#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 0.69 0.28 1.61 1.04 -1.26 -5.15 113.70 110.91 2dhm s SER 2 Ca 0.00 -0.09 -0.07 0.00 0.48 0.00 0.00 55.95 56.26 2dhm s SER 2 Cb 0.00 -0.25 -0.00 0.00 0.10 0.00 0.00 66.02 65.87 2dhm s SER 2 CO 0.00 -0.02 0.44 -0.44 0.98 0.00 0.00 173.24 174.20 2dhm s SER 3 N 0.53 0.33 0.11 7.02 0.01 -1.26 -5.19 113.70 115.26 2dhm s SER 3 Ca -0.06 -1.21 -0.14 0.00 1.31 0.00 0.00 55.95 55.85 2dhm s SER 3 Cb -0.10 0.60 0.02 0.00 0.21 0.00 0.00 66.02 66.75 2dhm s SER 3 CO -0.00 -1.18 0.34 -0.83 0.41 0.00 0.00 173.24 171.98 2dhm s GLY 4 N -3.12 -0.16 0.31 3.44 0.00 -1.26 -5.18 107.32 101.35 2dhm s GLY 4 Ca 0.28 -0.22 0.05 0.00 0.00 0.00 0.00 44.72 44.82 2dhm s GLY 4 CO 0.14 -0.46 -0.00 -0.56 0.00 0.00 0.00 173.10 172.22 2dhm s SER 5 N -2.82 2.69 -0.26 1.64 0.01 -1.26 -5.16 113.70 108.54 2dhm s SER 5 Ca 0.04 -1.29 -0.13 0.00 1.31 0.00 0.00 55.95 55.87 2dhm s SER 5 Cb 0.03 -0.15 0.09 0.00 0.21 0.00 0.00 66.02 66.19 2dhm s SER 5 CO -0.12 -0.47 0.63 -0.55 0.41 0.00 0.00 173.24 173.14 2dhm s SER 6 N -3.49 -0.89 0.00 2.44 0.15 -1.26 -5.07 113.70 105.58 2dhm s SER 6 Ca 0.33 1.41 0.00 0.00 0.70 0.00 0.00 55.95 58.39 2dhm s SER 6 Cb 0.07 1.49 0.00 0.00 -1.71 0.00 0.00 66.02 65.87 2dhm s SER 6 CO 0.14 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.96 2dhm n GLY 7 N 4.61 0.40 2.13 9.45 0.00 -1.26 -5.01 105.19 115.50 2dhm n GLY 7 Ca -0.18 -0.28 -0.17 0.00 0.00 0.00 0.00 46.02 45.39 2dhm n GLY 7 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2dhm n MET 8 N 0.00 2.26 -0.85 1.61 0.00 -1.26 -4.77 117.12 114.11 2dhm n MET 8 Ca 0.00 -1.40 -0.30 0.00 0.00 0.00 0.00 57.70 56.01 2dhm n MET 8 Cb 0.00 -2.10 0.18 0.00 0.00 0.00 0.00 33.22 31.30 2dhm n MET 8 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 2dhm s MET 9 N 0.53 0.61 0.29 0.03 1.00 -1.26 -4.51 119.30 116.00 2dhm s MET 9 Ca 0.65 1.09 -0.02 0.00 0.00 0.00 0.00 55.69 57.41 2dhm s MET 9 Cb 0.32 -1.71 0.62 0.00 0.00 0.00 0.00 34.83 34.06 2dhm s MET 9 CO -0.05 -2.76 1.54 -0.89 0.00 0.00 0.00 175.02 172.86 2dhm n ILE 10 N -4.27 -0.41 -0.07 2.53 2.08 -1.26 -0.17 119.36 117.78 2dhm n ILE 10 Ca 0.08 2.20 -0.10 0.00 0.56 0.00 0.00 62.75 65.48 2dhm n ILE 10 Cb 0.54 -3.14 -0.04 0.00 -0.75 0.00 0.00 39.64 36.25 2dhm n ILE 10 CO 0.00 0.00 0.00 -0.09 0.56 0.00 0.00 176.55 177.02 2dhm h ARG 11 N 0.00 -0.36 -0.39 0.38 2.43 -1.96 0.11 114.38 114.60 2dhm h ARG 11 Ca 0.54 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.78 2dhm h ARG 11 Cb 1.01 0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 30.60 2dhm h ARG 11 CO -0.96 -0.24 0.16 0.93 -1.51 0.00 0.00 179.97 178.35 2dhm h GLU 12 N -0.37 0.32 -0.34 0.20 5.08 -0.86 -1.80 114.58 116.81 2dhm h GLU 12 Ca 0.12 -0.02 0.06 0.00 -1.00 0.00 0.00 59.36 58.53 2dhm h GLU 12 Cb 0.58 -0.07 -0.06 0.00 0.50 0.00 0.00 28.75 29.70 2dhm h GLU 12 CO -0.48 0.21 -0.02 0.00 -1.00 0.00 0.00 179.01 177.71 2dhm h ARG 13 N 0.33 0.07 0.00 2.33 3.08 -0.30 0.37 114.38 120.25 2dhm h ARG 13 Ca 0.17 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2dhm h ARG 13 Cb 0.13 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.17 2dhm h ARG 13 CO -0.16 0.04 0.00 -0.89 -1.07 0.00 0.00 179.97 177.90 2dhm n ILE 14 N -5.20 0.00 -0.23 2.04 5.41 0.27 -3.11 119.36 118.55 2dhm n ILE 14 Ca 0.01 1.33 -0.02 0.00 1.00 0.00 0.00 62.75 65.07 2dhm n ILE 14 Cb 0.18 -2.32 0.04 0.00 -0.71 0.00 0.00 39.64 36.83 2dhm n ILE 14 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2dhm h GLU 15 N 0.00 -0.09 -0.74 0.38 5.08 -1.36 0.69 