#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhm s SER 2 N 0.00 0.70 -0.29 1.61 1.04 -1.26 -5.14 113.70 110.36 2dhm s SER 2 Ca 0.00 -0.10 -0.19 0.00 0.48 0.00 0.00 55.95 56.14 2dhm s SER 2 Cb 0.00 -0.22 0.16 0.00 0.10 0.00 0.00 66.02 66.06 2dhm s SER 2 CO 0.00 -0.00 1.12 -0.94 0.98 0.00 0.00 173.24 174.40 2dhm s SER 3 N 0.42 -0.33 0.00 7.02 1.04 -1.26 -5.17 113.70 115.42 2dhm s SER 3 Ca -0.05 0.56 0.00 0.00 0.48 0.00 0.00 55.95 56.95 2dhm s SER 3 Cb -0.08 0.93 0.00 0.00 0.10 0.00 0.00 66.02 66.97 2dhm s SER 3 CO -0.00 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.74 2dhm n GLY 4 N 2.94 0.79 3.50 7.32 0.00 -1.26 -4.87 105.19 113.60 2dhm n GLY 4 Ca -0.16 -1.33 -0.43 0.00 0.00 0.00 0.00 46.02 44.10 2dhm n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dhm s SER 5 N -1.02 6.87 -1.06 1.61 0.15 -1.26 -4.90 113.70 114.09 2dhm s SER 5 Ca 0.00 -2.52 -0.06 0.00 0.70 0.00 0.00 55.95 54.06 2dhm s SER 5 Cb 0.00 -2.46 0.28 0.00 -1.71 0.00 0.00 66.02 62.12 2dhm s SER 5 CO 0.00 -0.99 1.13 -1.54 1.20 0.00 0.00 173.24 173.04 2dhm n SER 6 N 6.83 5.44 -1.26 5.45 3.41 -1.26 -5.01 113.62 127.22 2dhm n SER 6 Ca 0.37 -3.15 0.15 0.00 -0.26 0.00 0.00 58.87 55.99 2dhm n SER 6 Cb 0.46 -1.28 -0.05 0.00 -0.26 0.00 0.00 64.21 63.07 2dhm n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2dhm n GLY 7 N 2.26 -2.00 3.26 5.00 0.00 -1.26 -4.49 105.19 107.96 2dhm n GLY 7 Ca 0.24 -0.88 -0.42 0.00 0.00 0.00 0.00 46.02 44.96 2dhm n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2dhm s MET 8 N -2.96 3.86 -0.47 1.61 -2.45 -1.26 -5.02 119.30 112.61 2dhm s MET 8 Ca 0.00 -3.21 -0.27 0.00 -1.25 0.00 0.00 55.69 50.96 2dhm s MET 8 Cb 0.00 -4.34 -0.04 0.00 1.25 0.00 0.00 34.83 31.70 2dhm s MET 8 CO 0.00 -1.25 2.05 -1.64 1.05 0.00 0.00 175.02 175.23 2dhm s MET 9 N -1.24 2.68 -0.24 4.11 1.00 -1.26 -4.79 119.30 119.56 2dhm s MET 9 Ca 0.29 1.18 -0.16 0.00 0.00 0.00 0.00 55.69 57.01 2dhm s MET 9 Cb -0.09 -4.40 -0.11 0.00 0.00 0.00 0.00 34.83 30.23 2dhm s MET 9 CO -0.09 -2.63 -0.30 -0.89 0.00 0.00 0.00 175.02 171.11 2dhm n ILE 10 N 7.55 1.52 0.32 2.53 2.08 -1.26 -3.51 119.36 128.59 2dhm n ILE 10 Ca 0.27 -0.20 0.17 0.00 0.56 0.00 0.00 62.75 63.54 2dhm n ILE 10 Cb 0.51 -2.03 0.89 0.00 -0.75 0.00 0.00 39.64 38.26 2dhm n ILE 10 CO 0.00 0.00 0.00 0.03 0.56 0.00 0.00 176.55 177.14 2dhm h ARG 11 N -1.00 0.00 0.00 0.38 3.08 -1.98 -1.08 114.38 113.78 2dhm h ARG 11 Ca -0.48 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.36 2dhm h ARG 11 Cb 1.40 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.42 2dhm h ARG 11 CO -0.29 0.00 -1.20 1.49 -1.07 0.00 0.00 179.97 178.90 2dhm h GLU 12 N 0.00 0.00 -0.97 0.04 4.81 -1.96 -3.27 114.58 113.22 2dhm h GLU 12 Ca 0.00 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.35 2dhm h GLU 12 Cb 0.48 0.00 -0.08 0.00 0.63 0.00 0.00 28.75 29.78 2dhm h GLU 12 CO 0.00 0.93 0.62 0.07 -0.73 0.00 0.00 179.01 179.90 2dhm h ARG 13 N -1.00 0.92 0.28 1.92 0.11 -1.39 -1.12 114.38 114.10 2dhm h ARG 13 Ca -0.32 -0.06 -0.01 0.00 0.10 0.00 0.00 59.98 59.69 2dhm h ARG 13 Cb 1.25 -0.21 0.00 0.00 1.11 0.00 0.00 29.97 32.12 2dhm h ARG 13 CO -0.20 0.61 -0.14 0.82 0.10 0.00 0.00 179.97 181.17 2dhm h ILE 14 N 0.95 0.00 -0.71 0.08 2.04 -1.41 -3.26 117.51 115.21 2dhm h ILE 14 Ca 0.47 -0.06 0.13 0.00 1.00 0.00 0.00 64.86 66.41 2dhm h ILE 14 Cb 0.49 0.00 -0.13 0.00 -0.74 0.00 0.00 36.82 36.43 2dhm h ILE 14 CO -0.24 0.00 -0.25 -0.33 0.00 0.00 0.00 178.15 177.33 2dhm h GLU 15 N -0.44 -0.05 -0.66 2.37 5.08 -1.58 -0.36 114.58 118.94 2dhm h GLU 15 Ca -0.04 0.00 0.13 0.00 -1.00 0.00 0.00 59.36 58.46 2dhm h GLU 15 Cb 0.29 0.01 -0.13 0.00 0.50 0.00 0.00 28.75 29.43 2dhm h GLU 15 CO 0.06 -0.04 -0.16 0.39 -1.00 0.00 0.00 179.01 178.27 2dhm n GLU 16 N -5.47 -0.06 0.19 2.33 1.02 -0.43 -0.29 120.64 117.92 2dhm n GLU 16 Ca 0.08 1.03 -0.08 0.00 -0.02 0.00 0.00 57.16 58.17 2dhm n GLU 16 Cb 0.37 -1.54 -0.04 0.00 -0.02 0.00 0.00 31.44 30.22 2dhm n GLU 16 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2dhm h LYS 17 N 0.00 -0.47 -0.98 3.49 6.56 -1.11 -3.22 116.57 120.83 2dhm h LYS 17 Ca 0.32 0.03 0.28 0.00 -1.06 0.00 0.00 60.65 60.22 2dhm h LYS 17 Cb 0.49 0.11 -0.18 0.00 -0.57 0.00 0.00 32.23 32.08 2dhm h LYS 17 CO -0.68 -0.32 0.05 1.28 -2.06 0.00 0.00 179.45 177.73 2dhm n LEU 18 N -3.78 -0.09 -0.29 2.94 4.77 0.18 0.01 117.00 120.75 2dhm n LEU 18 Ca -0.06 1.66 -0.08 0.00 -0.03 0.00 0.00 56.01 57.51 2dhm n LEU 18 Cb 0.19 -0.62 -0.07 0.00 -2.33 0.00 0.00 43.42 40.60 2dhm n LEU 18 CO 0.15 -1.69 0.37 0.54 -1.33 0.00 0.00 177.39 175.42 2dhm n ARG 19 N -5.45 -0.30 0.02 3.23 5.12 0.60 -0.17 116.66 119.71 2dhm n ARG 19 Ca 0.24 1.12 -0.10 0.00 -1.93 0.00 0.00 57.85 57.18 2dhm n ARG 19 Cb 0.78 -1.65 -0.13 0.00 -1.16 0.00 0.00 32.46 30.30 2dhm n ARG 19 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2dhm h ALA 20 N 0.26 0.55 -0.80 7.54 0.00 -1.18 0.53 119.26 126.16 2dhm h ALA 20 Ca 0.11 -1.24 0.16 0.00 0.00 0.00 0.00 54.91 53.94 2dhm h ALA 20 Cb 0.28 0.27 -0.10 0.00 0.00 0.00 0.00 17.79 18.24 2dhm h ALA 20 CO -0.64 1.40 0.34 0.00 0.00 0.00 0.00 179.25 180.35 2dhm h ALA 21 N 0.88 1.17 0.00 0.00 0.00 0.15 -3.37 119.26 118.09 2dhm h ALA 21 Ca -0.20 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2dhm h ALA 21 Cb 1.94 0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.82 2dhm h ALA 21 CO 0.11 -0.21 -0.68 1.19 0.00 0.00 0.00 179.25 179.66 2dhm n PHE 22 N -4.99 0.00 -2.35 0.00 3.72 0.77 -5.02 117.46 109.59 2dhm n PHE 22 Ca 0.16 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.52 2dhm n PHE 22 Cb 0.47 0.14 0.02 0.00 -0.94 0.00 0.00 39.48 39.17 2dhm n PHE 22 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2dhm n GLN 23 N -2.75 -1.63 -0.08 -1.08 6.02 0.18 -5.05 117.38 112.98 2dhm n GLN 23 Ca 0.00 0.21 -0.02 0.00 -0.01 0.00 0.00 57.00 57.18 2dhm n GLN 23 Cb 0.34 -3.33 0.02 0.00 1.02 0.00 0.00 30.24 28.29 2dhm n GLN 23 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 2dhm n PRO 24 N -1.78 -1.19 0.01 -1.09 -0.04 -1.26 -4.99 135.00 124.66 2dhm n PRO 24 Ca -0.07 -0.14 0.10 0.00 -0.04 0.00 0.00 63.50 63.36 2dhm n PRO 24 Cb 0.54 -0.13 -0.13 0.00 -0.04 0.00 0.00 33.50 33.74 2dhm n PRO 24 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2dhm n VAL 25 N -2.70 0.17 -4.19 0.52 0.24 -1.00 -4.96 118.33 106.42 2dhm n VAL 25 Ca 0.01 -0.52 -0.18 0.00 -2.04 0.00 0.00 64.34 61.61 2dhm n VAL 25 Cb 0.05 -0.09 -0.12 0.00 -1.47 0.00 0.00 33.84 32.21 2dhm n VAL 25 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 2dhm s PHE 26 N -3.46 1.23 -0.29 6.34 5.36 -1.23 -5.00 117.98 120.93 2dhm s PHE 26 Ca -0.06 -0.51 -0.13 0.00 -0.96 0.00 0.00 56.93 55.27 2dhm s PHE 26 Cb 0.13 -0.68 0.10 0.00 -0.34 0.00 0.00 43.02 42.23 2dhm s PHE 26 CO 0.88 0.07 0.66 -1.17 -1.46 0.00 0.00 175.22 174.20 2dhm s LEU 27 N -2.00 -1.03 -0.28 6.12 2.96 -1.26 -3.58 118.68 119.61 2dhm s LEU 27 Ca 0.01 1.53 -0.17 0.00 -0.22 0.00 0.00 54.13 55.28 2dhm s LEU 27 Cb -0.08 2.32 0.12 0.00 0.50 0.00 0.00 46.19 49.05 2dhm s LEU 27 CO 0.02 -0.23 0.88 -0.70 -1.32 0.00 0.00 176.35 175.00 2dhm s GLU 28 N 2.25 0.51 0.08 1.98 2.56 -1.04 -5.02 118.70 120.03 2dhm s GLU 28 Ca -0.08 0.85 0.07 0.00 0.00 0.00 0.00 54.97 55.81 2dhm s GLU 28 Cb -0.09 0.12 -0.04 0.00 2.00 0.00 0.00 34.13 36.13 2dhm s GLU 28 CO -0.19 -0.10 -0.14 0.08 -0.56 0.00 0.00 175.26 174.35 2dhm s VAL 29 N 1.30 3.11 -0.20 3.70 1.01 -1.26 -0.12 120.40 127.92 2dhm s VAL 29 Ca -0.08 -1.27 0.01 0.00 0.00 0.00 0.00 61.98 60.65 2dhm s VAL 29 Cb -0.04 -2.40 0.04 0.00 0.00 0.00 0.00 36.38 33.98 2dhm s VAL 29 CO -0.15 0.19 -0.12 -0.69 0.00 0.00 0.00 175.10 174.33 2dhm s VAL 30 N -1.10 1.79 -0.12 2.92 1.01 0.39 -5.00 120.40 120.29 2dhm s VAL 30 Ca 0.18 -1.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.07 2dhm s VAL 30 Cb -0.11 -1.82 -0.02 0.00 0.00 0.00 0.00 36.38 34.42 2dhm s VAL 30 CO 0.10 0.20 -0.08 -0.62 0.00 0.00 0.00 175.10 174.70 2dhm s ASP 31 N 1.33 4.48 -0.59 3.32 -1.08 -1.26 -1.98 116.67 120.89 2dhm s ASP 31 Ca -0.01 -0.16 0.01 0.00 -0.52 0.00 0.00 52.55 51.87 2dhm s ASP 31 Cb -0.16 -1.49 0.15 0.00 -1.46 0.00 0.00 42.92 39.96 2dhm s ASP 31 CO -0.08 0.24 0.36 -1.61 0.52 0.00 0.00 175.17 174.59 2dhm s GLU 32 N -0.06 2.29 -0.18 4.34 0.41 -1.12 -5.05 118.70 119.32 2dhm s GLU 32 Ca -0.00 -2.65 0.01 0.00 -0.41 0.00 0.00 54.97 51.91 2dhm s GLU 32 Cb -0.13 -3.52 0.04 0.00 -1.78 0.00 0.00 34.13 28.74 2dhm s GLU 32 CO 0.03 -1.15 -0.11 -1.12 -0.49 0.00 0.00 175.26 172.42 2dhm s SER 33 N 0.04 3.19 0.13 -0.19 0.01 -1.26 -4.12 113.70 111.50 2dhm s SER 33 Ca 0.18 -0.78 -0.31 0.00 1.31 0.00 0.00 55.95 56.35 2dhm s SER 33 Cb -0.22 -1.21 -0.10 0.00 0.21 0.00 0.00 66.02 64.69 2dhm s SER 33 CO -0.02 -0.12 1.81 -0.31 0.41 0.00 0.00 173.24 175.01 2dhm s TYR 34 N 1.43 2.21 0.27 2.43 1.51 -1.26 -4.88 117.35 119.05 2dhm s TYR 34 Ca 0.00 0.02 -0.04 0.00 -1.01 0.00 0.00 57.07 56.04 2dhm s TYR 34 Cb -0.15 -4.17 0.35 0.00 -0.11 0.00 0.00 41.96 37.88 2dhm s TYR 34 CO -0.09 -4.78 1.93 0.07 -1.11 0.00 0.00 175.55 171.57 2dhm h ARG 35 N 8.47 1.22 -6.26 -0.62 0.11 -1.98 -3.44 114.38 111.87 2dhm h ARG 35 Ca -0.46 -0.07 -0.47 0.00 0.10 0.00 0.00 59.98 59.08 2dhm h ARG 35 Cb 1.22 -0.28 0.25 0.00 1.11 0.00 0.00 29.97 32.27 2dhm h ARG 35 CO 0.95 0.81 -2.08 0.72 0.10 0.00 0.00 179.97 180.47 2dhm n HIS 36 N -4.42 -1.33 -0.95 4.08 8.25 -1.26 -4.75 115.22 114.84 2dhm n HIS 36 Ca 0.12 0.46 -0.14 0.00 -0.26 0.00 0.00 57.72 57.91 2dhm n HIS 36 Cb 0.06 -1.45 -0.04 0.00 1.12 0.00 0.00 29.99 29.68 2dhm n HIS 36 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 2dhm n ASN 37 N 1.42 5.90 -4.86 0.41 3.02 -1.26 -4.92 115.26 114.97 2dhm n ASN 37 Ca -0.01 -2.79 -0.33 0.00 -0.03 0.00 0.00 54.58 51.42 2dhm n ASN 37 Cb 0.70 -1.20 -0.05 0.00 -0.61 0.00 0.00 39.78 38.62 2dhm n ASN 37 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 2dhm s VAL 38 N -0.93 4.93 1.17 2.41 -7.23 -1.26 -5.09 120.40 114.40 2dhm s VAL 38 Ca 0.37 0.57 -0.18 0.00 -1.81 0.00 0.00 61.98 60.93 2dhm s VAL 38 Cb 0.23 -3.66 0.27 0.00 0.56 0.00 0.00 36.38 33.78 2dhm s VAL 38 CO -0.05 0.07 1.11 -2.16 -0.31 0.00 0.00 175.10 173.76 2dhm s PRO 39 N -2.44 -0.93 0.29 4.82 0.04 -1.26 -4.99 135.00 130.52 2dhm s PRO 39 Ca 0.43 0.03 0.09 0.00 0.04 0.00 0.00 61.00 61.59 2dhm s PRO 39 Cb -0.13 -1.62 -0.06 0.00 0.04 0.00 0.00 34.50 32.74 2dhm s PRO 39 CO 0.20 -3.54 -0.13 0.00 0.04 0.00 0.00 177.00 173.58 2dhm s ALA 40 N -3.00 2.62 0.00 8.56 0.00 -1.26 -4.88 121.76 123.79 2dhm s ALA 40 Ca 0.70 -1.92 0.00 0.00 0.00 0.00 0.00 51.96 50.74 2dhm s ALA 40 Cb -0.11 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 22.94 2dhm s ALA 40 CO 0.56 0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.84 