#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhx n SER 2 N 0.00 1.57 -4.55 1.61 7.64 -1.26 -5.02 113.62 113.62 2dhx n SER 2 Ca 0.00 0.24 -0.41 0.00 1.01 0.00 0.00 58.87 59.71 2dhx n SER 2 Cb 0.00 -0.56 0.01 0.00 -1.01 0.00 0.00 64.21 62.65 2dhx n SER 2 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2dhx n SER 3 N -4.03 0.36 0.00 6.43 2.88 -1.26 -4.73 113.62 113.27 2dhx n SER 3 Ca -0.08 0.97 0.00 0.00 -1.33 0.00 0.00 58.87 58.43 2dhx n SER 3 Cb 0.30 -1.26 0.00 0.00 -0.75 0.00 0.00 64.21 62.50 2dhx n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dhx n GLY 4 N 1.44 -2.15 3.31 0.46 0.00 -1.26 -5.16 105.19 101.82 2dhx n GLY 4 Ca 0.11 0.71 -0.15 0.00 0.00 0.00 0.00 46.02 46.68 2dhx n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhx s SER 5 N -0.80 0.88 -0.03 1.61 0.01 -1.26 -5.11 113.70 109.01 2dhx s SER 5 Ca 0.00 -1.52 -0.02 0.00 1.31 0.00 0.00 55.95 55.72 2dhx s SER 5 Cb 0.00 0.51 -0.01 0.00 0.21 0.00 0.00 66.02 66.74 2dhx s SER 5 CO 0.00 -1.03 -0.03 -1.28 0.41 0.00 0.00 173.24 171.31 2dhx h SER 6 N 2.31 0.00 -4.27 2.44 0.87 -2.01 -3.52 113.55 109.38 2dhx h SER 6 Ca -0.29 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.27 2dhx h SER 6 Cb 1.24 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.20 2dhx h SER 6 CO 0.43 0.14 0.00 0.61 -0.53 0.00 0.00 176.83 177.48 2dhx n GLY 7 N 1.75 4.19 0.00 5.77 0.00 -1.26 -5.15 105.19 110.49 2dhx n GLY 7 Ca -0.01 -1.43 0.00 0.00 0.00 0.00 0.00 46.02 44.58 2dhx n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dhx n GLY 8 N -1.59 -1.63 3.17 -0.02 0.00 -1.26 -5.12 105.19 98.76 2dhx n GLY 8 Ca 0.00 0.65 -0.31 0.00 0.00 0.00 0.00 46.02 46.36 2dhx n GLY 8 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dhx s VAL 9 N 0.00 1.95 0.02 1.61 1.01 -1.26 -5.06 120.40 118.66 2dhx s VAL 9 Ca 0.00 -0.93 0.02 0.00 0.00 0.00 0.00 61.98 61.06 2dhx s VAL 9 Cb 0.00 -1.71 -0.01 0.00 0.00 0.00 0.00 36.38 34.66 2dhx s VAL 9 CO 0.00 0.53 -0.06 0.00 0.00 0.00 0.00 175.10 175.57 2dhx s ALA 10 N 0.60 0.44 -0.06 5.51 0.00 -1.26 -1.80 121.76 125.19 2dhx s ALA 10 Ca -0.13 -0.44 0.02 0.00 0.00 0.00 0.00 51.96 51.41 2dhx s ALA 10 Cb -0.17 -0.03 0.02 0.00 0.00 0.00 0.00 23.12 22.94 2dhx s ALA 10 CO 0.04 0.04 -0.10 0.08 0.00 0.00 0.00 175.76 175.82 2dhx s VAL 11 N -0.67 0.95 -0.51 0.00 1.01 0.52 -3.84 120.40 117.86 2dhx s VAL 11 Ca -0.04 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 61.34 2dhx s VAL 11 Cb -0.05 -0.90 0.04 0.00 0.00 0.00 0.00 36.38 35.46 2dhx s VAL 11 CO 0.00 0.32 0.91 -0.70 0.00 0.00 0.00 175.10 175.63 2dhx s GLU 12 N 0.83 3.39 0.26 2.72 2.12 0.23 0.12 118.70 128.38 2dhx s GLU 12 Ca -0.12 -0.14 -0.12 0.00 0.36 0.00 0.00 54.97 54.94 2dhx s GLU 12 Cb -0.15 -4.00 -0.08 0.00 0.26 0.00 0.00 34.13 30.16 2dhx s GLU 12 CO 0.02 -1.36 0.63 0.08 -0.54 0.00 0.00 175.26 174.09 2dhx s VAL 13 N 3.77 4.81 0.28 3.70 1.01 0.12 -1.32 120.40 132.77 2dhx s VAL 13 Ca 0.32 0.72 0.02 0.00 0.00 0.00 0.00 61.98 63.04 2dhx s VAL 13 Cb -0.12 -3.63 -0.06 0.00 0.00 0.00 0.00 36.38 32.58 2dhx s VAL 13 CO 0.21 -0.09 0.08 -0.13 0.00 0.00 0.00 175.10 175.18 2dhx s ARG 14 N -2.81 1.48 -0.80 2.72 1.81 0.18 -0.90 118.95 120.63 2dhx s ARG 14 Ca 0.50 -1.81 -0.01 0.00 -1.72 0.00 0.00 55.73 52.69 2dhx s ARG 14 Cb -0.11 -0.45 -0.00 0.00 -0.45 0.00 0.00 34.95 33.94 2dhx s ARG 14 CO 0.19 -0.26 0.66 0.41 -0.68 0.00 0.00 175.30 175.62 2dhx