114.58 118.55 2dhm h GLU 15 Ca 0.00 0.01 0.26 0.00 -1.00 0.00 0.00 59.36 58.62 2dhm h GLU 15 Cb 0.00 0.02 -0.14 0.00 0.50 0.00 0.00 28.75 29.13 2dhm h GLU 15 CO 0.00 -0.06 0.21 0.39 -1.00 0.00 0.00 179.01 178.55 2dhm n GLU 16 N -5.45 -0.05 0.02 2.33 -0.58 0.13 -0.60 120.64 116.44 2dhm n GLU 16 Ca 0.07 1.07 -0.01 0.00 -0.42 0.00 0.00 57.16 57.86 2dhm n GLU 16 Cb 0.36 -1.81 -0.01 0.00 -0.57 0.00 0.00 31.44 29.42 2dhm n GLU 16 CO 0.00 0.00 0.00 0.87 -0.48 0.00 0.00 177.13 177.52 2dhm h LYS 17 N 0.00 -0.07 -0.77 3.49 1.57 -0.80 -3.33 116.57 116.66 2dhm h LYS 17 Ca 0.54 0.00 0.22 0.00 -1.87 0.00 0.00 60.65 59.54 2dhm h LYS 17 Cb 1.30 0.02 -0.14 0.00 0.08 0.00 0.00 32.23 33.48 2dhm h LYS 17 CO -0.64 -0.05 0.04 1.28 -0.57 0.00 0.00 179.45 179.51 2dhm n LEU 18 N -2.53 -0.07 -0.39 2.94 4.77 -0.34 0.30 117.00 121.67 2dhm n LEU 18 Ca -0.01 1.31 -0.08 0.00 -0.03 0.00 0.00 56.01 57.20 2dhm n LEU 18 Cb 0.03 -0.49 -0.06 0.00 -2.33 0.00 0.00 43.42 40.57 2dhm n LEU 18 CO 0.02 -1.34 0.48 0.54 -1.33 0.00 0.00 177.39 175.76 2dhm n ARG 19 N -5.07 -0.37 0.08 3.23 5.12 0.24 -0.34 116.66 119.54 2dhm n ARG 19 Ca 0.19 1.45 0.12 0.00 -1.93 0.00 0.00 57.85 57.67 2dhm n ARG 19 Cb 0.62 -2.13 0.08 0.00 -1.16 0.00 0.00 32.46 29.87 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 0.67 0.53 0.82 7.54 0.00 -0.60 -2.14 119.26 126.08 2dhm h ALA 20 Ca 0.19 0.00 -0.04 0.00 0.00 0.00 0.00 54.91 55.06 2dhm h ALA 20 Cb 0.43 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.23 2dhm h ALA 20 CO -0.91 0.00 -0.39 0.00 0.00 0.00 0.00 179.25 177.95 2dhm h ALA 21 N 2.28 -1.10 0.00 0.00 0.00 0.29 -3.40 119.26 117.32 2dhm h ALA 21 Ca 0.00 -0.25 -0.14 0.00 0.00 0.00 0.00 54.91 54.52 2dhm h ALA 21 Cb 0.86 0.43 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 2dhm h ALA 21 CO 0.00 -1.05 -1.53 1.19 0.00 0.00 0.00 179.25 177.86 2dhm n PHE 22 N -5.52 0.00 -2.53 0.00 3.72 0.15 -5.02 117.46 108.26 2dhm n PHE 22 Ca -0.14 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.19 2dhm n PHE 22 Cb 0.44 -0.37 0.04 0.00 -0.94 0.00 0.00 39.48 38.65 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 -2.63 -2.43 -0.26 -1.08 6.02 -0.80 -5.05 117.38 111.14 2dhm n GLN 23 Ca -0.15 0.37 -0.07 0.00 -0.01 0.00 0.00 57.00 57.13 2dhm n GLN 23 Cb 0.70 -3.82 0.06 0.00 1.02 0.00 0.00 30.24 28.20 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 -2.32 -1.56 -0.10 -1.09 -0.04 -1.26 -5.02 135.00 123.62 2dhm n PRO 24 Ca -0.10 -0.44 -0.19 0.00 -0.04 0.00 0.00 63.50 62.73 2dhm n PRO 24 Cb 0.57 -0.41 -0.13 0.00 -0.04 0.00 0.00 33.50 33.49 2dhm n PRO 24 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 2dhm n VAL 25 N -3.10 1.57 -4.43 0.52 3.14 -0.91 -4.96 118.33 110.15 2dhm n VAL 25 Ca 0.04 -0.59 -0.31 0.00 -2.96 0.00 0.00 64.34 60.51 2dhm n VAL 25 Cb 0.15 -1.50 -0.10 0.00 -1.06 0.00 0.00 33.84 31.32 2dhm n VAL 25 CO 0.00 0.00 0.00 0.12 -6.46 0.00 0.00 176.83 170.49 2dhm s PHE 26 N -2.53 2.83 -0.21 1.45 5.36 -1.19 -5.00 117.98 118.68 2dhm s PHE 26 Ca -0.32 -0.09 -0.10 0.00 -0.96 0.00 0.00 56.93 55.47 2dhm s PHE 26 Cb 0.08 -1.56 0.08 0.00 -0.34 0.00 0.00 43.02 41.29 2dhm s PHE 26 CO 0.64 0.37 0.48 -1.17 -1.46 0.00 0.00 175.22 174.09 2dhm s LEU 27 N -1.61 -0.50 -0.29 6.12 2.96 -1.26 -2.99 118.68 121.11 2dhm s LEU 27 Ca 0.18 1.09 -0.15 0.00 -0.22 0.00 0.00 54.13 55.03 2dhm s LEU 27 Cb -0.11 1.61 0.13 0.00 0.50 0.00 0.00 46.19 48.32 2dhm s LEU 27 CO 0.09 -0.22 0.84 -0.70 -1.32 0.00 0.00 176.35 175.04 2dhm s GLU 28 N 1.94 0.49 -0.11 1.98 2.12 -0.80 -5.03 118.70 119.29 