0.16 0.21 -1.08 0.00 0.00 175.30 174.34 2dqe s LYS 39 N -2.08 3.11 0.60 3.89 2.20 0.35 -0.89 119.74 126.91 2dqe s LYS 39 Ca -0.04 -0.78 -0.10 0.00 -0.36 0.00 0.00 55.97 54.70 2dqe s LYS 39 Cb -0.07 -2.66 -0.04 0.00 -1.51 0.00 0.00 37.83 33.55 2dqe s LYS 39 CO -0.00 -0.16 0.99 -0.06 -0.36 0.00 0.00 175.35 175.76 2dqe s PHE 40 N 1.23 3.61 0.52 4.03 0.08 0.08 -1.17 117.98 126.36 2dqe s PHE 40 Ca 0.03 1.20 0.35 0.00 0.12 0.00 0.00 56.93 58.63 2dqe s PHE 40 Cb -0.14 -2.65 1.50 0.00 -0.57 0.00 0.00 43.02 41.16 2dqe s PHE 40 CO -0.08 -0.63 1.76 -1.35 -0.10 0.00 0.00 175.22 174.82 2dqe h PRO 41 N -0.23 0.06 -0.78 0.24 0.11 -1.89 0.15 132.00 129.66 2dqe h PRO 41 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2dqe h PRO 41 Cb 1.19 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2dqe h PRO 41 CO 0.62 0.04 0.00 0.41 -0.21 0.00 0.00 178.00 178.86 2dqe n GLY 42 N -1.73 1.28 2.48 -0.55 0.00 -1.26 -4.83 105.19 100.58 2dqe n GLY 42 Ca 0.28 -0.13 -0.16 0.00 0.00 0.00 0.00 46.02 46.01 2dqe n GLY 42 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2dqe n ASN 43 N 0.04 -4.90 -4.54 1.61 3.02 0.04 -4.99 115.26 105.53 2dqe n ASN 43 Ca 0.04 -0.10 -0.35 0.00 -0.03 0.00 0.00 54.58 54.13 2dqe n ASN 43 Cb 0.33 -3.91 -0.11 0.00 -0.61 0.00 0.00 39.78 35.48 2dqe n ASN 43 CO 0.00 0.00 0.00 -0.60 -2.62 0.00 0.00 177.26 174.04 2dqe s ARG 44 N -5.07 3.80 -0.06 3.52 3.52 -1.22 -4.93 118.95 118.51 2dqe s ARG 44 Ca 0.10 -0.42 -0.10 0.00 -0.13 0.00 0.00 55.73 55.18 2dqe s ARG 44 Cb -0.04 -3.24 -0.05 0.00 -1.56 0.00 0.00 34.95 30.06 2dqe s ARG 44 CO 0.12 0.06 0.26 -0.51 -0.81 0.00 0.00 175.30 174.42 2dqe s LEU 45 N 0.94 4.42 -0.07 -0.88 1.43 -1.26 -0.74 118.68 122.52 2dqe s LEU 45 Ca 0.03 0.67 0.01 0.00 -1.03 0.00 0.00 54.13 53.81 2dqe s LEU 45 Cb -0.14 -2.34 0.02 0.00 0.03 0.00 0.00 46.19 43.76 2dqe s LEU 45 CO 0.03 0.36 -0.07 -0.70 0.23 0.00 0.00 176.35 176.20 2dqe s GLU 46 N -1.14 1.18 -0.37 1.70 2.12 -0.07 -5.00 118.70 117.12 2dqe s GLU 46 Ca 0.20 -0.19 -0.26 0.00 0.36 0.00 0.00 54.97 55.07 2dqe s GLU 46 Cb -0.14 -1.16 0.02 0.00 0.26 0.00 0.00 34.13 33.11 2dqe s GLU 46 CO 0.09 -0.12 0.95 -0.47 -0.54 0.00 0.00 175.26 175.17 2dqe s TYR 47 N 1.13 3.07 -0.02 5.30 6.14 -1.26 -1.53 117.35 130.19 2dqe s TYR 47 Ca -0.07 0.80 -0.20 0.00 0.64 0.00 0.00 57.07 58.24 2dqe s TYR 47 Cb -0.14 -3.70 -0.28 0.00 0.42 0.00 0.00 41.96 38.26 2dqe s TYR 47 CO -0.01 -0.85 1.00 0.52 0.64 0.00 0.00 175.55 176.85 2dqe h MET 48 N 8.49 0.37 0.00 4.97 2.86 -1.45 -3.41 114.93 