n GLY 15 N -0.53 -1.27 2.98 -3.53 0.00 -1.13 -1.09 105.19 100.62 2dhx n GLY 15 Ca -0.01 0.54 -0.30 0.00 0.00 0.00 0.00 46.02 46.25 2dhx n GLY 15 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dhx s LEU 16 N -4.57 2.25 0.58 0.99 2.96 -1.26 -4.01 118.68 115.63 2dhx s LEU 16 Ca 0.02 -0.89 -0.16 0.00 -0.22 0.00 0.00 54.13 52.88 2dhx s LEU 16 Cb -0.01 -1.21 -0.04 0.00 0.50 0.00 0.00 46.19 45.44 2dhx s LEU 16 CO 0.83 -0.15 1.05 -2.16 -1.32 0.00 0.00 176.35 174.59 2dhx s PRO 17 N 1.41 3.40 0.12 0.98 0.04 -1.26 -4.18 135.00 135.51 2dhx s PRO 17 Ca -0.01 1.17 -0.07 0.00 0.04 0.00 0.00 61.00 62.12 2dhx s PRO 17 Cb -0.16 -2.05 -0.11 0.00 0.04 0.00 0.00 34.50 32.22 2dhx s PRO 17 CO -0.08 -0.74 1.30 -1.00 0.04 0.00 0.00 177.00 176.52 2dhx h PRO 18 N 0.50 0.54 -0.85 0.56 0.13 -2.01 -3.21 132.00 127.66 2dhx h PRO 18 Ca -0.47 -0.53 0.21 0.00 -0.87 0.00 0.00 66.00 64.34 2dhx h PRO 18 Cb 1.22 0.14 -0.13 0.00 0.13 0.00 0.00 31.00 32.35 2dhx h PRO 18 CO 0.58 1.16 0.24 0.00 -0.23 0.00 0.00 178.00 179.75 2dhx h ALA 19 N 0.66 1.21 -2.13 -0.56 0.00 -2.00 -3.36 119.26 113.08 2dhx h ALA 19 Ca -0.08 0.20 -0.57 0.00 0.00 0.00 0.00 54.91 54.46 2dhx h ALA 19 Cb 1.53 0.27 -0.05 0.00 0.00 0.00 0.00 17.79 19.54 2dhx h ALA 19 CO 0.17 -0.41 0.81 0.08 0.00 0.00 0.00 179.25 179.89 2dhx s VAL 20 N -5.96 4.52 0.61 0.00 1.01 -1.21 -5.01 120.40 114.36 2dhx s VAL 20 Ca -0.12 1.84 -0.14 0.00 0.00 0.00 0.00 61.98 63.55 2dhx s VAL 20 Cb 0.25 -4.18 -0.03 0.00 0.00 0.00 0.00 36.38 32.41 2dhx s VAL 20 CO 0.77 -0.14 1.05 -2.16 0.00 0.00 0.00 175.10 174.62 2dhx s PRO 21 N 3.14 3.28 0.43 2.72 0.04 -1.26 -4.84 135.00 138.51 2dhx s PRO 21 Ca 0.49 1.11 0.09 0.00 0.04 0.00 0.00 61.00 62.74 2dhx s PRO 21 Cb -0.18 -2.03 0.95 0.00 0.04 0.00 0.00 34.50 33.27 2dhx s PRO 21 CO 0.11 -0.84 2.06 -0.44 0.04 0.00 0.00 177.00 177.93 2dhx h ASP 22 N 0.17 0.39 -0.58 6.66 5.19 -1.95 -2.37 116.42 123.92 2dhx h ASP 22 Ca -0.46 -0.01 0.10 0.00 -0.62 0.00 0.00 57.03 56.04 2dhx h ASP 22 Cb 1.21 -0.09 -0.11 0.00 0.18 0.00 0.00 39.33 40.52 2dhx h ASP 22 CO 0.58 0.27 -0.35 -0.33 -3.12 0.00 0.00 179.24 176.29 2dhx h GLU 23 N 0.45 -0.17 0.17 3.56 5.08 -1.99 0.15 114.58 121.83 2dhx h GLU 23 Ca 0.15 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.51 2dhx h GLU 23 Cb 0.04 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.33 2dhx h GLU 23 CO -0.03 -0.11 -0.08 -0.07 -1.00 0.00 0.00 179.01 177.71 2dhx h LEU 24 N -0.17 -0.19 -0.99 1.33 3.38 -1.82 0.50 115.31 117.35 2dhx h LEU 24 Ca 0.22 -0.16 0.33 0.00 0.09 0.00 0.00 57.88 58.36 2dhx h LEU 24 Cb 0.55 0.05 -0.18 0.00 0.09 0.00 0.00 40.66 41.17 2dhx h LEU 24 CO -0.68 0.05 0.21 -0.11 0.09 0.00 0.00 178.44 178.00 2dhx n LEU 25 N -5.09 0.05 0.07 1.67 7.94 -0.43 0.13 117.00 121.34 2dhx n LEU 25 Ca -0.09 1.67 -0.21 0.00 -1.11 0.00 0.00 56.01 56.28 2dhx n LEU 25 Cb 0.19 -0.68 -0.15 0.00 0.53 0.00 0.00 43.42 43.31 2dhx n LEU 25 CO 0.33 -1.76 -0.02 0.71 -1.11 0.00 0.00 177.39 175.55 2dhx h THR 26 N 0.00 1.46 -0.92 1.96 1.35 -0.45 -2.62 112.91 113.69 2dhx h THR 26 Ca 0.69 -2.56 0.18 0.00 -0.55 0.00 0.00 66.41 64.17 2dhx h THR 26 Cb 1.60 3.17 -0.08 0.00 -1.73 0.00 0.00 68.15 71.11 2dhx h THR 26 CO -0.87 0.73 0.59 0.17 -0.25 0.00 0.00 175.52 175.90 2dhx h LEU 27 N -0.28 0.56 0.12 3.87 8.10 0.53 1.46 115.31 129.66 2dhx h LEU 27 Ca -0.17 0.05 -0.01 0.00 0.11 0.00 0.00 57.88 57.87 2dhx h LEU 