2dhm s GLU 28 Ca -0.07 0.99 0.03 0.00 0.36 0.00 0.00 54.97 56.28 2dhm s GLU 28 Cb -0.09 0.34 0.00 0.00 0.26 0.00 0.00 34.13 34.64 2dhm s GLU 28 CO -0.15 -0.13 -0.22 0.08 -0.54 0.00 0.00 175.26 174.31 2dhm s VAL 29 N 1.99 1.92 -0.44 3.70 1.01 -1.26 -0.28 120.40 127.04 2dhm s VAL 29 Ca -0.07 -0.93 -0.17 0.00 0.00 0.00 0.00 61.98 60.82 2dhm s VAL 29 Cb -0.06 -1.68 0.03 0.00 0.00 0.00 0.00 36.38 34.67 2dhm s VAL 29 CO -0.18 0.53 0.42 -0.69 0.00 0.00 0.00 175.10 175.18 2dhm s VAL 30 N 0.52 5.13 0.30 2.92 1.01 -0.31 -5.03 120.40 124.94 2dhm s VAL 30 Ca -0.15 -0.55 -0.13 0.00 0.00 0.00 0.00 61.98 61.15 2dhm s VAL 30 Cb -0.17 -4.06 -0.08 0.00 0.00 0.00 0.00 36.38 32.07 2dhm s VAL 30 CO 0.05 -0.46 0.68 -1.81 0.00 0.00 0.00 175.10 173.57 2dhm s ASP 31 N 1.99 6.72 -1.18 3.32 1.11 -1.26 -3.33 116.67 124.04 2dhm s ASP 31 Ca 0.10 1.17 -0.09 0.00 0.18 0.00 0.00 52.55 53.91 2dhm s ASP 31 Cb -0.19 -2.33 0.23 0.00 1.07 0.00 0.00 42.92 41.70 2dhm s ASP 31 CO 0.12 -0.18 1.50 -1.84 1.18 0.00 0.00 175.17 175.95 2dhm n GLU 32 N -0.34 3.74 -2.35 8.23 0.00 -1.26 -4.99 120.64 123.67 2dhm n GLU 32 Ca 0.03 -4.06 -0.36 0.00 0.00 0.00 0.00 57.16 52.77 2dhm n GLU 32 Cb 0.53 -2.78 -0.02 0.00 0.00 0.00 0.00 31.44 29.18 2dhm n GLU 32 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2dhm s SER 33 N 0.86 6.22 -0.22 -1.84 0.15 -1.26 -4.96 113.70 112.65 2dhm s SER 33 Ca 0.37 2.18 -0.02 0.00 0.70 0.00 0.00 55.95 59.18 2dhm s SER 33 Cb 0.01 -2.59 0.07 0.00 -1.71 0.00 0.00 66.02 61.79 2dhm s SER 33 CO 0.01 -0.88 0.02 -0.72 1.20 0.00 0.00 173.24 172.88 2dhm s TYR 34 N -1.66 1.41 -0.03 3.44 1.13 -1.26 -5.02 117.35 115.36 2dhm s TYR 34 Ca 0.65 -1.17 -0.25 0.00 -1.41 0.00 0.00 57.07 54.89 2dhm s TYR 34 Cb -0.25 -1.24 -0.19 0.00 -1.10 0.00 0.00 41.96 39.18 2dhm s TYR 34 CO 0.30 -0.68 1.13 0.00 -2.51 0.00 0.00 175.55 173.79 2dhm h ARG 35 N 8.16 -0.10 -6.15 -3.49 2.47 -1.97 -3.41 114.38 109.90 2dhm h ARG 35 Ca -0.16 0.01 -0.59 0.00 -1.26 0.00 0.00 59.98 57.98 2dhm h ARG 35 Cb 1.09 0.02 -0.10 0.00 -1.65 0.00 0.00 29.97 29.33 2dhm h ARG 35 CO 0.37 0.38 0.71 -1.01 0.56 0.00 0.00 179.97 180.98 2dhm s HIS 36 N -3.96 2.75 0.27 3.04 3.76 -1.26 -4.92 115.29 114.98 2dhm s HIS 36 Ca -0.15 0.19 -0.07 0.00 -0.15 0.00 0.00 55.06 54.88 2dhm s HIS 36 Cb 0.01 -4.21 0.47 0.00 1.11 0.00 0.00 32.58 29.96 2dhm s HIS 36 CO 0.61 -1.40 1.58 -0.91 -0.85 0.00 0.00 174.74 173.77 2dhm h ASN 37 N 9.36 -0.75 -3.55 1.40 2.35 -2.04 -3.41 115.58 118.93 2dhm h ASN 37 Ca -0.25 0.27 -0.57 0.00 -0.55 0.00 0.00 56.30 55.20 2dhm h ASN 37 Cb 1.07 0.54 0.17 0.00 0.05 0.00 0.00 38.32 40.14 2dhm h ASN 37 CO 1.11 -0.30 0.08 1.33 -1.65 0.00 0.00 177.43 178.00 2dhm n VAL 38 N -5.55 3.67 -2.05 2.81 0.24 -1.26 -4.83 118.33 111.37 2dhm n VAL 38 Ca 0.16 -0.50 -0.29 0.00 -2.04 0.00 0.00 64.34 61.67 2dhm n VAL 38 Cb 0.52 -1.10 -0.05 0.00 -1.47 0.00 0.00 33.84 31.74 2dhm n VAL 38 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 2dhm s PRO 39 N -2.75 2.57 0.42 7.34 0.04 -1.26 -4.96 135.00 136.40 2dhm s PRO 39 Ca 0.76 -0.10 -0.03 0.00 0.04 0.00 0.00 61.00 61.67 2dhm s PRO 39 Cb -0.41 -4.92 0.09 0.00 0.04 0.00 0.00 34.50 29.29 2dhm s PRO 39 CO 0.47 -3.25 0.57 0.00 0.04 0.00 0.00 177.00 174.83 2dhm n ALA 40 N 13.73 -0.22 -2.67 8.56 0.00 -1.26 -5.00 120.51 133.65 2dhm n ALA 40 Ca 0.36 -0.95 -0.41 0.00 0.00 0.00 0.00 53.44 52.44 2dhm n ALA 40 Cb 0.48 0.09 0.02 0.00 0.00 0.00 0.00 19.45 20.04 2dhm n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dhm n GLY 41 N 0.92 6.08 3.02 0.00 0.00 -1.26 -4.93 