2dhm n GLY 41 N -0.63 1.28 0.00 0.00 0.00 -1.26 -4.83 105.19 99.74 2dhm n GLY 41 Ca -0.06 -0.35 0.12 0.00 0.00 0.00 0.00 46.02 45.74 2dhm n GLY 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dhm n SER 42 N 0.00 0.00 -3.75 1.61 3.41 -1.26 -4.38 113.62 109.25 2dhm n SER 42 Ca 0.00 -0.08 -0.30 0.00 -0.26 0.00 0.00 58.87 58.24 2dhm n SER 42 Cb 0.00 -0.28 -0.14 0.00 -0.26 0.00 0.00 64.21 63.52 2dhm n SER 42 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 2dhm s GLU 43 N -2.57 1.00 -0.30 4.33 2.02 -1.26 -5.05 118.70 116.88 2dhm s GLU 43 Ca 0.24 -1.50 -0.13 0.00 0.02 0.00 0.00 54.97 53.60 2dhm s GLU 43 Cb 0.17 -2.24 0.18 0.00 0.10 0.00 0.00 34.13 32.34 2dhm s GLU 43 CO 0.38 -1.05 1.06 0.45 0.02 0.00 0.00 175.26 176.12 2dhm s SER 44 N 1.08 -0.44 -0.28 -0.19 0.15 -1.26 -4.83 113.70 107.93 2dhm s SER 44 Ca 0.13 0.23 -0.05 0.00 0.70 0.00 0.00 55.95 56.96 2dhm s SER 44 Cb -0.20 1.35 0.02 0.00 -1.71 0.00 0.00 66.02 65.47 2dhm s SER 44 CO -0.14 -0.08 0.02 -1.00 1.20 0.00 0.00 173.24 173.24 2dhm s HIS 45 N 2.96 3.12 0.05 3.44 3.76 -1.26 -4.82 115.29 122.54 2dhm s HIS 45 Ca 0.04 -1.22 0.05 0.00 -0.15 0.00 0.00 55.06 53.78 2dhm s HIS 45 Cb -0.09 -2.18 -0.04 0.00 1.11 0.00 0.00 32.58 31.39 2dhm s HIS 45 CO -0.13 -0.64 -0.09 0.12 -0.85 0.00 0.00 174.74 173.15 2dhm s PHE 46 N 1.43 2.79 -0.07 1.40 5.36 -1.26 -2.81 117.98 124.82 2dhm s PHE 46 Ca 0.01 -0.11 -0.16 0.00 -0.96 0.00 0.00 56.93 55.71 2dhm s PHE 46 Cb -0.17 -1.52 0.03 0.00 -0.34 0.00 0.00 43.02 41.03 2dhm s PHE 46 CO -0.00 0.38 0.39 0.21 -1.46 0.00 0.00 175.22 174.74 2dhm s LYS 47 N -1.79 0.64 -0.03 10.12 2.20 -0.84 -1.24 119.74 128.80 2dhm s LYS 47 Ca 0.19 0.15 0.01 0.00 -0.36 0.00 0.00 55.97 55.95 2dhm s LYS 47 Cb -0.11 0.30 0.02 0.00 -1.51 0.00 0.00 37.83 36.53 2dhm s LYS 47 CO 0.10 -0.15 -0.02 0.08 -0.36 0.00 0.00 175.35 175.00 2dhm s VAL 48 N -0.73 0.30 -0.21 4.02 1.01 -1.13 -0.46 120.40 123.21 2dhm s VAL 48 Ca -0.08 -0.01 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 2dhm s VAL 48 Cb -0.04 -0.36 -0.03 0.00 0.00 0.00 0.00 36.38 35.95 2dhm s VAL 48 CO 0.03 0.16 0.03 -0.69 0.00 0.00 0.00 175.10 174.64 2dhm s VAL 49 N 0.85 4.24 -0.22 2.92 1.01 0.82 -1.58 120.40 128.45 2dhm s VAL 49 Ca -0.10 -0.21 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 2dhm s VAL 49 Cb -0.13 -2.93 0.07 0.00 0.00 0.00 0.00 36.38 33.39 2dhm s VAL 49 CO -0.01 0.41 0.09 -0.22 0.00 0.00 0.00 175.10 175.37 2dhm s LEU 50 N 1.02 0.68 -0.22 3.92 0.20 -1.10 -2.48 118.68 120.70 2dhm s LEU 50 Ca 0.03 -0.90 -0.17 0.00 0.69 0.00 0.00 54.13 53.77 2dhm s LEU 50 Cb -0.14 -0.38 -0.03 0.00 -0.43 0.00 0.00 46.19 45.21 2dhm s LEU 50 CO 0.02 -0.37 0.48 -0.69 -0.29 0.00 0.00 176.35 175.50 2dhm s VAL 51 N 2.04 5.12 0.07 1.68 1.01 -1.24 -2.29 120.40 126.80 2dhm s VAL 51 Ca 0.04 0.85 -0.22 0.00 0.00 0.00 0.00 61.98 62.65 2dhm s VAL 51 Cb -0.16 -3.80 0.05 0.00 0.00 0.00 0.00 36.38 32.47 2dhm s VAL 51 CO -0.17 0.17 0.53 -0.55 0.00 0.00 0.00 175.10 175.07 2dhm s SER 52 N 1.28 -0.45 -0.08 3.32 0.15 0.90 -2.36 113.70 116.46 2dhm s SER 52 Ca 0.21 0.12 -0.01 0.00 0.70 0.00 0.00 55.95 56.97 2dhm s SER 52 Cb -0.15 0.51 -0.26 0.00 -1.71 0.00 0.00 66.02 64.41 2dhm s SER 52 CO 0.09 -0.78 0.54 -0.78 1.20 0.00 0.00 173.24 173.51 2dhm h ASP 53 N 2.60 0.30 -1.54 5.45 3.58 -1.94 -3.33 116.42 121.53 2dhm h ASP 53 Ca -0.32 -0.62 0.45 0.00 0.42 0.00 0.00 57.03 56.97 2dhm h ASP 53 Cb 1.23 -0.10 -0.07 0.00 1.72 0.00 0.00 39.33 42.11 2dhm h ASP 53 CO 0.41 1.55 1.10 0.54 -2.88 0.00 0.00 179.24 179.96 2dhm n ARG 54 N -3.36 -0.00 -0.82 0.28 5.12 -1.26 0.20 116.66 116.82 2dhm n ARG 54 Ca -0.25 0.89 -0.15 0.00 -1.93 0.00 0.00 57.85 56.41 2dhm n ARG 54 Cb 1.05 -2.02 0.05 0.00 -1.16 0.00 0.00 32.46 30.38 2dhm n ARG 54 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 2dhm n PHE 55 N -3.64 1.49 -3.32 -1.55 3.72 -1.26 -4.78 117.46 108.12 2dhm n PHE 55 Ca 0.36 -1.79 -0.41 0.00 -0.05 0.00 0.00 57.45 55.56 2dhm n PHE 55 Cb 1.59 -0.87 -0.09 0.00 -0.94 0.00 0.00 39.48 39.17 2dhm n PHE 55 CO 0.00 0.00 0.00 -0.08 -0.05 0.00 0.00 176.76 176.63 2dhm s THR 56 N -2.11 5.10 0.00 4.37 -1.32 0.54 -4.39 115.64 117.83 2dhm s THR 56 Ca 0.30 0.15 0.00 0.00 -1.21 0.00 0.00 61.69 60.92 2dhm s THR 56 Cb 0.23 -3.90 0.00 0.00 -1.51 0.00 0.00 72.50 67.32 2dhm s THR 56 CO 0.01 -0.17 0.00 0.61 -2.21 0.00 0.00 174.62 172.86 2dhm n GLY 57 N 4.89 1.72 3.08 6.08 0.00 -1.26 -5.00 105.19 114.70 2dhm n GLY 57 Ca -0.07 -0.28 -0.37 0.00 0.00 0.00 0.00 46.02 45.30 2dhm n GLY 57 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dhm n GLU 58 N 0.00 -0.24 -2.85 1.61 4.71 -1.26 -4.90 120.64 117.71 2dhm n GLU 58 Ca 0.00 -0.06 -0.36 0.00 -0.01 0.00 0.00 57.16 56.73 2dhm n GLU 58 Cb 0.00 -1.17 -0.07 0.00 -1.01 0.00 0.00 31.44 29.19 2dhm n GLU 58 CO 0.00 0.00 0.00 1.03 0.09 0.00 0.00 177.13 178.25 2dhm s ARG 59 N -2.35 4.42 0.22 3.49 0.52 -1.26 -4.91 118.95 119.09 2dhm s ARG 59 Ca 0.42 1.19 -0.09 0.00 -0.52 0.00 0.00 55.73 56.72 2dhm s ARG 59 Cb -0.05 -2.62 0.34 0.00 0.52 0.00 0.00 34.95 33.13 2dhm s ARG 59 CO 0.72 0.20 1.67 0.74 0.02 0.00 0.00 175.30 178.65 2dhm h PHE 60 N 2.81 0.05 0.50 -0.53 0.04 -1.98 0.14 116.94 117.97 2dhm h PHE 60 Ca -0.48 0.04 -0.02 0.00 2.80 0.00 0.00 57.97 60.31 2dhm h PHE 60 Cb 1.19 0.08 0.00 0.00 2.20 0.00 0.00 35.95 39.42 2dhm h PHE 60 CO 0.62 -0.14 -0.24 -0.07 -0.60 0.00 0.00 178.31 177.88 2dhm h LEU 61 N 0.16 -0.56 -1.30 1.54 3.38 -1.99 0.12 115.31 116.66 2dhm h LEU 61 Ca 0.34 -0.01 0.16 0.00 0.09 0.00 0.00 57.88 58.46 2dhm h LEU 61 Cb 0.56 0.15 -0.07 0.00 0.09 0.00 0.00 40.66 41.39 2dhm h LEU 61 CO -0.52 -0.36 0.58 -1.13 0.09 0.00 0.00 178.44 177.10 2dhm h ASN 62 N -0.72 0.63 0.30 -0.43 -1.24 -1.77 0.29 115.58 112.63 2dhm h ASN 62 Ca -0.07 0.05 -0.16 0.00 0.71 0.00 0.00 56.30 56.83 2dhm h ASN 62 Cb 0.54 -0.08 -0.01 0.00 0.73 0.00 0.00 38.32 39.50 2dhm h ASN 62 CO 0.11 0.30 -0.63 0.03 -1.29 0.00 0.00 177.43 175.95 2dhm h ARG 63 N 0.65 0.32 0.24 6.67 3.08 -0.42 -3.12 114.38 121.79 2dhm h ARG 63 Ca 0.46 -0.23 -0.01 0.00 0.07 0.00 0.00 59.98 60.28 2dhm h ARG 63 Cb 0.81 0.04 0.00 0.00 0.08 0.00 0.00 29.97 30.90 2dhm h ARG 63 CO -0.22 0.84 -0.11 0.45 -1.07 0.00 0.00 179.97 179.86 2dhm h HIS 64 N 0.23 -0.29 -0.99 3.04 3.86 0.12 -3.27 115.15 117.84 2dhm h HIS 64 Ca -0.01 -0.01 0.30 0.00 -1.16 0.00 0.00 60.37 59.49 2dhm h HIS 64 Cb 1.15 0.10 -0.18 0.00 1.06 0.00 0.00 27.41 29.54 2dhm h HIS 64 CO 0.03 -0.13 0.12 0.07 0.86 0.00 0.00 177.93 178.88 2dhm h ARG 65 N -1.07 0.01 -0.22 2.45 0.11 -0.66 0.44 114.38 115.43 2dhm h ARG 65 Ca -0.03 -0.00 0.06 0.00 0.10 0.00 0.00 59.98 60.10 2dhm h ARG 65 Cb 0.30 -0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.31 2dhm h ARG 65 CO 0.05 0.00 -0.18 0.52 0.10 0.00 0.00 179.97 180.47 2dhm h MET 66 N 0.01 -0.18 0.26 0.08 2.86 -1.64 0.15 114.93 116.48 2dhm h MET 66 Ca 0.65 0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 58.29 2dhm h MET 66 Cb 1.42 0.04 -0.01 0.00 0.06 0.00 0.00 31.60 33.11 2dhm h MET 66 CO -0.90 -0.12 -0.23 0.82 1.06 0.00 0.00 176.91 177.54 2dhm h ILE 67 N -0.18 0.00 -0.32 -1.22 1.08 -0.19 -2.92 117.51 