27 Cb 1.74 -0.05 0.00 0.00 -0.44 0.00 0.00 40.66 41.91 2dhx h LEU 27 CO 0.17 0.24 -0.06 0.22 -4.11 0.00 0.00 178.44 174.90 2dhx h TYR 28 N 0.57 -0.15 0.00 0.17 3.20 0.11 -0.95 116.97 119.92 2dhx h TYR 28 Ca 0.49 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.33 2dhx h TYR 28 Cb 0.98 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 39.30 2dhx h TYR 28 CO -0.00 0.34 -0.09 0.74 -1.64 0.00 0.00 178.16 177.51 2dhx h PHE 29 N -0.84 0.00 0.06 -3.82 0.04 -0.93 -2.50 116.94 108.94 2dhx h PHE 29 Ca -0.02 0.00 -0.16 0.00 2.80 0.00 0.00 57.97 60.60 2dhx h PHE 29 Cb 0.56 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.72 2dhx h PHE 29 CO 0.11 0.09 -0.65 0.93 -0.60 0.00 0.00 178.31 178.19 2dhx h GLU 30 N 0.00 0.34 -7.02 1.51 5.08 0.20 -3.33 114.58 111.35 2dhx h GLU 30 Ca -0.00 -0.44 -0.53 0.00 -1.00 0.00 0.00 59.36 57.39 2dhx h GLU 30 Cb 0.22 0.14 0.10 0.00 0.50 0.00 0.00 28.75 29.71 2dhx h GLU 30 CO 0.01 1.14 0.55 1.21 -1.00 0.00 0.00 179.01 180.92 2dhx s ASN 31 N -6.80 5.76 -0.08 1.42 3.84 -0.36 -4.39 114.94 114.33 2dhx s ASN 31 Ca -0.14 2.53 -0.00 0.00 0.21 0.00 0.00 52.86 55.46 2dhx s ASN 31 Cb 0.02 -2.62 -0.00 0.00 -0.55 0.00 0.00 41.25 38.10 2dhx s ASN 31 CO 0.82 -1.22 -0.01 -0.09 -2.79 0.00 0.00 177.10 173.81 2dhx h ARG 32 N 1.80 0.00 -0.82 0.43 2.43 -1.88 -3.20 114.38 113.15 2dhx h ARG 32 Ca -0.50 0.00 0.16 0.00 -0.81 0.00 0.00 59.98 58.83 2dhx h ARG 32 Cb 1.27 0.00 -0.15 0.00 -0.42 0.00 0.00 29.97 30.67 2dhx h ARG 32 CO 0.59 0.00 -0.22 0.00 -1.51 0.00 0.00 179.97 178.83 2dhx h ARG 33 N -0.78 -0.01 -0.04 0.20 3.08 -1.93 0.25 114.38 115.15 2dhx h ARG 33 Ca 0.00 0.00 0.01 0.00 0.07 0.00 0.00 59.98 60.06 2dhx h ARG 33 Cb 0.02 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 2dhx h ARG 33 CO 0.00 -0.01 -0.14 0.00 -1.07 0.00 0.00 179.97 178.75 2dhx h ARG 34 N -0.01 -0.14 0.00 0.04 2.47 -1.83 -3.42 114.38 111.49 2dhx h ARG 34 Ca 0.39 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 59.12 2dhx h ARG 34 Cb 0.60 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.95 2dhx h ARG 34 CO -0.84 -0.10 0.00 0.45 0.56 0.00 0.00 179.97 180.04 2dhx n SER 35 N -3.33 0.00 0.00 7.04 2.88 -0.56 -4.96 113.62 114.69 2dhx n SER 35 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2dhx n SER 35 Cb 0.10 -0.13 0.00 0.00 -0.75 0.00 0.00 64.21 63.43 2dhx n SER 35 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2dhx n GLY 36 N 2.96 0.76 0.00 0.46 0.00 0.77 -4.95 105.19 105.18 2dhx n GLY 36 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 2dhx n GLY 36 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dhx n GLY 37 N 0.00 -0.30 0.00 -0.02 0.00 -1.26 -3.68 105.19 99.94 2dhx n GLY 37 Ca 0.00 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2dhx n GLY 37 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dhx n GLY 38 N 0.36 -0.54 3.82 -0.02 0.00 -1.23 -4.38 105.19 103.20 2dhx n GLY 38 Ca 0.00 -0.80 -0.31 0.00 0.00 0.00 0.00 46.02 44.90 2dhx n GLY 38 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dhx s PRO 39 N -0.80 3.07 -0.20 1.61 0.04 -1.26 -3.84 135.00 133.62 2dhx s PRO 39 Ca 0.00 1.02 -0.06 0.00 0.04 0.00 0.00 61.00 62.00 2dhx s PRO 39 Cb 0.00 -2.01 -0.03 0.00 0.04 0.00 0.00 34.50 32.50 2dhx s PRO 39 CO 0.00 -0.99 0.03 0.08 0.04 0.00 0.00 177.00 176.15 2dhx s VAL 40 N -2.87 4.25 -0.03 -0.36 1.01 -1.26 -1.49 120.40 119.64 2dhx s VAL 40 Ca 