105.19 109.03 2dhm n GLY 41 Ca 0.08 -2.59 -0.31 0.00 0.00 0.00 0.00 46.02 43.20 2dhm n GLY 41 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dhm s SER 42 N -1.38 3.91 -0.40 1.61 0.15 -1.26 -5.07 113.70 111.27 2dhm s SER 42 Ca 0.38 -1.15 -0.39 0.00 0.70 0.00 0.00 55.95 55.50 2dhm s SER 42 Cb 0.18 -1.37 -0.14 0.00 -1.71 0.00 0.00 66.02 62.98 2dhm s SER 42 CO -0.11 -0.17 2.15 -0.62 1.20 0.00 0.00 173.24 175.68 2dhm n GLU 43 N 4.57 0.70 -3.65 5.44 1.02 -1.26 -4.88 120.64 122.58 2dhm n GLU 43 Ca -0.14 0.20 -0.38 0.00 -0.02 0.00 0.00 57.16 56.81 2dhm n GLU 43 Cb 0.44 -2.11 -0.08 0.00 -0.02 0.00 0.00 31.44 29.67 2dhm n GLU 43 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 2dhm s SER 44 N 6.66 5.54 0.16 1.62 1.04 -1.26 -5.04 113.70 122.43 2dhm s SER 44 Ca 1.13 -2.97 0.09 0.00 0.48 0.00 0.00 55.95 54.68 2dhm s SER 44 Cb -1.09 -1.91 -0.04 0.00 0.10 0.00 0.00 66.02 63.08 2dhm s SER 44 CO 0.56 -0.37 -0.20 -2.28 0.98 0.00 0.00 173.24 171.93 2dhm s HIS 45 N -0.24 1.94 -0.05 5.02 5.04 -1.26 -4.98 115.29 120.77 2dhm s HIS 45 Ca 0.19 -0.43 -0.03 0.00 -1.54 0.00 0.00 55.06 53.25 2dhm s HIS 45 Cb -0.17 -0.98 -0.04 0.00 0.04 0.00 0.00 32.58 31.43 2dhm s HIS 45 CO -0.05 0.36 0.10 0.12 -2.34 0.00 0.00 174.74 172.93 2dhm s PHE 46 N -1.81 3.41 -0.22 3.88 5.36 -1.26 -4.30 117.98 123.04 2dhm s PHE 46 Ca 0.16 0.33 -0.17 0.00 -0.96 0.00 0.00 56.93 56.28 2dhm s PHE 46 Cb -0.07 -1.82 0.06 0.00 -0.34 0.00 0.00 43.02 40.85 2dhm s PHE 46 CO 0.07 0.61 0.57 0.21 -1.46 0.00 0.00 175.22 175.22 2dhm s LYS 47 N -1.43 0.63 -0.06 10.12 2.36 -1.21 -3.12 119.74 127.03 2dhm s LYS 47 Ca 0.20 0.88 0.05 0.00 -2.55 0.00 0.00 55.97 54.55 2dhm s LYS 47 Cb -0.12 0.23 -0.00 0.00 -1.05 0.00 0.00 37.83 36.89 2dhm s LYS 47 CO 0.10 -0.11 -0.20 0.08 1.55 0.00 0.00 175.35 176.77 2dhm s VAL 48 N 0.76 1.67 -0.17 4.02 1.01 -1.08 -1.16 120.40 125.45 2dhm s VAL 48 Ca -0.04 -0.84 -0.02 0.00 0.00 0.00 0.00 61.98 61.09 2dhm s VAL 48 Cb -0.05 -1.44 -0.01 0.00 0.00 0.00 0.00 36.38 34.88 2dhm s VAL 48 CO -0.06 0.47 -0.10 -0.69 0.00 0.00 0.00 175.10 174.73 2dhm s VAL 49 N 0.10 3.13 -0.16 2.92 1.01 0.61 -2.20 120.40 125.82 2dhm s VAL 49 Ca -0.07 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 61.26 2dhm s VAL 49 Cb -0.14 -2.36 0.07 0.00 0.00 0.00 0.00 36.38 33.95 2dhm s VAL 49 CO 0.04 0.49 0.16 -0.22 0.00 0.00 0.00 175.10 175.57 2dhm s LEU 50 N 0.84 0.04 -0.16 3.92 0.20 -1.12 -1.91 118.68 120.49 2dhm s LEU 50 Ca -0.03 -0.19 -0.09 0.00 0.69 0.00 0.00 54.13 54.51 2dhm s LEU 50 Cb -0.15 0.16 -0.05 0.00 -0.43 0.00 0.00 46.19 45.73 2dhm s LEU 50 CO 0.01 -0.31 0.16 -0.69 -0.29 0.00 0.00 176.35 175.22 2dhm s VAL 51 N 2.26 5.42 -0.16 1.68 1.01 -1.16 -3.01 120.40 126.44 2dhm s VAL 51 Ca 0.04 0.25 -0.28 0.00 0.00 0.00 0.00 61.98 62.00 2dhm s VAL 51 Cb -0.15 -3.47 0.09 0.00 0.00 0.00 0.00 36.38 32.85 2dhm s VAL 51 CO -0.09 0.51 0.79 -0.55 0.00 0.00 0.00 175.10 175.75 2dhm s SER 52 N -0.20 -0.61 0.28 3.32 0.15 -0.06 -2.14 113.70 114.44 2dhm s SER 52 Ca 0.12 0.90 0.13 0.00 0.70 0.00 0.00 55.95 57.80 2dhm s SER 52 Cb -0.12 0.82 0.35 0.00 -1.71 0.00 0.00 66.02 65.36 2dhm s SER 52 CO 0.01 -0.40 1.59 -0.78 1.20 0.00 0.00 173.24 174.86 2dhm h ASP 53 N 3.67 0.00 -0.72 5.45 1.82 -1.94 -3.17 116.42 121.53 2dhm h ASP 53 Ca -0.26 0.00 0.21 0.00 -0.39 0.00 0.00 57.03 56.59 2dhm h ASP 53 Cb 1.15 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 41.14 2dhm h ASP 53 CO 0.24 0.59 0.92 0.03 -1.61 0.00 0.00 179.24 179.41 2dhm h ARG 54 N 0.00 0.00 -1.38 0.28 2.47 -1.96 0.43 114.38 114.22 