126.76 2dqe h MET 48 Ca -0.23 -0.51 0.00 0.00 -2.06 0.00 0.00 59.70 56.90 2dqe h MET 48 Cb 1.08 0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.91 2dqe h MET 48 CO 0.99 1.19 0.00 0.41 1.06 0.00 0.00 176.91 180.57 2dqe n GLY 49 N 1.39 -0.85 3.32 8.32 0.00 -1.17 -1.13 105.19 115.07 2dqe n GLY 49 Ca -0.12 -1.28 -0.11 0.00 0.00 0.00 0.00 46.02 44.51 2dqe n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2dqe s TYR 50 N -2.00 -0.22 -0.10 1.61 1.13 -0.48 -1.63 117.35 115.65 2dqe s TYR 50 Ca 0.00 -0.05 0.04 0.00 -1.41 0.00 0.00 57.07 55.65 2dqe s TYR 50 Cb 0.00 0.26 -0.00 0.00 -1.10 0.00 0.00 41.96 41.12 2dqe s TYR 50 CO 0.00 -0.68 -0.23 0.54 -2.51 0.00 0.00 175.55 172.67 2dqe s VAL 51 N -3.59 2.18 0.55 -3.49 0.11 0.35 -1.35 120.40 115.16 2dqe s VAL 51 Ca 0.02 -0.98 0.08 0.00 -2.93 0.00 0.00 61.98 58.16 2dqe s VAL 51 Cb 0.01 -1.84 0.09 0.00 -1.53 0.00 0.00 36.38 33.12 2dqe s VAL 51 CO -0.10 0.56 0.76 -1.54 -3.33 0.00 0.00 175.10 171.44 2dqe n SER 52 N 3.49 1.86 -0.23 3.54 3.41 -0.28 -0.97 113.62 124.45 2dqe n SER 52 Ca -0.19 -2.37 0.12 0.00 -0.26 0.00 0.00 58.87 56.16 2dqe n SER 52 Cb 0.53 -0.41 0.40 0.00 -0.26 0.00 0.00 64.21 64.47 2dqe n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dqe h ALA 53 N 0.06 1.87 0.00 7.33 0.00 -1.89 -0.99 119.26 125.65 2dqe h ALA 53 Ca -0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2dqe h ALA 53 Cb 1.14 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2dqe h ALA 53 CO 0.35 -0.08 0.00 -1.13 0.00 0.00 0.00 179.25 178.40 2dqe n SER 54 N -4.52 0.00 0.00 0.00 3.41 -1.26 -4.86 113.62 106.39 2dqe n SER 54 Ca 0.15 0.10 0.00 0.00 -0.26 0.00 0.00 58.87 58.86 2dqe n SER 54 Cb 0.43 -0.36 0.00 0.00 -0.26 0.00 0.00 64.21 64.02 2dqe n SER 54 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dqe n GLY 55 N 1.12 0.51 3.77 5.00 0.00 -0.37 -5.05 105.19 110.17 2dqe n GLY 55 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 2dqe n GLY 55 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dqe s SER 56 N -2.60 6.25 0.17 1.61 1.04 -1.26 -4.73 113.70 114.19 2dqe s SER 56 Ca 0.00 2.47 0.11 0.00 0.48 0.00 0.00 55.95 59.01 2dqe s SER 56 Cb 0.00 -2.62 -0.04 0.00 0.10 0.00 0.00 66.02 63.46 2dqe s SER 56 CO 0.00 -0.87 -0.22 0.42 0.98 0.00 0.00 173.24 173.55 2dqe s THR 57 N -1.39 2.49 -0.10 2.02 -4.23 -1.26 -1.12 115.64 112.06 2dqe s THR 57 Ca 0.60 -1.89 -0.01 0.00 -1.18 0.00 0.00 61.69 59.21 2dqe s THR 57 Cb -0.33 -2.18 0.03 0.00 1.34 0.00 0.00 72.50 71.35 2dqe s THR 57 CO 0.42 -0.06 -0.05 -0.31 -0.54 0.00 0.00 174.62 174.07 2dqe s TYR 58 N -1.53 1.22 -0.02 3.99 2.02 -0.46 -5.00 117.35 117.57 2dqe s TYR 58 Ca 0.20 -0.55 0.07 0.00 -0.37 0.00 0.00 57.07 56.42 2dqe s TYR 58 Cb -0.09 -1.08 -0.02 0.00 -0.40 0.00 0.00 41.96 40.37 2dqe s TYR 58 CO 0.10 -0.44 -0.22 0.71 -1.57 0.00 0.00 175.55 174.12 2dqe s TYR 59 N 1.74 2.44 0.05 2.71 2.02 -1.26 -1.39 117.35 123.66 2dqe s TYR 59 Ca 0.04 -0.35 -0.31 0.00 -0.37 0.00 0.00 57.07 56.09 2dqe s TYR 59 Cb -0.13 -1.52 -0.07 0.00 -0.40 0.00 0.00 41.96 39.84 2dqe s TYR 59 CO -0.07 0.05 1.50 1.21 -1.57 0.00 0.00 175.55 176.68 2dqe s ASN 60 N -0.74 6.74 0.64 2.29 3.84 -0.28 -4.87 114.94 122.56 2dqe s ASN 60 Ca 0.11 2.30 0.32 0.00 0.21 0.00 0.00 52.86 55.80 2dqe s ASN 60 Cb -0.10 -2.57 1.77 0.00 -0.55 0.00 0.00 41.25 39.80 2dqe s ASN 60 CO 0.00 -0.78 2.05 -0.65 -2.79 0.00 0.00 177.10 174.93 2dqe h PRO 61 N 7.86 0.00 0.00 0.43 0.11 -1.94 -0.93 132.00 137.52 2dqe h PRO 61 Ca -0.40 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 2dqe h PRO 61 Cb 1.19 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.30 2dqe h PRO 61 CO 0.91 0.00 -0.04 0.66 -0.21 0.00 0.00 178.00 179.32 2dqe h SER 62 N 0.00 0.00 0.09 -2.05 4.64 -1.97 -0.82 113.55 113.44 2dqe h SER 62 Ca 0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 2dqe h SER 62 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 2dqe h SER 62 CO -0.00 0.04 -0.01 0.18 -0.87 0.00 0.00 176.83 176.17 2dqe n LEU 63 N -3.67 0.16 -4.20 5.97 4.77 -0.35 -4.92 117.00 114.76 2dqe n LEU 63 Ca -0.03 -0.01 -0.34 0.00 -0.03 0.00 0.00 56.01 55.60 2dqe n LEU 63 Cb 0.13 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.14 2dqe n LEU 63 CO 0.27 0.03 -0.12 0.29 -1.33 0.00 0.00 177.39 176.53 2dqe n LYS 64 N -0.92 -2.81 -2.71 3.23 4.76 -0.31 -1.69 118.16 117.70 2dqe n LYS 64 Ca 0.22 0.34 -0.21 0.00 -2.87 0.00 0.00 58.31 55.78 2dqe n LYS 64 Cb 0.16 -4.81 0.01 0.00 -1.84 0.00 0.00 35.03 28.54 2dqe n LYS 64 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 2dqe n SER 65 N -2.73 -5.94 -0.39 4.39 7.64 -1.26 -4.88 113.62 110.45 2dqe n SER 65 Ca -0.04 -0.15 0.11 0.00 1.01 0.00 0.00 58.87 59.80 2dqe n SER 65 Cb 0.55 -4.88 0.02 0.00 -1.01 0.00 0.00 64.21 58.90 2dqe n SER 65 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 2dqe n ARG 66 N -3.51 0.97 -3.94 1.43 1.74 -0.68 -4.97 116.66 107.70 2dqe n ARG 66 Ca -0.18 -0.78 -0.32 0.00 -0.77 0.00 0.00 57.85 55.80 2dqe n ARG 66 Cb 0.65 -1.48 -0.05 0.00 -1.02 0.00 0.00 32.46 30.56 2dqe n ARG 66 