0.60 -0.21 -0.26 0.00 0.00 0.00 0.00 61.98 62.11 2dhx s VAL 40 Cb -0.14 -2.93 -0.20 0.00 0.00 0.00 0.00 36.38 33.11 2dhx s VAL 40 CO 0.49 0.43 1.20 0.25 0.00 0.00 0.00 175.10 177.47 2dhx h LEU 41 N 7.32 -0.04 -8.49 3.92 5.85 0.50 -3.43 115.31 120.93 2dhx h LEU 41 Ca -0.36 -0.48 -0.25 0.00 0.84 0.00 0.00 57.88 57.63 2dhx h LEU 41 Cb 1.18 0.01 -0.08 0.00 0.37 0.00 0.00 40.66 42.14 2dhx h LEU 41 CO 0.63 0.48 -0.17 -0.55 -0.34 0.00 0.00 178.44 178.48 2dhx s SER 42 N -5.66 0.82 -0.15 1.25 0.15 -0.82 -4.99 113.70 104.29 2dhx s SER 42 Ca -0.16 -1.44 -0.13 0.00 0.70 0.00 0.00 55.95 54.92 2dhx s SER 42 Cb 0.01 0.66 0.04 0.00 -1.71 0.00 0.00 66.02 65.03 2dhx s SER 42 CO 0.65 -1.30 0.40 0.86 1.20 0.00 0.00 173.24 175.04 2dhx s TRP 43 N -3.09 -0.47 -0.28 3.44 -0.00 -1.26 -1.08 118.94 116.20 2dhx s TRP 43 Ca 0.30 1.10 -0.02 0.00 -0.00 0.00 0.00 56.10 57.48 2dhx s TRP 43 Cb -0.01 0.17 0.09 0.00 -0.00 0.00 0.00 33.47 33.73 2dhx s TRP 43 CO 0.19 -0.24 0.09 -1.14 -0.00 0.00 0.00 176.95 175.86 2dhx s GLN 44 N 0.45 0.57 -0.23 5.86 0.74 0.82 -4.98 119.66 122.89 2dhx s GLN 44 Ca -0.02 -0.80 -0.29 0.00 0.05 0.00 0.00 55.36 54.30 2dhx s GLN 44 Cb -0.04 -1.80 -0.01 0.00 1.10 0.00 0.00 33.01 32.26 2dhx s GLN 44 CO -0.02 -0.92 1.30 0.50 -0.55 0.00 0.00 175.29 175.59 2dhx s ARG 45 N 1.79 4.07 0.02 1.67 3.52 -1.26 -0.01 118.95 128.75 2dhx s ARG 45 Ca 0.07 1.48 0.00 0.00 -0.13 0.00 0.00 55.73 57.15 2dhx s ARG 45 Cb -0.17 -3.83 0.00 0.00 -1.56 0.00 0.00 34.95 29.39 2dhx s ARG 45 CO -0.25 -0.92 0.01 1.28 -0.81 0.00 0.00 175.30 174.61 2dhx n LEU 46 N 7.16 0.00 -4.60 -0.88 4.77 -0.96 -4.87 117.00 117.62 2dhx n LEU 46 Ca 0.15 -0.13 -0.43 0.00 -0.03 0.00 0.00 56.01 55.57 2dhx n LEU 46 Cb 0.46 0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.52 2dhx n LEU 46 CO 0.59 -0.13 1.79 -0.83 -1.33 0.00 0.00 177.39 177.48 2dhx s GLY 47 N -1.35 0.52 -0.73 -0.72 0.00 -1.26 -3.08 107.32 100.70 2dhx s GLY 47 Ca 0.01 0.63 -0.05 0.00 0.00 0.00 0.00 44.72 45.31 2dhx s GLY 47 CO 0.00 3.71 0.65 0.00 0.00 0.00 0.00 173.10 177.46 2dhx n GLY 49 N -1.47 0.54 0.00 0.00 0.00 -1.18 -2.86 105.19 100.22 2dhx n GLY 49 Ca -0.14 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.88 2dhx n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dhx n GLY 50 N 0.00 4.29 3.67 -0.02 0.00 -0.08 -2.27 105.19 110.78 2dhx n GLY 50 Ca 0.00 -1.38 -0.41 0.00 0.00 0.00 0.00 46.02 44.24 2dhx n GLY 50 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dhx s VAL 51 N -1.93 4.96 -0.02 1.61 1.01 0.98 0.15 120.40 127.16 2dhx s VAL 51 Ca 0.00 1.44 0.02 0.00 0.00 0.00 0.00 61.98 63.43 2dhx s VAL 51 Cb 0.00 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.30 2dhx s VAL 51 CO 0.00 0.09 -0.05 -0.22 0.00 0.00 0.00 175.10 174.92 2dhx s LEU 52 N 1.87 3.28 -0.24 3.92 0.20 0.33 -0.13 118.68 127.91 2dhx s LEU 52 Ca 0.34 -0.06 -0.06 0.00 0.69 0.00 0.00 54.13 55.04 2dhx s LEU 52 Cb -0.16 -1.83 -0.02 0.00 -0.43 0.00 0.00 46.19 43.74 2dhx s LEU 52 CO 0.12 0.31 0.03 -0.89 -0.29 0.00 0.00 176.35 175.63 2dhx s THR 53 N -0.96 3.99 -0.16 3.68 2.01 -0.24 0.19 115.64 124.15 2dhx s THR 53 Ca 0.16 -0.28 -0.16 0.00 0.31 0.00 0.00 61.69 61.72 2dhx s THR 53 Cb -0.11 -2.85 -0.04 0.00 0.01 0.00 0.00 72.50 69.51 2dhx s THR 53 CO 0.06 0.37 0.40 -0.36 -0.69 0.00 0.00 174.62 174.41 2dhx s PHE 54 N 1.52 3.44 0.15 4.92 0.40 -0.74 0.11 117.98 127.78 2dhx s PHE 54 