2dhm h ARG 54 Ca -0.01 0.00 -0.23 0.00 -1.26 0.00 0.00 59.98 58.49 2dhm h ARG 54 Cb 1.15 0.00 -0.11 0.00 -1.65 0.00 0.00 29.97 29.36 2dhm h ARG 54 CO 0.08 0.00 0.29 1.19 0.56 0.00 0.00 179.97 182.09 2dhm n PHE 55 N -3.32 1.17 -3.83 3.04 3.01 -1.20 -4.88 117.46 111.45 2dhm n PHE 55 Ca 0.16 -1.45 -0.35 0.00 1.01 0.00 0.00 57.45 56.81 2dhm n PHE 55 Cb 1.16 -0.72 -0.08 0.00 -0.01 0.00 0.00 39.48 39.83 2dhm n PHE 55 CO 0.00 0.00 0.00 -0.08 1.01 0.00 0.00 176.76 177.69 2dhm s THR 56 N -1.56 5.24 -1.25 4.37 -1.32 0.15 -4.53 115.64 116.74 2dhm s THR 56 Ca 0.23 0.12 -0.09 0.00 -1.21 0.00 0.00 61.69 60.74 2dhm s THR 56 Cb 0.18 -3.37 -0.01 0.00 -1.51 0.00 0.00 72.50 67.80 2dhm s THR 56 CO 0.01 0.47 0.66 0.61 -2.21 0.00 0.00 174.62 174.17 2dhm n GLY 57 N 3.30 -0.61 1.63 6.08 0.00 -1.26 -4.99 105.19 109.35 2dhm n GLY 57 Ca -0.17 0.29 -0.12 0.00 0.00 0.00 0.00 46.02 46.03 2dhm n GLY 57 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2dhm n GLU 58 N -4.24 0.62 -2.83 1.61 0.28 -1.26 -5.15 120.64 109.67 2dhm n GLU 58 Ca -0.21 -1.68 -0.32 0.00 -0.16 0.00 0.00 57.16 54.80 2dhm n GLU 58 Cb 0.64 1.03 -0.05 0.00 1.43 0.00 0.00 31.44 34.49 2dhm n GLU 58 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 2dhm s ARG 59 N -2.74 3.95 0.17 3.44 3.03 -1.26 -4.98 118.95 120.56 2dhm s ARG 59 Ca 0.13 0.73 0.24 0.00 2.03 0.00 0.00 55.73 58.86 2dhm s ARG 59 Cb 0.01 -2.31 0.42 0.00 -1.03 0.00 0.00 34.95 32.03 2dhm s ARG 59 CO 0.09 -0.03 1.41 0.74 -1.13 0.00 0.00 175.30 176.38 2dhm h PHE 60 N 1.57 0.00 0.00 5.89 0.04 -2.01 -3.31 116.94 119.12 2dhm h PHE 60 Ca -0.48 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.27 2dhm h PHE 60 Cb 1.18 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.33 2dhm h PHE 60 CO 0.62 0.00 -0.15 -0.07 -0.60 0.00 0.00 178.31 178.11 2dhm h LEU 61 N 0.00 0.01 -2.98 1.54 4.07 -2.04 -3.29 115.31 112.61 2dhm h LEU 61 Ca 0.00 -0.94 0.00 0.00 0.08 0.00 0.00 57.88 57.02 2dhm h LEU 61 Cb 0.78 -0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.52 2dhm h LEU 61 CO 0.00 1.06 0.00 -0.55 -1.08 0.00 0.00 178.44 177.87 2dhm h ASN 62 N -0.99 0.00 -0.51 -0.43 -0.00 -1.99 -3.16 115.58 108.49 2dhm h ASN 62 Ca -0.04 0.00 0.05 0.00 -0.00 0.00 0.00 56.30 56.31 2dhm h ASN 62 Cb 1.04 0.00 -0.06 0.00 -0.00 0.00 0.00 38.32 39.30 2dhm h ASN 62 CO -0.02 0.00 -0.31 0.03 -0.00 0.00 0.00 177.43 177.13 2dhm h ARG 63 N 0.00 -0.01 -0.28 4.14 2.47 -1.65 -1.36 114.38 117.69 2dhm h ARG 63 Ca 0.00 0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.60 2dhm h ARG 63 Cb 0.00 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.32 2dhm h ARG 63 CO 0.00 -0.01 -0.29 0.45 0.56 0.00 0.00 179.97 180.68 2dhm h HIS 64 N -0.01 0.84 0.00 3.04 3.86 -1.79 -3.28 115.15 117.82 2dhm h HIS 64 Ca 0.08 -0.26 0.00 0.00 -1.16 0.00 0.00 60.37 59.04 2dhm h HIS 64 Cb 0.22 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.51 2dhm h HIS 64 CO -0.97 1.00 0.00 0.54 0.86 0.00 0.00 177.93 179.36 2dhm n ARG 65 N -4.26 0.00 -0.18 2.45 1.74 -0.57 0.60 116.66 116.43 2dhm n ARG 65 Ca -0.04 0.67 -0.03 0.00 -0.77 0.00 0.00 57.85 57.68 2dhm n ARG 65 Cb 0.48 -1.02 0.04 0.00 -1.02 0.00 0.00 32.46 30.93 2dhm n ARG 65 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2dhm h MET 66 N 0.00 -0.06 0.00 5.56 -0.00 -1.52 0.21 114.93 119.12 2dhm h MET 66 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2dhm h MET 66 Cb 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 31.60 31.61 2dhm h MET 66 CO 0.00 -0.04 0.00 -0.89 -0.00 0.00 0.00 176.91 175.98 2dhm n ILE 