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 2dqe s ILE 67 N -2.57 5.28 -0.05 0.55 2.07 -1.26 -0.60 121.20 124.62 2dqe s ILE 67 Ca 0.17 -0.35 -0.02 0.00 -1.41 0.00 0.00 60.65 59.04 2dqe s ILE 67 Cb 0.18 -3.52 0.03 0.00 0.13 0.00 0.00 42.46 39.28 2dqe s ILE 67 CO 0.61 0.22 0.12 -0.55 -1.91 0.00 0.00 174.94 173.43 2dqe s SER 68 N -2.25 -0.08 -0.15 4.50 0.15 -0.39 -5.00 113.70 110.48 2dqe s SER 68 Ca 0.31 0.24 0.01 0.00 0.70 0.00 0.00 55.95 57.22 2dqe s SER 68 Cb -0.13 0.15 0.02 0.00 -1.71 0.00 0.00 66.02 64.34 2dqe s SER 68 CO 0.23 -0.13 -0.19 -0.63 1.20 0.00 0.00 173.24 173.72 2dqe s ILE 69 N 1.00 1.91 0.27 6.45 1.01 -1.26 -1.14 121.20 129.44 2dqe s ILE 69 Ca -0.08 -0.86 0.04 0.00 0.00 0.00 0.00 60.65 59.75 2dqe s ILE 69 Cb -0.10 -1.72 -0.06 0.00 0.01 0.00 0.00 42.46 40.59 2dqe s ILE 69 CO -0.05 0.52 0.02 0.42 0.00 0.00 0.00 174.94 175.85 2dqe s THR 70 N 1.14 1.13 0.10 2.92 -4.23 -1.10 -4.94 115.64 110.66 2dqe s THR 70 Ca -0.00 -2.03 0.04 0.00 -1.18 0.00 0.00 61.69 58.52 2dqe s THR 70 Cb -0.14 -2.54 -0.04 0.00 1.34 0.00 0.00 72.50 71.13 2dqe s THR 70 CO -0.08 -0.18 -0.12 -0.13 -0.54 0.00 0.00 174.62 173.57 2dqe s ARG 71 N -3.87 0.89 -0.30 3.99 0.52 -1.26 0.31 118.95 119.23 2dqe s ARG 71 Ca 0.32 -1.16 -0.02 0.00 -0.52 0.00 0.00 55.73 54.35 2dqe s ARG 71 Cb 0.07 -0.66 0.10 0.00 0.52 0.00 0.00 34.95 34.97 2dqe s ARG 71 CO 0.12 0.12 0.11 0.34 0.02 0.00 0.00 175.30 176.00 2dqe s ASP 72 N -2.39 3.87 0.21 0.23 -1.08 0.06 -4.99 116.67 112.58 2dqe s ASP 72 Ca 0.06 -1.52 -0.10 0.00 -0.52 0.00 0.00 52.55 50.46 2dqe s ASP 72 Cb -0.04 -0.70 0.17 0.00 -1.46 0.00 0.00 42.92 40.89 2dqe s ASP 72 CO 0.01 -0.42 1.85 0.74 0.52 0.00 0.00 175.17 177.87 2dqe h THR 73 N 6.47 1.12 -0.81 1.71 2.02 -1.97 -0.16 112.91 121.29 2dqe h THR 73 Ca -0.16 -0.30 0.06 0.00 0.77 0.00 0.00 66.41 66.78 2dqe h THR 73 Cb 1.01 0.16 -0.05 0.00 -1.74 0.00 0.00 68.15 67.53 2dqe h THR 73 CO 0.46 0.16 0.53 0.77 0.37 0.00 0.00 175.52 177.81 2dqe h SER 74 N 0.88 0.79 0.05 4.18 4.64 -1.95 -1.17 113.55 120.97 2dqe h SER 74 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 2dqe h SER 74 Cb -0.02 -0.17 0.00 0.00 -0.31 0.00 0.00 62.40 61.90 2dqe h SER 74 CO -0.09 0.51 -0.22 0.29 -0.87 0.00 0.00 176.83 176.45 2dqe n LYS 75 N -4.48 1.44 -3.85 4.77 5.02 -1.04 -4.96 118.16 115.05 2dqe n LYS 75 Ca 0.12 -1.05 -0.27 0.00 -2.02 0.00 0.00 58.31 55.09 2dqe n LYS 75 Cb 0.20 -1.48 0.00 0.00 -0.02 0.00 0.00 35.03 33.74 2dqe n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2dqe n ASN 76 N 0.14 -1.76 -4.06 4.39 2.85 -0.11 -4.83 115.26 111.88 2dqe n ASN 76 Ca 0.13 -0.99 -0.08 0.00 -0.11 0.00 0.00 54.58 53.53 2dqe n ASN 76 Cb 0.44 -3.24 -0.10 0.00 1.24 0.00 0.00 39.78 38.12 2dqe n ASN 76 CO 0.00 0.00 0.00 -1.10 -2.11 0.00 0.00 177.26 174.05 2dqe s GLN 77 N -6.35 0.53 0.17 1.20 -0.21 -0.96 -2.06 119.66 111.99 2dqe s GLN 77 Ca 0.13 -1.04 0.04 0.00 0.02 0.00 0.00 55.36 54.50 2dqe s GLN 77 Cb -0.05 0.16 -0.05 0.00 1.00 0.00 0.00 33.01 34.08 2dqe s GLN 77 CO 0.87 -0.09 -0.06 1.52 -2.12 0.00 0.00 175.29 175.42 2dqe s TYR 78 N -3.17 1.32 0.23 0.91 1.13 -0.81 -0.76 117.35 116.20 2dqe s TYR 78 Ca 0.00 -0.86 0.03 0.00 -1.41 0.00 0.00 57.07 54.83 2dqe s TYR 78 Cb 0.03 -0.72 -0.05 0.00 -1.10 0.00 0.00 41.96 40.12 2dqe s TYR 78 CO -0.07 -0.01 0.02 0.71 -2.51 0.00 0.00 175.55 173.69 2dqe s TYR 79 N -3.42 1.50 -0.08 -3.49 2.02 0.15 -1.14 117.35 112.89 2dqe s TYR 79 Ca 0.21 -1.00 0.00 0.00 -0.37 0.00 0.00 57.07 55.92 2dqe s TYR 79 Cb 0.04 -0.88 0.02 0.00 -0.40 0.00 0.00 41.96 40.75 2dqe s TYR 79 CO 0.03 -0.13 -0.07 -1.17 -1.57 0.00 0.00 175.55 172.64 2dqe s LEU 80 N -3.29 1.24 -0.09 -1.29 2.96 -0.59 -2.73 118.68 114.90 2dqe s LEU 80 Ca 0.30 -0.22 0.04 0.00 -0.22 0.00 0.00 54.13 54.02 2dqe s LEU 80 Cb 0.06 -0.68 0.00 0.00 0.50 0.00 0.00 46.19 46.08 2dqe s LEU 80 CO 0.09 -0.08 -0.21 -1.81 -1.32 0.00 0.00 176.35 173.02 2dqe s ASP 81 N 1.29 2.76 -0.21 3.68 1.01 -0.29 -0.78 116.67 124.13 2dqe s ASP 81 Ca -0.04 -0.49 -0.01 0.00 0.71 0.00 0.00 52.55 52.72 2dqe s ASP 81 Cb -0.14 -1.18 0.06 0.00 1.01 0.00 0.00 42.92 42.67 2dqe s ASP 81 CO -0.03 0.14 -0.00 -0.22 0.21 0.00 0.00 175.17 175.27 2dqe s LEU 82 N 0.34 1.72 0.63 1.23 2.96 0.50 -1.26 118.68 124.80 2dqe s LEU 82 Ca -0.16 -0.93 -0.11 0.00 -0.22 0.00 0.00 54.13 52.71 2dqe s LEU 82 Cb -0.17 -0.83 -0.03 0.00 0.50 0.00 0.00 46.19 45.66 2dqe s LEU 82 CO 0.07 -0.27 1.04 0.20 -1.32 0.00 0.00 176.35 176.07 2dqe s ASN 83 N 1.67 6.09 -1.15 3.68 0.01 0.23 -0.86 114.94 124.60 2dqe s ASN 83 Ca -0.03 1.45 -0.33 0.00 -0.71 0.00 0.00 52.86 53.24 2dqe s ASN 83 Cb -0.18 -2.47 0.05 0.00 0.41 0.00 0.00 41.25 39.06 2dqe s ASN 83 CO -0.07 -0.97 0.64 -1.20 -1.51 0.00 0.00 177.10 174.00 2dqe n SER 84 N -2.81 -3.91 -4.77 -1.22 7.64 -1.07 -4.90 113.62 102.58 2dqe n SER 84 Ca 0.06 -1.25 -0.32 0.00 1.01 0.00 0.00 58.87 58.37 2dqe n SER 84 Cb 0.54 -1.50 0.06 0.00 -1.01 0.00 0.00 64.21 62.30 2dqe n SER 84 CO 0.00 0.00 0.00 0.68 -3.01 0.00 0.00 175.04 172.71 2dqe s VAL 85 N -3.58 3.26 0.32 0.44 -7.23 -0.82 -4.58 120.40 108.21 