Ca 0.06 0.71 -0.28 0.00 -0.60 0.00 0.00 56.93 56.82 2dhx s PHE 54 Cb -0.15 -2.49 -0.06 0.00 0.51 0.00 0.00 43.02 40.82 2dhx s PHE 54 CO 0.01 0.11 1.41 -2.13 0.70 0.00 0.00 175.22 175.32 2dhx n ARG 55 N 3.98 -0.40 -4.03 0.44 0.63 -0.56 -4.34 116.66 112.38 2dhx n ARG 55 Ca -0.09 1.38 -0.22 0.00 -0.92 0.00 0.00 57.85 58.01 2dhx n ARG 55 Cb 0.51 -2.03 -0.04 0.00 0.45 0.00 0.00 32.46 31.35 2dhx n ARG 55 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 2dhx s GLU 56 N -5.44 2.79 -0.04 -0.14 0.41 -1.26 -4.82 118.70 110.20 2dhx s GLU 56 Ca -0.11 -1.18 -0.24 0.00 -0.41 0.00 0.00 54.97 53.03 2dhx s GLU 56 Cb 0.10 -2.49 -0.23 0.00 -1.78 0.00 0.00 34.13 29.74 2dhx s GLU 56 CO 0.56 0.28 1.07 -1.00 -0.49 0.00 0.00 175.26 175.69 2dhx h PRO 57 N 1.44 0.20 -0.50 0.39 0.13 -1.97 -2.68 132.00 129.02 2dhx h PRO 57 Ca -0.47 -0.20 -0.01 0.00 -0.87 0.00 0.00 66.00 64.46 2dhx h PRO 57 Cb 1.25 0.05 -0.02 0.00 0.13 0.00 0.00 31.00 32.40 2dhx h PRO 57 CO 0.60 0.90 0.27 0.00 -0.23 0.00 0.00 178.00 179.55 2dhx h ALA 58 N 0.30 0.64 -0.77 -0.56 0.00 -1.96 0.86 119.26 117.77 2dhx h ALA 58 Ca -0.03 -0.09 0.08 0.00 0.00 0.00 0.00 54.91 54.88 2dhx h ALA 58 Cb 0.98 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.52 2dhx h ALA 58 CO 0.05 0.16 0.50 -0.44 0.00 0.00 0.00 179.25 179.52 2dhx h ASP 59 N 0.66 0.66 0.01 0.00 5.19 -1.76 0.18 116.42 121.36 2dhx h ASP 59 Ca 0.18 0.01 -0.02 0.00 -0.62 0.00 0.00 57.03 56.57 2dhx h ASP 59 Cb 0.05 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 39.43 2dhx h ASP 59 CO -0.03 0.41 -0.10 0.00 -3.12 0.00 0.00 179.24 176.40 2dhx h ALA 60 N 1.60 0.00 -0.50 3.45 0.00 -0.93 -3.26 119.26 119.62 2dhx h ALA 60 Ca 0.35 -0.46 0.10 0.00 0.00 0.00 0.00 54.91 54.90 2dhx h ALA 60 Cb 0.38 0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.08 2dhx h ALA 60 CO -0.13 -0.01 -0.18 0.93 0.00 0.00 0.00 179.25 179.87 2dhx h GLU 61 N -0.77 -0.06 -0.75 0.00 4.39 0.14 0.53 114.58 118.06 2dhx h GLU 61 Ca -0.01 0.00 0.17 0.00 0.34 0.00 0.00 59.36 59.86 2dhx h GLU 61 Cb 0.95 0.01 -0.13 0.00 -0.10 0.00 0.00 28.75 29.48 2dhx h GLU 61 CO 0.02 -0.04 -0.04 -0.09 -1.16 0.00 0.00 179.01 177.70 2dhx h ARG 62 N -0.06 0.07 -0.93 2.33 2.43 -0.76 0.94 114.38 118.40 2dhx h ARG 62 Ca 0.24 -0.00 0.01 0.00 -0.81 0.00 0.00 59.98 59.41 2dhx h ARG 62 Cb 0.43 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 29.92 2dhx h ARG 62 CO -0.55 0.05 0.60 0.28 -1.51 0.00 0.00 179.97 178.84 2dhx h VAL 63 N 0.07 1.24 -0.25 0.20 2.07 -0.98 -2.13 116.25 116.47 2dhx h VAL 63 Ca 0.40 -0.46 -0.04 0.00 0.82 0.00 0.00 66.70 67.42 2dhx h VAL 63 Cb 0.68 -0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 2dhx h VAL 63 CO -0.69 0.24 0.01 -0.07 0.02 0.00 0.00 177.57 177.09 2dhx h LEU 64 N 1.26 0.43 -1.96 2.57 3.38 0.17 -2.44 115.31 118.72 2dhx h LEU 64 Ca 0.34 -0.29 0.57 0.00 0.09 0.00 0.00 57.88 58.59 2dhx h LEU 64 Cb -0.13 -0.11 -0.08 0.00 0.09 0.00 0.00 40.66 40.43 2dhx h LEU 64 CO -0.07 0.61 1.41 0.00 0.09 0.00 0.00 178.44 180.48 2dhx n ALA 65 N -2.34 1.88 -2.47 1.53 0.00 0.25 -3.46 120.51 115.91 2dhx n ALA 65 Ca -0.03 0.66 -0.43 0.00 0.00 0.00 0.00 53.44 53.64 2dhx n ALA 65 Cb 0.23 -1.14 -0.10 0.00 0.00 0.00 0.00 19.45 18.44 2dhx n ALA 65 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 2dhx s GLN 66 N -4.86 3.01 0.00 0.00 0.74 -0.92 -4.90 119.66 112.73 2dhx s GLN 66 Ca -0.05 -0.96 0.24 0.00 