67 N -5.42 0.00 -0.36 -0.10 2.08 0.86 -1.85 119.36 114.59 2dhm n ILE 67 Ca 0.06 1.45 0.25 0.00 0.56 0.00 0.00 62.75 65.07 2dhm n ILE 67 Cb 0.32 -2.30 0.51 0.00 -0.75 0.00 0.00 39.64 37.41 2dhm n ILE 67 CO 0.00 0.00 0.00 1.88 0.56 0.00 0.00 176.55 178.99 2dhm h TYR 68 N 0.00 0.78 -0.46 1.39 0.05 0.37 0.26 116.97 119.36 2dhm h TYR 68 Ca 0.00 0.03 0.06 0.00 0.05 0.00 0.00 58.73 58.87 2dhm h TYR 68 Cb 0.00 -0.21 -0.05 0.00 1.01 0.00 0.00 36.73 37.47 2dhm h TYR 68 CO -0.11 -0.09 0.15 1.03 -1.05 0.00 0.00 178.16 178.10 2dhm h SER 69 N 0.33 0.14 -0.06 3.88 0.87 -0.13 0.61 113.55 119.19 2dhm h SER 69 Ca 0.70 0.06 0.04 0.00 -1.23 0.00 0.00 61.79 61.36 2dhm h SER 69 Cb 1.76 0.05 -0.05 0.00 -0.44 0.00 0.00 62.40 63.72 2dhm h SER 69 CO -0.47 0.11 -0.26 0.74 -0.53 0.00 0.00 176.83 176.43 2dhm h THR 70 N 0.31 0.41 -0.93 2.23 2.02 0.28 -2.31 112.91 114.92 2dhm h THR 70 Ca 0.22 0.00 -0.60 0.00 0.77 0.00 0.00 66.41 66.80 2dhm h THR 70 Cb 0.23 0.41 -0.30 0.00 -1.74 0.00 0.00 68.15 66.75 2dhm h THR 70 CO -0.23 0.00 0.59 0.18 0.37 0.00 0.00 175.52 176.42 2dhm n LEU 71 N -5.37 7.00 -0.14 2.58 4.32 -1.00 -4.76 117.00 119.62 2dhm n LEU 71 Ca -0.04 -4.17 -0.13 0.00 -0.02 0.00 0.00 56.01 51.64 2dhm n LEU 71 Cb 0.29 -0.86 -0.10 0.00 -1.62 0.00 0.00 43.42 41.13 2dhm n LEU 71 CO 0.20 1.45 0.50 0.00 -1.22 0.00 0.00 177.39 178.31 2dhm h ALA 72 N 1.76 -0.77 0.06 -1.18 0.00 0.81 0.65 119.26 120.60 2dhm h ALA 72 Ca 0.57 0.00 -0.21 0.00 0.00 0.00 0.00 54.91 55.27 2dhm h ALA 72 Cb 1.36 1.12 -0.01 0.00 0.00 0.00 0.00 17.79 20.26 2dhm h ALA 72 CO 1.33 -1.03 -1.07 0.93 0.00 0.00 0.00 179.25 179.42 2dhm h GLU 73 N -0.38 0.12 -0.86 0.00 4.39 -1.85 -3.28 114.58 112.73 2dhm h GLU 73 Ca 0.07 -0.21 0.18 0.00 0.34 0.00 0.00 59.36 59.74 2dhm h GLU 73 Cb 0.57 0.08 -0.16 0.00 -0.10 0.00 0.00 28.75 29.14 2dhm h GLU 73 CO -0.59 1.10 -0.17 0.93 -1.16 0.00 0.00 179.01 179.13 2dhm h GLU 74 N -0.65 0.01 0.00 2.33 4.39 -1.87 1.40 114.58 120.19 2dhm h GLU 74 Ca -0.25 -0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.40 2dhm h GLU 74 Cb 1.47 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.11 2dhm h GLU 74 CO -0.03 0.01 -0.22 1.37 -1.16 0.00 0.00 179.01 178.97 2dhm h LEU 75 N 0.01 0.00 -1.35 1.33 8.10 -1.02 -2.40 115.31 119.98 2dhm h LEU 75 Ca 0.43 0.00 0.00 0.00 0.11 0.00 0.00 57.88 58.42 2dhm h LEU 75 Cb 0.70 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.92 2dhm h LEU 75 CO -0.87 0.22 0.00 -0.24 -4.11 0.00 0.00 178.44 173.45 2dhm n SER 76 N -3.60 1.69 -0.06 0.17 2.88 0.48 -3.05 113.62 112.13 2dhm n SER 76 Ca -0.01 -2.14 -0.03 0.00 -1.33 0.00 0.00 58.87 55.36 2dhm n SER 76 Cb 0.36 -0.50 -0.01 0.00 -0.75 0.00 0.00 64.21 63.31 2dhm n SER 76 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2dhm h THR 77 N 0.64 0.00 0.00 2.46 2.02 -1.11 -3.46 112.91 113.45 2dhm h THR 77 Ca 0.00 -0.79 0.00 0.00 0.77 0.00 0.00 66.41 66.39 2dhm h THR 77 Cb 0.70 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.11 2dhm h THR 77 CO 0.07 0.00 -0.64 1.07 0.37 0.00 0.00 175.52 176.39 2dhm n THR 78 N -4.13 0.00 -2.55 3.16 5.66 -1.26 -5.05 114.28 110.12 2dhm n THR 78 Ca -0.05 0.00 -0.41 0.00 -3.05 0.00 0.00 64.05 60.53 2dhm n THR 78 Cb 0.20 -0.57 -0.04 0.00 -1.55 0.00 0.00 70.33 68.37 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 -1.64 4.03 -0.15 1.08 1.01 -1.17 -4.95 120.40 118.61 2dhm s VAL 79 Ca 0.00 1.69 -0.08 0.00 0.00 0.00 0.00 61.98 63.58 2dhm s VAL 79 Cb 0.00 -4.08 -0.07 0.00 0.00 0.00 0.00 36.38 32.24 2dhm s VAL 79 CO 0.00 0.26 -0.21 0.00 0.00 0.00 