2dqe s VAL 85 Ca 0.46 0.52 0.03 0.00 -1.81 0.00 0.00 61.98 61.18 2dqe s VAL 85 Cb -0.26 -3.03 -0.04 0.00 0.56 0.00 0.00 36.38 33.61 2dqe s VAL 85 CO 0.93 -0.43 0.15 0.42 -0.31 0.00 0.00 175.10 175.86 2dqe s THR 86 N -2.54 0.43 0.27 5.32 -4.23 -1.26 0.46 115.64 114.09 2dqe s THR 86 Ca 0.65 -2.00 0.32 0.00 -1.18 0.00 0.00 61.69 59.48 2dqe s THR 86 Cb -0.19 -2.52 0.32 0.00 1.34 0.00 0.00 72.50 71.45 2dqe s THR 86 CO 0.47 0.00 1.96 0.71 -0.54 0.00 0.00 174.62 177.22 2dqe h THR 87 N 2.16 0.00 0.00 3.99 1.35 -1.98 0.15 112.91 118.58 2dqe h THR 87 Ca -0.34 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 2dqe h THR 87 Cb 1.25 0.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.38 2dqe h THR 87 CO 0.54 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 175.19 2dqe n GLU 88 N -2.65 0.14 -0.10 4.72 -0.58 -1.26 -2.54 120.64 118.37 2dqe n GLU 88 Ca -0.02 0.31 0.12 0.00 -0.42 0.00 0.00 57.16 57.15 2dqe n GLU 88 Cb 0.10 -1.74 0.29 0.00 -0.57 0.00 0.00 31.44 29.53 2dqe n GLU 88 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2dqe n ASP 89 N -2.00 2.50 -4.69 1.62 8.00 0.52 -4.88 116.55 117.62 2dqe n ASP 89 Ca 0.03 -1.84 -0.42 0.00 0.71 0.00 0.00 54.79 53.28 2dqe n ASP 89 Cb 0.26 -0.13 -0.03 0.00 -0.02 0.00 0.00 41.12 41.20 2dqe n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2dqe s THR 90 N -1.74 3.40 0.02 -3.53 2.01 -1.05 -4.84 115.64 109.90 2dqe s THR 90 Ca 0.35 0.83 -0.28 0.00 0.31 0.00 0.00 61.69 62.90 2dqe s THR 90 Cb 0.20 -3.53 0.10 0.00 0.01 0.00 0.00 72.50 69.28 2dqe s THR 90 CO 0.30 0.00 1.24 0.00 -0.69 0.00 0.00 174.62 175.47 2dqe s ALA 91 N 2.39 -2.25 -0.28 7.40 0.00 -0.83 -4.49 121.76 123.70 2dqe s ALA 91 Ca 0.68 0.21 -0.11 0.00 0.00 0.00 0.00 51.96 52.73 2dqe s ALA 91 Cb -0.35 0.69 -0.05 0.00 0.00 0.00 0.00 23.12 23.41 2dqe s ALA 91 CO 0.29 -1.10 0.21 0.99 0.00 0.00 0.00 175.76 176.15 2dqe s THR 92 N -2.21 5.30 -0.15 0.00 2.01 -0.31 -1.01 115.64 119.26 2dqe s THR 92 Ca 0.23 0.22 -0.09 0.00 0.31 0.00 0.00 61.69 62.36 2dqe s THR 92 Cb 0.01 -3.55 -0.05 0.00 0.01 0.00 0.00 72.50 68.93 2dqe s THR 92 CO -0.01 0.25 0.15 -0.31 -0.69 0.00 0.00 174.62 174.01 2dqe s TYR 93 N 1.74 3.51 0.05 4.92 1.51 0.33 -0.49 117.35 128.92 2dqe s TYR 93 Ca 0.08 0.46 0.06 0.00 -1.01 0.00 0.00 57.07 56.65 2dqe s TYR 93 Cb -0.16 -2.07 -0.02 0.00 -0.11 0.00 0.00 41.96 39.60 2dqe s TYR 93 CO 0.10 0.51 -0.17 0.71 -1.11 0.00 0.00 175.55 175.60 2dqe s TYR 94 N -0.33 1.44 0.08 2.71 1.51 0.97 -0.81 117.35 122.93 2dqe s TYR 94 Ca 0.12 -0.38 