0.05 0.00 0.00 55.36 54.63 2dhx s GLN 66 Cb 0.27 -3.97 1.42 0.00 1.10 0.00 0.00 33.01 31.83 2dhx s GLN 66 CO 0.89 -0.75 1.87 0.00 -0.55 0.00 0.00 175.29 176.75 2dhx n ALA 67 N 5.22 2.56 -2.35 1.58 0.00 -1.22 -4.70 120.51 121.59 2dhx n ALA 67 Ca -0.11 -0.15 -0.31 0.00 0.00 0.00 0.00 53.44 52.87 2dhx n ALA 67 Cb 0.47 -1.39 -0.15 0.00 0.00 0.00 0.00 19.45 18.38 2dhx n ALA 67 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2dhx s ASP 68 N -1.83 3.28 -0.28 0.00 2.15 -1.26 -4.73 116.67 114.00 2dhx s ASP 68 Ca 0.36 -0.44 -0.21 0.00 0.43 0.00 0.00 52.55 52.70 2dhx s ASP 68 Cb 0.16 -0.44 0.09 0.00 -0.30 0.00 0.00 42.92 42.43 2dhx s ASP 68 CO 0.28 0.31 0.77 -1.00 -0.17 0.00 0.00 175.17 175.36 2dhx s HIS 69 N -0.67 -0.84 -0.01 -5.34 3.76 -1.25 -5.03 115.29 105.91 2dhx s HIS 69 Ca 0.11 1.85 0.04 0.00 -0.15 0.00 0.00 55.06 56.91 2dhx s HIS 69 Cb -0.10 0.43 -0.01 0.00 1.11 0.00 0.00 32.58 34.01 2dhx s HIS 69 CO -0.00 -0.41 -0.13 -2.00 -0.85 0.00 0.00 174.74 171.34 2dhx s GLU 70 N 0.94 1.13 -0.26 1.40 2.12 -1.26 -0.94 118.70 121.84 2dhx s GLU 70 Ca -0.04 -0.48 -0.02 0.00 0.36 0.00 0.00 54.97 54.79 2dhx s GLU 70 Cb -0.05 -1.08 0.13 0.00 0.26 0.00 0.00 34.13 33.39 2dhx s GLU 70 CO -0.10 0.27 0.30 -1.17 -0.54 0.00 0.00 175.26 174.03 2dhx s LEU 71 N -0.25 -0.32 -0.75 2.70 2.96 -1.14 -4.95 118.68 116.93 2dhx s LEU 71 Ca 0.04 -0.39 -0.02 0.00 -0.22 0.00 0.00 54.13 53.54 2dhx s LEU 71 Cb -0.06 0.63 0.00 0.00 0.50 0.00 0.00 46.19 47.26 2dhx s LEU 71 CO -0.00 -0.35 0.65 1.41 -1.32 0.00 0.00 176.35 176.74 2dhx n HIS 72 N 5.33 -2.62 -3.09 5.38 8.25 -1.26 -3.97 115.22 123.24 2dhx n HIS 72 Ca -0.03 1.03 -0.04 0.00 -0.26 0.00 0.00 57.72 58.42 2dhx n HIS 72 Cb 0.48 -3.49 0.00 0.00 1.12 0.00 0.00 29.99 28.10 2dhx n HIS 72 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dhx n GLY 73 N -1.60 -1.17 0.00 -1.41 0.00 -1.26 -4.92 105.19 94.82 2dhx n GLY 73 Ca -0.13 0.29 0.00 0.00 0.00 0.00 0.00 46.02 46.19 2dhx n GLY 73 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dhx n ALA 74 N 0.92 0.00 -3.41 4.61 0.00 -1.25 -5.02 120.51 116.36 2dhx n ALA 74 Ca -0.00 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.99 2dhx n ALA 74 Cb 0.39 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.78 2dhx n ALA 74 CO 0.00 0.00 0.00 1.14 0.00 0.00 0.00 177.50 178.64 2dhx s GLN 75 N -1.36 2.99 0.19 0.00 -2.07 -1.26 -2.86 119.66 115.30 2dhx s GLN 75 Ca 0.00 -2.00 -0.30 0.00 -1.82 0.00 0.00 55.36 51.24 2dhx s GLN 75 Cb 0.00 -4.20 -0.08 0.00 -1.09 0.00 0.00 33.01 27.65 2dhx s GLN 75 CO 0.00 -1.27 1.00 -0.51 -1.32 0.00 0.00 175.29 173.19 2dhx s LEU 76 N 1.01 4.56 -0.37 2.60 2.01 -0.11 -4.63 118.68 123.74 2dhx s LEU 76 Ca 0.09 1.98 -0.07 0.00 0.01 0.00 0.00 54.13 56.14 2dhx s LEU 76 Cb -0.23 -3.60 0.06 0.00 0.01 0.00 0.00 46.19 42.43 2dhx s LEU 76 CO -0.02 -0.03 0.17 -0.44 1.01 0.00 0.00 176.35 177.05 2dhx s SER 77 N -0.57 5.44 -0.01 2.29 0.01 -0.25 -3.78 113.70 116.83 2dhx s SER 77 Ca 0.45 -1.36 -0.21 0.00 1.31 0.00 0.00 55.95 56.14 2dhx s SER 77 Cb -0.27 -1.91 -0.05 0.00 0.21 0.00 0.00 66.02 64.00 2dhx s SER 77 CO 0.33 -0.42 0.62 -0.76 0.41 0.00 0.00 173.24 173.42 2dhx s LEU 78 N 1.39 4.40 0.16 2.44 2.01 -1.26 0.52 118.68 128.33 2dhx s LEU 78 Ca 0.01 1.19 -0.15 0.00 0.01 0.00 0.00 54.13 55.19 2dhx s LEU 78 Cb -0.21 -2.97 0.02 0.00 0.01 0.00 0.00 46.19 43.04 2dhx s LEU 78 CO 0.02 0.06 0.41 -0.13 