0.00 175.10 175.15 2dhm n HIS 80 N 2.69 0.00 -4.76 5.22 -0.00 -1.26 -4.34 115.22 112.77 2dhm n HIS 80 Ca 0.04 0.00 -0.32 0.00 -0.00 0.00 0.00 57.72 57.44 2dhm n HIS 80 Cb 0.47 -0.55 -0.17 0.00 -0.00 0.00 0.00 29.99 29.75 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 -2.32 2.17 -0.02 1.59 0.00 -1.26 -5.08 121.76 116.83 2dhm s ALA 81 Ca -0.22 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 50.72 2dhm s ALA 81 Cb 0.08 -0.94 0.03 0.00 0.00 0.00 0.00 23.12 22.29 2dhm s ALA 81 CO 0.28 0.03 0.01 -1.17 0.00 0.00 0.00 175.76 174.91 2dhm s LEU 82 N 0.73 1.20 -0.50 0.00 2.96 -1.26 -4.47 118.68 117.34 2dhm s LEU 82 Ca -0.09 -0.00 -0.20 0.00 -0.22 0.00 0.00 54.13 53.62 2dhm s LEU 82 Cb -0.16 -0.15 0.05 0.00 0.50 0.00 0.00 46.19 46.43 2dhm s LEU 82 CO 0.00 -0.10 0.64 0.00 -1.32 0.00 0.00 176.35 175.58 2dhm s ALA 83 N 0.95 3.36 -0.22 5.97 0.00 -1.18 -5.03 121.76 125.62 2dhm s ALA 83 Ca -0.09 -1.63 -0.25 0.00 0.00 0.00 0.00 51.96 49.99 2dhm s ALA 83 Cb -0.12 -3.36 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 2dhm s ALA 83 CO -0.02 -2.00 0.85 -0.51 0.00 0.00 0.00 175.76 174.08 2dhm s LEU 84 N 2.74 4.11 -0.44 0.00 1.43 -1.26 -2.64 118.68 122.62 2dhm s LEU 84 Ca 0.17 1.11 -0.02 0.00 -1.03 0.00 0.00 54.13 54.36 2dhm s LEU 84 Cb -0.18 -3.24 0.12 0.00 0.03 0.00 0.00 46.19 42.92 2dhm s LEU 84 CO 0.13 -0.49 0.23 -1.00 0.23 0.00 0.00 176.35 175.45 2dhm s HIS 85 N 2.66 3.56 -0.27 0.29 3.76 -0.93 -5.01 115.29 119.35 2dhm s HIS 85 Ca 0.37 -2.54 -0.11 0.00 -0.15 0.00 0.00 55.06 52.63 2dhm s HIS 85 Cb -0.16 -3.18 -0.05 0.00 1.11 0.00 0.00 32.58 30.30 2dhm s HIS 85 CO 0.09 -0.94 0.17 0.95 -0.85 0.00 0.00 174.74 174.16 2dhm s THR 86 N 0.88 5.23 0.23 1.30 -4.23 -1.26 -2.79 115.64 114.99 2dhm s THR 86 Ca 0.10 0.14 0.02 0.00 -1.18 0.00 0.00 61.69 60.77 2dhm s THR 86 Cb -0.22 -3.48 -0.05 0.00 1.34 0.00 0.00 72.50 70.09 2dhm s THR 86 CO -0.04 0.28 0.05 -0.31 -0.54 0.00 0.00 174.62 174.05 2dhm s TYR 87 N 1.61 1.45 0.56 3.99 1.51 -1.16 -5.05 117.35 120.26 2dhm s TYR 87 Ca 0.07 -1.08 0.07 0.00 -1.01 0.00 0.00 57.07 55.12 2dhm s TYR 87 Cb -0.15 -0.85 0.07 0.00 -0.11 0.00 0.00 41.96 40.92 2dhm s TYR 87 CO 0.09 -0.23 0.59 0.25 -1.11 0.00 0.00 175.55 175.14 2dhm n THR 88 N -0.39 0.00 0.21 -0.71 -2.24 -1.26 -0.88 114.28 109.01 2dhm n THR 88 Ca -0.03 -2.07 0.08 0.00 -2.27 0.00 0.00 64.05 59.76 2dhm n THR 88 Cb 0.65 -0.25 0.43 0.00 -2.10 0.00 0.00 70.33 69.06 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 0.40 0.73 0.00 2.28 5.03 -1.94 -3.04 117.51 120.97 2dhm h ILE 89 Ca -0.31 -1.22 0.00 0.00 -0.12 0.00 0.00 64.86 63.20 2dhm h ILE 89 Cb 1.26 1.78 0.00 0.00 -3.03 0.00 0.00 36.82 36.83 2dhm h ILE 89 CO 0.47 0.28 -0.40 1.17 -0.68 0.00 0.00 178.15 178.99 2dhm n LYS 90 N -3.51 0.31 -0.29 2.37 3.00 -1.26 -3.13 118.16 115.65 2dhm n LYS 90 Ca -0.00 0.38 0.22 0.00 -0.00 0.00 0.00 58.31 58.91 2dhm n LYS 90 Cb 0.44 -1.34 0.42 0.00 0.00 0.00 0.00 35.03 34.55 2dhm n LYS 90 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2dhm n GLU 91 N -3.84 -0.06 -0.03 1.64 -0.58 -1.26 0.76 120.64 117.28 2dhm n GLU 91 Ca -0.06 1.24 -0.14 0.00 -0.42 0.00 0.00 57.16 57.78 2dhm n GLU 91 Cb 0.21 -2.12 -0.11 0.00 -0.57 0.00 0.00 31.44 28.85 2dhm n GLU 91 CO 0.00 0.00 0.00 2.35 -0.48 0.00 0.00 177.13 179.00 2dhm h TRP 92 N 0.00 0.19 -1.88 -0.32 -0.00 -1.73 0.36 115.95 112.57 2dhm h TRP 92 Ca 0.66 -0.09 0.56 0.00 -0.00 0.00 0.00 58.89 60.02 2dhm h TRP 92 Cb 1.63 -0.03 -0.09 0.00 -0.00 0.00 0.00 29.16 30.67 2dhm h TRP 92 CO -0.17 0.83 1.34 0.39 -0.00 