0.06 0.00 -1.01 0.00 0.00 57.07 55.86 2dqe s TYR 94 Cb -0.12 -0.84 -0.04 0.00 -0.11 0.00 0.00 41.96 40.85 2dqe s TYR 94 CO 0.02 0.07 -0.08 0.00 -1.11 0.00 0.00 175.55 174.45 2dqe s ALA 96 N -1.20 -1.71 0.68 0.00 0.00 -1.01 -0.15 121.76 118.38 2dqe s ALA 96 Ca 0.22 0.91 -0.11 0.00 0.00 0.00 0.00 51.96 52.98 2dqe s ALA 96 Cb -0.11 0.42 -0.00 0.00 0.00 0.00 0.00 23.12 23.43 2dqe s ALA 96 CO 0.14 -0.59 1.06 0.54 0.00 0.00 0.00 175.76 176.90 2dqe s ASN 97 N -2.07 5.61 0.33 0.00 6.03 -0.48 -1.22 114.94 123.13 2dqe s ASN 97 Ca -0.03 1.48 0.07 0.00 -1.03 0.00 0.00 52.86 53.35 2dqe s ASN 97 Cb -0.01 -2.40 0.77 0.00 -3.03 0.00 0.00 41.25 36.58 2dqe s ASN 97 CO -0.04 -1.28 1.82 -0.25 -2.03 0.00 0.00 177.10 175.32 2dqe h TRP 98 N -0.61 0.96 0.00 1.54 7.01 -1.50 -0.20 115.95 123.15 2dqe h TRP 98 Ca -0.44 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 60.55 2dqe h TRP 98 Cb 1.21 -0.30 -0.00 0.00 -2.10 0.00 0.00 29.16 27.97 2dqe h TRP 98 CO 0.61 0.28 -0.15 -0.44 -2.79 0.00 0.00 178.44 175.95 2dqe h ASP 99 N 0.75 0.00 0.00 2.65 3.32 -1.92 -3.46 116.42 117.76 2dqe h ASP 99 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 2dqe h ASP 99 Cb 0.82 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.37 2dqe h ASP 99 CO -0.29 0.15 0.00 0.61 -1.72 0.00 0.00 179.24 177.99 2dqe n GLY 100 N -0.52 0.63 0.07 2.75 0.00 -0.09 -4.93 105.19 103.11 2dqe n GLY 100 Ca -0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.95 2dqe n GLY 100 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2dqe h ASP 101 N 0.00 0.00 -3.17 1.61 3.32 -1.90 -3.44 116.42 112.83 2dqe h ASP 101 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 2dqe h ASP 101 Cb 0.00 0.00 -0.35 0.00 0.22 0.00 0.00 39.33 39.20 2dqe h ASP 101 CO 0.00 0.92 -0.85 -0.31 -1.72 0.00 0.00 179.24 177.28 2dqe s TYR 102 N -2.74 2.44 0.14 4.55 2.02 -1.26 -5.04 117.35 117.46 2dqe s TYR 102 Ca 0.01 -1.29 0.09 0.00 -0.37 0.00 0.00 57.07 55.51 2dqe s TYR 102 Cb 0.09 -1.71 -0.04 0.00 -0.40 0.00 0.00 41.96 39.91 2dqe s TYR 102 CO 0.81 -0.63 -0.20 -1.58 -1.57 0.00 0.00 175.55 172.38 2dqe s TRP 103 N 1.07 1.86 0.64 2.71 0.52 -1.26 -1.38 118.94 123.10 2dqe s TRP 103 Ca -0.02 -0.44 -0.10 0.00 0.02 0.00 0.00 56.10 55.56 2dqe s TRP 103 Cb -0.14 -0.96 0.15 0.00 -1.15 0.00 0.00 33.47 31.36 2dqe s TRP 103 CO -0.06 0.30 0.88 0.41 0.02 0.00 0.00 176.95 178.50 2dqe n GLY 104 N 0.60 -1.06 0.07 0.98 0.00 0.79 -4.50 105.19 102.07 2dqe n GLY 104 Ca -0.16 -1.75 0.13 0.00 0.00 0.00 0.00 46.02 44.24 2dqe n GLY 104 