1.01 0.00 0.00 176.35 177.72 2dhx s ARG 79 N -0.02 1.19 -0.21 1.70 0.52 -0.43 -4.95 118.95 116.75 2dhx s ARG 79 Ca 0.32 -0.89 -0.29 0.00 -0.52 0.00 0.00 55.73 54.35 2dhx s ARG 79 Cb -0.18 0.46 -0.01 0.00 0.52 0.00 0.00 34.95 35.74 2dhx s ARG 79 CO 0.18 -0.47 1.30 -1.25 0.02 0.00 0.00 175.30 175.07 2dhx s PRO 80 N -3.87 4.10 0.95 3.54 0.04 -1.26 0.77 135.00 139.27 2dhx s PRO 80 Ca 0.09 1.53 -0.12 0.00 0.04 0.00 0.00 61.00 62.54 2dhx s PRO 80 Cb 0.01 -3.82 0.16 0.00 0.04 0.00 0.00 34.50 30.89 2dhx s PRO 80 CO -0.06 -0.88 1.09 0.00 0.04 0.00 0.00 177.00 177.19 2dhx s ALA 81 N 3.90 1.13 0.59 8.56 0.00 -1.25 -4.66 121.76 130.02 2dhx s ALA 81 Ca 0.56 -0.01 -0.15 0.00 0.00 0.00 0.00 51.96 52.36 2dhx s ALA 81 Cb -0.20 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 2dhx s ALA 81 CO 0.18 -2.71 1.05 -1.25 0.00 0.00 0.00 175.76 173.03 2dhx s PRO 82 N -4.81 3.37 0.47 0.00 0.04 -1.26 -4.91 135.00 127.90 2dhx s PRO 82 Ca 0.65 1.16 -0.21 0.00 0.04 0.00 0.00 61.00 62.64 2dhx s PRO 82 Cb -0.20 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.21 2dhx s PRO 82 CO 0.58 -0.76 1.04 -1.25 0.04 0.00 0.00 177.00 176.65 2dhx s PRO 83 N -4.14 3.86 -0.15 0.56 0.04 -1.26 -5.01 135.00 128.91 2dhx s PRO 83 Ca 0.63 1.39 -0.10 0.00 0.04 0.00 0.00 61.00 62.95 2dhx s PRO 83 Cb -0.15 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.18 2dhx s PRO 83 CO 0.37 -0.38 -0.20 -2.13 0.04 0.00 0.00 177.00 174.71 2dhx n ARG 84 N -0.81 0.46 -4.42 4.56 3.00 -1.26 -5.02 116.66 113.16 2dhx n ARG 84 Ca 0.09 0.49 -0.21 0.00 -0.00 0.00 0.00 57.85 58.21 2dhx n ARG 84 Cb 0.52 -1.66 -0.10 0.00 0.00 0.00 0.00 32.46 31.22 2dhx n ARG 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2dhx s ALA 85 N -2.75 2.34 0.01 5.13 0.00 -1.26 -5.06 121.76 120.16 2dhx s ALA 85 Ca -0.17 -1.88 -0.20 0.00 0.00 0.00 0.00 51.96 49.71 2dhx s ALA 85 Cb 0.02 0.14 -0.22 0.00 0.00 0.00 0.00 23.12 23.07 2dhx s ALA 85 CO 0.25 -0.04 1.13 -1.00 0.00 0.00 0.00 175.76 176.09 2dhx h PRO 86 N 2.30 0.40 -1.05 0.00 0.13 -2.06 -3.44 132.00 128.28 2dhx h PRO 86 Ca -0.40 -0.39 0.07 0.00 -0.87 0.00 0.00 66.00 64.41 2dhx h PRO 86 Cb 1.23 0.10 -0.21 0.00 0.13 0.00 0.00 31.00 32.25 2dhx h PRO 86 CO 0.67 1.05 -0.30 0.00 -0.23 0.00 0.00 178.00 179.19 2dhx s ALA 87 N -3.35 -2.22 -0.41 -0.56 0.00 -1.26 -5.11 121.76 108.84 2dhx s ALA 87 Ca -0.13 1.66 0.00 0.00 0.00 0.00 0.00 51.96 53.49 2dhx s ALA 87 Cb 0.04 -2.21 0.11 0.00 0.00 0.00 0.00 23.12 21.06 2dhx s ALA 87 CO 0.81 -1.41 0.17 1.03 0.00 0.00 0.00 175.76 176.36 2dhx s ARG 88 N 2.84 1.85 -0.50 0.00 0.52 -1.26 -5.02 118.95 117.38 2dhx s ARG 88 Ca 0.19 -1.99 0.04 0.00 -0.52 0.00 0.00 55.73 53.44 2dhx s ARG 88 Cb -0.14 -3.43 0.13 0.00 0.52 0.00 0.00 34.95 32.03 2dhx s ARG 88 CO -0.22 -1.04 0.25 -0.51 0.02 0.00 0.00 175.30 173.81 2dhx s LEU 89 N 0.79 4.03 -1.09 2.53 1.43 -1.26 -5.01 118.68 120.10 2dhx s LEU 89 Ca 0.11 -2.93 -0.07 0.00 -1.03 0.00 0.00 54.13 50.21 2dhx s LEU 89 Cb -0.21 -1.53 0.28 0.00 0.03 0.00 0.00 46.19 44.76 2dhx s LEU 89 CO -0.05 -0.24 1.18 -0.11 0.23 0.00 0.00 176.35 177.36 2dhx n LEU 90 N 3.21 5.62 -4.58 1.79 -0.00 -1.26 -5.03 117.00 116.76 2dhx n LEU 90 Ca 0.06 -5.10 -0.47 0.00 -0.00 0.00 0.00 56.01 50.50 2dhx n LEU 90 Cb 0.33 -1.38 -0.03 0.00 -0.00 0.00 0.00 43.42 42.33 2dhx n LEU 90 CO 0.32 1.46 0.63 0.18 -0.00 0.00 0.00 177.39 179.98 2dhx n LEU 91 N 2.27 1.56 -3.55 -1.96 7.99 -1.26 -4.95 117.00 117.10 2dhx n LEU 91 Ca 0.24 1.16 -0.06 0.00 -0.01 0.00 0.00 56.01 57.34 2dhx n LEU 91 Cb 0.37 -1.24 -0.02 0.00 -0.11 0.00 0.00 43.42 42.42 2dhx n LEU 91 CO 0.52 -1.40 0.81 -1.58 -1.51 0.00 0.00 177.39 174.24 2dhx s GLN 92 N -0.91 0.66 0.00 3.23 0.74 -1.26 -5.18 119.66 116.93 2dhx s GLN 92 Ca 0.66 -0.25 0.00 0.00 0.05 0.00 0.00 55.36 55.82 2dhx s GLN 92 Cb -0.78 0.29 0.00 0.00 1.10 0.00 0.00 33.01 33.62 2dhx s GLN 92 CO 0.56 -0.29 0.00 0.41 -0.55 0.00 0.00 175.29 175.42 2dhx n GLY 93 N -0.21 0.96 3.61 2.59 0.00 -1.26 -5.15 105.19 105.73 2dhx n GLY 93 Ca -0.06 -2.01 -0.09 0.00 0.00 0.00 0.00 46.02 43.86 2dhx n GLY 93 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2dhx s LEU 94 N 0.00 -0.39 0.89 0.99 0.20 -1.26 -5.18 118.68 113.93 2dhx s LEU 94 Ca 0.00 0.62 -0.12 0.00 0.69 0.00 0.00 54.13 55.32 2dhx s LEU 94 Cb 0.00 1.82 0.12 0.00 -0.43 0.00 0.00 46.19 47.70 2dhx s LEU 94 CO 0.00 -0.22 1.13 -2.16 -0.29 0.00 0.00 176.35 174.81 2dhx s PRO 95 N -0.35 1.35 0.38 0.98 0.04 -1.26 -5.02 135.00 131.12 2dhx s PRO 95 Ca 0.01 0.37 -0.25 0.00 0.04 0.00 0.00 61.00 61.17 2dhx s PRO 95 Cb -0.03 -1.86 -0.09 0.00 0.04 0.00 0.00 34.50 32.56 2dhx s PRO 95 CO -0.04 -2.07 1.06 -1.25 0.04 0.00 0.00 177.00 174.74 2dhx s PRO 96 N -5.25 4.23 -0.32 0.56 0.04 -1.26 -5.04 135.00 127.97 2dhx s PRO 96 Ca 0.63 1.57 -0.01 0.00 0.04 0.00 0.00 61.00 63.23 2dhx s PRO 96 Cb -0.15 -2.65 0.13 0.00 0.04 0.00 0.00 34.50 31.87 2dhx s PRO 96 CO 0.53 -0.09 0.22 0.20 0.04 0.00 0.00 177.00 177.91 2dhx s GLY 97 N -1.45 0.37 -0.29 0.56 0.00 -1.26 -5.10 107.32 100.15 2dhx s GLY 97 Ca 0.56 -1.10 -0.10 0.00 0.00 0.00 0.00 44.72 44.08 2dhx s GLY 97 CO 0.30 2.30 0.63 -1.08 0.00 0.00 0.00 173.10 175.26 2dhx s THR 98 N 1.80 -0.98 -0.25 0.90 -1.32 -1.26 -5.16 115.64 109.37 2dhx s THR 98 Ca 0.13 0.01 -0.28 0.00 -1.21 0.00 0.00 61.69 60.33 2dhx s THR 98 Cb -0.17 -0.98 0.16 0.00 -1.51 0.00 0.00 72.50 70.00 2dhx s THR 98 CO -0.21 0.00 1.23 -0.44 -2.21 0.00 0.00 174.62 172.98 2dhx s SER 99 N 2.88 -0.19 0.00 8.08 0.01 -1.26 -5.12 113.70 118.10 2dhx s SER 99 Ca -0.05 0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.47 2dhx s SER 99 Cb -0.12 0.23 0.00 0.00 0.21 0.00 0.00 66.02 66.34 2dhx s SER 99 CO -0.19 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 173.93 2dhx n GLY 100 N 0.97 -1.89 3.79 3.44 0.00 -1.26 -5.17 105.19 105.07 2dhx n GLY 100 Ca -0.06 0.88 -0.29 0.00 0.00 0.00 0.00 46.02 46.55 2dhx n GLY 100 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dhx s PRO 101 N 0.00 1.23 0.00 1.61 0.04 -1.26 -5.08 135.00 131.54 2dhx s PRO 101 Ca 0.00 0.32 0.00 0.00 0.04 0.00 0.00 61.00 61.36 2dhx s PRO 101 Cb 0.00 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.69 2dhx s PRO 101 CO 0.00 -2.14 0.00 0.45 0.04 0.00 0.00 177.00 175.35 2dhx n SER 102 N -3.73 0.00 -3.64 6.66 2.88 -1.26 -5.17 113.62 109.35 2dhx n SER 102 Ca 0.07 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.57 2dhx n SER 102 Cb 0.59 0.00 -0.07 0.00 -0.75 0.00 0.00 64.21 63.98 2dhx n SER 102 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2dhx s SER 103 N 0.00 -0.27 0.00 -3.46 0.15 -1.26 -5.37 113.70 103.49 2dhx s SER 103 Ca 0.00 0.48 0.00 0.00 0.70 0.00 0.00 55.95 57.13 2dhx s SER 103 Cb 0.00 0.70 0.00 0.00 -1.71 0.00 0.00 66.02 65.01 2dhx s SER 103 CO 0.00 -0.08 0.00 0.61 1.20 0.00 0.00 173.24 174.97