0.00 0.00 178.44 180.82 2dhm n GLU 93 N -4.60 -0.01 -2.72 2.65 -0.58 0.23 -3.19 120.64 112.42 2dhm n GLU 93 Ca -0.09 1.10 -0.07 0.00 -0.42 0.00 0.00 57.16 57.69 2dhm n GLU 93 Cb 0.43 -2.48 0.06 0.00 -0.57 0.00 0.00 31.44 28.88 2dhm n GLU 93 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2dhm n GLY 94 N -1.85 -0.62 0.32 0.62 0.00 -0.99 -5.00 105.19 97.67 2dhm n GLY 94 Ca 0.44 0.46 0.09 0.00 0.00 0.00 0.00 46.02 47.02 2dhm n GLY 94 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2dhm h LEU 95 N 3.62 0.30 -3.64 0.99 5.85 -0.88 -1.57 115.31 119.98 2dhm h LEU 95 Ca -0.18 -0.00 -0.42 0.00 0.84 0.00 0.00 57.88 58.12 2dhm h LEU 95 Cb 1.10 -0.07 -0.26 0.00 0.37 0.00 0.00 40.66 41.81 2dhm h LEU 95 CO 0.13 0.20 -0.08 0.00 -0.34 0.00 0.00 178.44 178.35 2dhm n GLN 96 N -4.48 2.59 -2.98 1.25 10.64 -1.26 -5.02 117.38 118.13 2dhm n GLN 96 Ca 0.05 -3.52 -0.20 0.00 -1.83 0.00 0.00 57.00 51.51 2dhm n GLN 96 Cb 0.24 -2.08 0.06 0.00 -0.86 0.00 0.00 30.24 27.60 2dhm n GLN 96 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2dhm s ASP 97 N -2.68 5.08 -0.21 2.61 1.11 -0.59 -5.14 116.67 116.85 2dhm s ASP 97 Ca 0.52 -0.74 -0.27 0.00 0.18 0.00 0.00 52.55 52.23 2dhm s ASP 97 Cb 0.43 0.15 0.11 0.00 1.07 0.00 0.00 42.92 44.68 2dhm s ASP 97 CO 0.01 -1.33 0.92 -0.89 1.18 0.00 0.00 175.17 175.05 2dhm s THR 98 N -2.68 0.00 -0.04 -1.27 2.01 -1.26 -5.10 115.64 107.29 2dhm s THR 98 Ca 0.62 0.00 0.07 0.00 0.31 0.00 0.00 61.69 62.68 2dhm s THR 98 Cb -0.06 -1.00 -0.02 0.00 0.01 0.00 0.00 72.50 71.43 2dhm s THR 98 CO 0.39 0.00 -0.24 0.54 -0.69 0.00 0.00 174.62 174.62 2dhm s VAL 99 N -0.33 2.21 0.84 3.82 0.11 -1.26 -5.13 120.40 120.66 2dhm s VAL 99 Ca -0.01 -1.04 -0.12 0.00 -2.93 0.00 0.00 61.98 57.88 2dhm s VAL 99 Cb -0.03 -1.79 0.19 0.00 -1.53 0.00 0.00 36.38 33.22 2dhm s VAL 99 CO -0.00 0.58 0.44 0.49 -3.33 0.00 0.00 175.10 173.27 2dhm n PHE 100 N 2.60 -2.60 -3.30 1.54 3.72 -1.26 -5.03 117.46 113.13 2dhm n PHE 100 Ca -0.17 -0.28 -0.20 0.00 -0.05 0.00 0.00 57.45 56.76 2dhm n PHE 100 Cb 0.51 -0.89 0.00 0.00 -0.94 0.00 0.00 39.48 38.16 2dhm n PHE 100 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2dhm s ALA 101 N -2.05 4.38 0.15 4.37 0.00 -1.26 -5.12 121.76 122.23 2dhm s ALA 101 Ca 0.34 -1.80 -0.02 0.00 0.00 0.00 0.00 51.96 50.49 2dhm s ALA 101 Cb -0.06 -1.28 -0.05 0.00 0.00 0.00 0.00 23.12 21.73 2dhm s ALA 101 CO 0.28 -0.38 0.35 -1.54 0.00 0.00 0.00 175.76 174.47 2dhm s SER 102 N -4.32 6.41 0.94 0.00 1.04 -1.26 -5.10 113.70 111.41 2dhm s SER 102 Ca 0.52 0.41 -0.12 0.00 0.48 0.00 0.00 55.95 57.24 2dhm s SER 102 Cb -0.06 -2.02 0.16 0.00 0.10 0.00 0.00 66.02 64.20 2dhm s SER 102 CO 0.31 0.03 1.09 -2.16 0.98 0.00 0.00 173.24 173.49 2dhm s PRO 103 N -2.98 0.87 1.03 4.02 0.04 -1.26 -5.04 135.00 131.69 2dhm s PRO 103 Ca 0.38 0.68 -0.13 0.00 0.04 0.00 0.00 61.00 61.97 2dhm s PRO 103 Cb -0.12 -1.78 0.21 0.00 0.04 0.00 0.00 34.50 32.85 2dhm s PRO 103 CO 0.28 -2.47 1.09 -1.25 0.04 0.00 0.00 177.00 174.69 2dhm s PRO 104 N -4.95 0.14 0.94 0.56 0.04 -1.26 -5.05 135.00 125.42 2dhm s PRO 104 Ca 0.64 0.42 -0.16 0.00 0.04 0.00 0.00 61.00 61.95 2dhm s PRO 104 Cb -0.18 -1.71 0.22 0.00 0.04 0.00 0.00 34.50 32.87 2dhm s PRO 104 CO 0.57 -2.91 1.13 0.00 0.04 0.00 0.00 177.00 175.83 2dhm n ARG 106 N -3.82 -0.03 0.00 0.00 1.74 -1.26 -5.33 116.66 107.96 2dhm n ARG 106 Ca 0.15 0.02 0.00 0.00 -0.77 0.00 0.00 57.85 57.24 2dhm n ARG 106 Cb 0.52 -1.53 0.00 0.00 -1.02 0.00 0.00 32.46 30.43 2dhm n ARG 106 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52