113.77 2dhm h ILE 67 Ca 0.13 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.65 2dhm h ILE 67 Cb 0.38 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 34.05 2dhm h ILE 67 CO -0.33 0.00 -0.48 1.88 -0.69 0.00 0.00 178.15 178.53 2dhm h TYR 68 N -0.49 -1.43 -0.76 1.37 0.05 -1.33 -0.10 116.97 114.28 2dhm h TYR 68 Ca -0.03 0.07 0.27 0.00 0.05 0.00 0.00 58.73 59.09 2dhm h TYR 68 Cb 0.41 0.67 -0.14 0.00 1.01 0.00 0.00 36.73 38.68 2dhm h TYR 68 CO -0.11 -0.48 0.24 0.45 -1.05 0.00 0.00 178.16 177.21 2dhm n SER 69 N -5.41 0.11 0.44 3.88 2.88 0.52 0.23 113.62 116.27 2dhm n SER 69 Ca -0.03 1.28 -0.17 0.00 -1.33 0.00 0.00 58.87 58.62 2dhm n SER 69 Cb 0.36 -0.56 -0.08 0.00 -0.75 0.00 0.00 64.21 63.18 2dhm n SER 69 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2dhm h THR 70 N 0.00 0.00 -1.00 2.46 2.02 -0.81 -3.17 112.91 112.41 2dhm h THR 70 Ca 0.57 -0.10 -0.59 0.00 0.77 0.00 0.00 66.41 67.06 2dhm h THR 70 Cb 1.39 0.00 -0.30 0.00 -1.74 0.00 0.00 68.15 67.50 2dhm h THR 70 CO -0.65 0.00 0.76 0.18 0.37 0.00 0.00 175.52 176.18 2dhm n LEU 71 N -5.34 7.19 -0.21 2.58 4.77 0.12 -4.74 117.00 121.37 2dhm n LEU 71 Ca -0.14 -3.92 -0.09 0.00 -0.03 0.00 0.00 56.01 51.83 2dhm n LEU 71 Cb 0.45 -0.90 -0.07 0.00 -2.33 0.00 0.00 43.42 40.57 2dhm n LEU 71 CO 0.34 1.24 0.49 0.00 -1.33 0.00 0.00 177.39 178.13 2dhm h ALA 72 N 1.46 -0.50 0.11 -1.18 0.00 0.29 -2.35 119.26 117.09 2dhm h ALA 72 Ca 0.63 0.05 -0.32 0.00 0.00 0.00 0.00 54.91 55.26 2dhm h ALA 72 Cb 1.93 1.15 -0.01 0.00 0.00 0.00 0.00 17.79 20.86 2dhm h ALA 72 CO 1.33 -0.75 -1.73 0.93 0.00 0.00 0.00 179.25 179.04 2dhm h GLU 73 N -0.12 0.23 -0.73 0.00 5.08 -1.85 -3.35 114.58 113.83 2dhm h GLU 73 Ca 0.09 -0.39 0.31 0.00 -1.00 0.00 0.00 59.36 58.36 2dhm h GLU 73 Cb 0.35 0.15 -0.13 0.00 0.50 0.00 0.00 28.75 29.61 2dhm h GLU 73 CO -0.56 1.19 0.39 0.39 -1.00 0.00 0.00 179.01 179.42 2dhm n GLU 74 N -3.75 -0.04 0.05 2.33 -0.58 -1.18 0.56 120.64 118.02 2dhm n GLU 74 Ca -0.30 1.01 -0.09 0.00 -0.42 0.00 0.00 57.16 57.36 2dhm n GLU 74 Cb 0.96 -1.81 -0.06 0.00 -0.57 0.00 0.00 31.44 29.95 2dhm n GLU 74 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2dhm h LEU 75 N 0.00 -0.19 -1.83 -4.62 3.38 -1.58 -3.24 115.31 107.22 2dhm h LEU 75 Ca 0.62 -0.29 0.37 0.00 0.09 0.00 0.00 57.88 58.67 2dhm h LEU 75 Cb 1.64 0.05 -0.07 0.00 0.09 0.00 0.00 40.66 42.37 2dhm h LEU 75 CO -0.56 0.37 0.89 0.28 0.09 0.00 0.00 178.44 179.51 2dhm h SER 76 N -0.95 0.10 -0.47 -0.43 0.02 0.24 0.98 113.55 113.05 2dhm h SER 76 Ca -0.02 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.00 2dhm h SER 76 Cb 0.47 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.96 2dhm h SER 76 CO 0.04 -0.00 -0.28 0.41 -1.14 0.00 0.00 176.83 175.86 2dhm n THR 77 N -4.28 -0.32 0.00 -2.27 -1.04 -0.12 -3.95 114.28 102.31 2dhm n THR 77 Ca 0.29 1.47 0.00 0.00 -2.04 0.00 0.00 64.05 63.77 2dhm n THR 77 Cb 1.29 -1.85 0.00 0.00 -1.82 0.00 0.00 70.33 67.95 2dhm n THR 77 CO 0.00 0.00 0.00 1.07 -0.64 0.00 0.00 175.07 175.50 2dhm n THR 78 N -4.18 0.00 -3.31 12.58 5.66 -0.94 -5.06 114.28 119.02 2dhm n THR 78 Ca 0.01 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.68 2dhm n THR 78 Cb 0.12 -0.63 -0.06 0.00 -1.55 0.00 0.00 70.33 68.22 2dhm n THR 78 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 2dhm s VAL 79 N -1.79 4.83 -0.09 1.08 1.01 0.30 -5.00 120.40 120.72 2dhm s VAL 79 Ca 0.00 0.74 -0.02 0.00 0.00 0.00 0.00 61.98 62.70 2dhm s VAL 79 Cb 0.00 -3.67 -0.05 0.00 0.00 0.00 0.00 36.38 32.66 2dhm s VAL 79 CO 0.00 0.02 -0.10 0.00 0.00 0.00 0.00 175.10 