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dqe n GLN 105 N -2.83 0.24 0.00 1.61 10.64 -1.26 -4.84 117.38 120.95 2dqe n GLN 105 Ca 0.11 0.13 0.00 0.00 -1.83 0.00 0.00 57.00 55.41 2dqe n GLN 105 Cb 0.40 -1.71 0.00 0.00 -0.86 0.00 0.00 30.24 28.06 2dqe n GLN 105 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2dqe n GLY 106 N 1.35 -0.76 3.04 2.61 0.00 -1.26 -5.05 105.19 105.11 2dqe n GLY 106 Ca 0.05 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.50 2dqe n GLY 106 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2dqe s THR 107 N -2.74 -0.12 -0.02 2.61 -1.32 0.01 -4.93 115.64 109.14 2dqe s THR 107 Ca 0.00 0.18 -0.30 0.00 -1.21 0.00 0.00 61.69 60.36 2dqe s THR 107 Cb 0.00 -0.39 -0.03 0.00 -1.51 0.00 0.00 72.50 70.57 2dqe s THR 107 CO 0.00 0.07 1.05 -0.22 -2.21 0.00 0.00 174.62 173.31 2dqe s LEU 108 N 1.52 4.34 -0.15 9.08 2.96 -1.26 -0.51 118.68 134.65 2dqe s LEU 108 Ca -0.07 1.71 0.00 0.00 -0.22 0.00 0.00 54.13 55.56 2dqe s LEU 108 Cb -0.11 -3.57 0.02 0.00 0.50 0.00 0.00 46.19 43.04 2dqe s LEU 108 CO -0.08 -0.37 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.73 2dqe s VAL 109 N 1.34 1.66 -0.17 1.68 1.01 -0.18 -4.56 120.40 121.19 2dqe s VAL 109 Ca 0.53 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.76 2dqe s VAL 109 Cb -0.22 -1.55 -0.04 0.00 0.00 0.00 0.00 36.38 34.58 2dqe s VAL 109 CO 0.26 0.47 0.02 -0.89 0.00 0.00 0.00 175.10 174.96 2dqe s THR 110 N 1.44 4.42 -0.32 3.92 2.01 0.20 -1.97 115.64 125.34 2dqe s THR 110 Ca 0.05 -0.17 -0.11 0.00 0.31 0.00 0.00 61.69 61.76 2dqe s THR 110 Cb -0.13 -2.97 -0.02 0.00 0.01 0.00 0.00 72.50 69.40 2dqe s THR 110 CO -0.11 0.48 0.20 -0.69 -0.69 0.00 0.00 174.62 173.81 2dqe s VAL 111 N 0.31 5.04 -0.05 3.82 1.01 -1.26 -1.53 120.40 127.74 2dqe s VAL 111 Ca 0.00 -0.24 -0.13 0.00 0.00 0.00 0.00 61.98 61.61 2dqe s VAL 111 Cb -0.13 -3.55 0.03 0.00 0.00 0.00 0.00 36.38 32.72 2dqe s VAL 111 CO 0.01 0.05 0.31 -0.55 0.00 0.00 0.00 175.10 174.93 2dqe s SER 112 N 1.69 -0.23 0.19 3.32 0.15 -0.56 -4.53 113.70 113.73 2dqe s SER 112 Ca 0.06 0.26 0.13 0.00 0.70 0.00 0.00 55.95 57.10 2dqe s SER 112 Cb -0.17 0.43 0.72 0.00 -1.71 0.00 0.00 66.02 65.28 2dqe s SER 112 CO 0.09 -0.34 1.41 0.00 1.20 0.00 0.00 173.24 175.60 2dqe n ALA 113 N 1.81 1.04 0.33 5.45 0.00 -1.26 -4.29 120.51 123.58 2dqe n ALA 113 Ca -0.19 0.12 0.04 0.00 0.00 0.00 0.00 53.44 53.41 2dqe n ALA 113 Cb 0.56 -1.19 0.03 0.00 0.00 0.00 0.00 19.45 18.85 2dqe n ALA 113 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50