175.02 2dhm n HIS 80 N 0.17 0.00 -4.59 5.22 -0.00 -1.26 -2.91 115.22 111.85 2dhm n HIS 80 Ca -0.01 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.39 2dhm n HIS 80 Cb 0.52 -0.35 -0.11 0.00 -0.00 0.00 0.00 29.99 30.05 2dhm n HIS 80 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2dhm s ALA 81 N -2.18 2.83 -0.26 1.59 0.00 -1.26 -4.92 121.76 117.56 2dhm s ALA 81 Ca -0.13 -1.06 -0.11 0.00 0.00 0.00 0.00 51.96 50.66 2dhm s ALA 81 Cb 0.04 -0.99 0.10 0.00 0.00 0.00 0.00 23.12 22.28 2dhm s ALA 81 CO 0.19 0.59 0.59 -1.17 0.00 0.00 0.00 175.76 175.96 2dhm s LEU 82 N -1.31 -0.89 -0.55 0.00 2.96 -1.26 -3.98 118.68 113.64 2dhm s LEU 82 Ca 0.15 1.38 -0.20 0.00 -0.22 0.00 0.00 54.13 55.24 2dhm s LEU 82 Cb -0.11 2.04 0.07 0.00 0.50 0.00 0.00 46.19 48.70 2dhm s LEU 82 CO 0.06 -0.22 0.73 0.00 -1.32 0.00 0.00 176.35 175.59 2dhm s ALA 83 N 2.37 3.33 0.23 5.97 0.00 -0.37 -4.96 121.76 128.33 2dhm s ALA 83 Ca -0.07 -1.82 -0.30 0.00 0.00 0.00 0.00 51.96 49.78 2dhm s ALA 83 Cb -0.10 -3.51 -0.09 0.00 0.00 0.00 0.00 23.12 19.42 2dhm s ALA 83 CO -0.17 -2.25 1.14 -0.51 0.00 0.00 0.00 175.76 173.97 2dhm s LEU 84 N 3.00 4.50 -0.54 0.00 1.43 -1.26 -2.84 118.68 122.97 2dhm s LEU 84 Ca 0.17 2.24 0.04 0.00 -1.03 0.00 0.00 54.13 55.55 2dhm s LEU 84 Cb -0.19 -3.62 0.17 0.00 0.03 0.00 0.00 46.19 42.58 2dhm s LEU 84 CO 0.11 -0.25 0.41 -1.00 0.23 0.00 0.00 176.35 175.85 2dhm s HIS 85 N -0.62 2.18 -0.33 0.29 3.76 -0.62 -4.96 115.29 114.99 2dhm s HIS 85 Ca 0.48 -2.77 -0.22 0.00 -0.15 0.00 0.00 55.06 52.40 2dhm s HIS 85 Cb -0.32 -1.70 0.00 0.00 1.11 0.00 0.00 32.58 31.68 2dhm s HIS 85 CO 0.39 -0.70 0.72 0.95 -0.85 0.00 0.00 174.74 175.25 2dhm s THR 86 N -0.61 4.83 0.37 1.30 -4.23 -1.26 -2.70 115.64 113.33 2dhm s THR 86 Ca 0.29 0.92 0.08 0.00 -1.18 0.00 0.00 61.69 61.80 2dhm s THR 86 Cb 0.00 -4.12 -0.07 0.00 1.34 0.00 0.00 72.50 69.65 2dhm s THR 86 CO -0.19 -0.29 -0.03 -0.31 -0.54 0.00 0.00 174.62 173.27 2dhm s TYR 87 N 2.88 2.40 0.54 3.99 1.51 -0.97 -4.99 117.35 122.69 2dhm s TYR 87 Ca 0.29 -0.63 0.07 0.00 -1.01 0.00 0.00 57.07 55.79 2dhm s TYR 87 Cb -0.14 -1.55 0.07 0.00 -0.11 0.00 0.00 41.96 40.23 2dhm s TYR 87 CO 0.14 0.45 0.61 0.25 -1.11 0.00 0.00 175.55 175.89 2dhm n THR 88 N -0.86 0.00 -0.07 -0.71 -2.24 -1.25 -0.07 114.28 109.08 2dhm n THR 88 Ca -0.05 -1.92 -0.15 0.00 -2.27 0.00 0.00 64.05 59.66 2dhm n THR 88 Cb 0.65 -0.35 -0.05 0.00 -2.10 0.00 0.00 70.33 68.49 2dhm n THR 88 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2dhm h ILE 89 N 0.32 1.29 0.04 2.28 5.03 -1.94 -2.91 117.51 121.63 2dhm h ILE 89 Ca -0.29 -1.70 -0.00 0.00 -0.12 0.00 0.00 64.86 62.75 2dhm h ILE 89 Cb 1.19 1.73 0.00 0.00 -3.03 0.00 0.00 36.82 36.71 2dhm h ILE 89 CO 0.43 0.55 -0.02 0.11 -0.68 0.00 0.00 178.15 178.53 2dhm h LYS 90 N 0.53 -0.06 -0.90 2.37 6.56 -1.96 0.15 116.57 123.26 2dhm h LYS 90 Ca 0.01 0.00 0.28 0.00 -1.06 0.00 0.00 60.65 59.88 2dhm h LYS 90 Cb 1.11 0.01 -0.17 0.00 -0.57 0.00 0.00 32.23 32.62 2dhm h LYS 90 CO 0.11 -0.04 0.14 0.39 -2.06 0.00 0.00 179.45 178.00 2dhm n GLU 91 N -2.26 -0.07 -0.04 3.15 4.71 -1.26 0.92 120.64 125.79 2dhm n GLU 91 Ca -0.01 1.32 -0.15 0.00 -0.01 0.00 0.00 57.16 58.32 2dhm n GLU 91 Cb 0.02 -2.17 -0.08 0.00 -1.01 0.00 0.00 31.44 28.20 2dhm n GLU 91 CO 0.00 0.00 0.00 2.35 0.09 0.00 0.00 177.13 179.57 2dhm h TRP 92 N 0.00 0.57 -0.51 -0.32 -0.00 -1.58 1.23 115.95 115.34 2dhm h TRP 92 Ca 0.61 -0.23 0.15 0.00 -0.00 0.00 0.00 58.89 59.41 2dhm h TRP 92 Cb 1.37 -0.10 -0.02 0.00 -0.00 0.00 0.00 29.16 30.41 2dhm h TRP 92 CO -0.34 0.97 0.91 0.93 -0.00 0.00 0.00 178.44 180.91 2dhm h GLU 93 N 0.01 0.00 0.00 2.65 4.39 0.35 -3.22 114.58 118.76 2dhm h GLU 93 Ca -0.01 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.59 2dhm h GLU 93 Cb 0.99 0.00 -0.10 0.00 -0.10 0.00 0.00 28.75 29.54 2dhm h GLU 93 CO 0.08 0.00 0.14 0.41 -1.16 0.00 0.00 179.01 178.47 2dhm n GLY 94 N -1.55 -1.53 0.33 -3.84 0.00 -1.00 -5.03 105.19 92.57 2dhm n GLY 94 Ca 0.11 0.78 0.02 0.00 0.00 0.00 0.00 46.02 46.93 2dhm n GLY 94 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2dhm n LEU 95 N 0.33 -0.46 -3.84 0.99 7.94 0.42 -4.72 117.00 117.66 2dhm n LEU 95 Ca -0.10 1.54 -0.26 0.00 -1.11 0.00 0.00 56.01 56.08 2dhm n LEU 95 Cb 0.74 -0.40 -0.07 0.00 0.53 0.00 0.00 43.42 44.22 2dhm n LEU 95 CO -0.12 -1.43 -0.29 1.67 -1.11 0.00 0.00 177.39 176.12 2dhm n GLN 96 N -5.37 -0.91 -3.79 1.96 -0.06 -1.26 0.53 117.38 108.48 2dhm n GLN 96 Ca 0.11 0.08 -0.25 0.00 -2.00 0.00 0.00 57.00 54.94 2dhm n GLN 96 Cb 0.40 -2.93 -0.07 0.00 -4.06 0.00 0.00 30.24 23.58 2dhm n GLN 96 CO 0.00 0.00 0.00 -3.47 -0.20 0.00 0.00 177.06 173.39 2dhm n ASP 97 N -1.96 0.15 -3.60 1.69 2.03 -1.26 -4.85 116.55 108.75 2dhm n ASP 97 Ca -0.15 -0.92 -0.11 0.00 0.52 0.00 0.00 54.79 54.13 2dhm n ASP 97 Cb 0.47 -1.15 -0.06 0.00 -0.72 0.00 0.00 41.12 39.66 2dhm n ASP 97 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2dhm s THR 98 N -3.63 0.00 -0.10 5.18 2.01 0.19 -5.15 115.64 114.13 2dhm s THR 98 Ca 0.16 0.00 -0.23 0.00 0.31 0.00 0.00 61.69 61.94 2dhm s THR 98 Cb -0.10 -1.00 -0.03 0.00 0.01 0.00 0.00 72.50 71.38 2dhm s THR 98 CO 0.73 0.00 0.68 -0.69 -0.69 0.00 0.00 174.62 174.65 2dhm s VAL 99 N -0.43 5.05 -0.22 3.82 1.01 -1.26 -4.70 120.40 123.67 2dhm s VAL 99 Ca -0.01 1.37 -0.29 0.00 0.00 0.00 0.00 61.98 63.05 2dhm s VAL 99 Cb -0.03 -4.01 -0.02 0.00 0.00 0.00 0.00 36.38 32.33 2dhm s VAL 99 CO -0.00 0.22 1.40 0.12 0.00 0.00 0.00 175.10 176.84 2dhm s PHE 100 N 1.04 2.51 0.48 5.22 2.19 -1.26 -4.98 117.98 123.19 2dhm s PHE 100 Ca 0.35 0.76 -0.23 0.00 0.33 0.00 0.00 56.93 58.14 2dhm s PHE 100 Cb -0.17 -3.81 -0.07 0.00 -1.31 0.00 0.00 43.02 37.66 2dhm s PHE 100 CO 0.16 -2.23 1.28 0.00 1.83 0.00 0.00 175.22 176.26 2dhm s ALA 101 N 4.30 2.97 0.62 11.12 0.00 -1.26 -4.98 121.76 134.53 2dhm s ALA 101 Ca 0.61 1.17 -0.17 0.00 0.00 0.00 0.00 51.96 53.58 2dhm s ALA 101 Cb -0.22 -3.49 -0.02 0.00 0.00 0.00 0.00 23.12 19.39 2dhm s ALA 101 CO 0.23 -1.00 1.13 -1.12 0.00 0.00 0.00 175.76 174.99 2dhm s SER 102 N -1.04 5.30 0.47 0.00 0.01 -1.26 -5.00 113.70 112.18 2dhm s SER 102 Ca 0.65 2.10 -0.22 0.00 1.31 0.00 0.00 55.95 59.79 2dhm s SER 102 Cb -0.36 -2.57 -0.07 0.00 0.21 0.00 0.00 66.02 63.24 2dhm s SER 102 CO 0.43 -1.50 1.16 -2.16 0.41 0.00 0.00 173.24 171.58 2dhm s PRO 103 N -3.75 3.70 0.16 12.44 0.04 -1.26 -4.93 135.00 141.40 2dhm s PRO 103 Ca 0.70 1.75 0.20 0.00 0.04 0.00 0.00 61.00 63.69 2dhm s PRO 103 Cb -0.23 -2.35 0.84 0.00 0.04 0.00 0.00 34.50 32.80 2dhm s PRO 103 CO 0.36 -0.59 1.61 -0.35 0.04 0.00 0.00 177.00 178.07 2dhm n PRO 104 N -0.59 0.12 -1.45 0.56 -0.04 -1.26 -4.77 135.00 127.56 2dhm n PRO 104 Ca 0.08 0.36 -0.48 0.00 -0.04 0.00 0.00 63.50 63.42 2dhm n PRO 104 Cb 0.48 -1.73 -0.08 0.00 -0.04 0.00 0.00 33.50 32.13 2dhm n PRO 104 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2dhm s ARG 106 N 6.98 1.01 0.00 0.00 0.52 -1.26 -5.23 118.95 120.96 2dhm s ARG 106 Ca 1.13 -0.93 0.00 0.00 -0.52 0.00 0.00 55.73 55.41 2dhm s ARG 106 Cb -0.88 -2.10 0.00 0.00 0.52 0.00 0.00 34.95 32.48 2dhm s ARG 106 CO 0.47 -2.02 0.00 0.41 0.02 0.00 0.00 175.30 174.18