#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 0.42 -0.06 1.61 0.01 -1.26 -5.17 113.70 109.25 2dhm s SER 2 Ca 0.00 -1.25 -0.00 0.00 1.31 0.00 0.00 55.95 56.01 2dhm s SER 2 Cb 0.00 0.63 0.02 0.00 0.21 0.00 0.00 66.02 66.88 2dhm s SER 2 CO 0.00 -1.23 -0.03 -0.55 0.41 0.00 0.00 173.24 171.84 2dhm s SER 3 N -3.14 1.36 -0.61 2.44 0.15 -1.26 -5.03 113.70 107.61 2dhm s SER 3 Ca 0.27 -0.13 -0.02 0.00 0.70 0.00 0.00 55.95 56.78 2dhm s SER 3 Cb -0.00 -0.48 0.38 0.00 -1.71 0.00 0.00 66.02 64.20 2dhm s SER 3 CO 0.15 -0.12 2.06 0.61 1.20 0.00 0.00 173.24 177.13 2dhm n GLY 4 N 4.64 5.45 3.23 9.45 0.00 -1.26 -4.91 105.19 121.78 2dhm n GLY 4 Ca -0.16 -2.08 -0.13 0.00 0.00 0.00 0.00 46.02 43.66 2dhm n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhm s SER 5 N -1.29 -0.18 0.64 1.61 0.01 -1.26 -5.15 113.70 108.09 2dhm s SER 5 Ca 0.57 0.08 -0.17 0.00 1.31 0.00 0.00 55.95 57.73 2dhm s SER 5 Cb 0.45 0.31 -0.08 0.00 0.21 0.00 0.00 66.02 66.91 2dhm s SER 5 CO -0.06 -0.43 0.34 -1.54 0.41 0.00 0.00 173.24 171.96 2dhm n SER 6 N 1.34 -1.83 -3.29 2.44 3.41 -1.26 -4.93 113.62 109.50 2dhm n SER 6 Ca -0.21 0.63 -0.28 0.00 -0.26 0.00 0.00 58.87 58.75 2dhm n SER 6 Cb 0.56 -1.11 -0.06 0.00 -0.26 0.00 0.00 64.21 63.34 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 1.95 5.17 3.34 5.00 0.00 -1.26 -4.97 105.19 114.42 2dhm n GLY 7 Ca 0.10 -2.77 -0.45 0.00 0.00 0.00 0.00 46.02 42.89 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 -2.92 4.18 -0.92 1.61 -2.45 -1.26 -4.98 119.30 112.56 2dhm s MET 8 Ca 0.43 -3.18 -0.19 0.00 -1.25 0.00 0.00 55.69 51.50 2dhm s MET 8 Cb 0.19 -4.56 0.13 0.00 1.25 0.00 0.00 34.83 31.85 2dhm s MET 8 CO -0.05 -1.25 1.10 -1.64 1.05 0.00 0.00 175.02 174.23 2dhm s MET 9 N -1.17 3.59 -0.24 4.11 1.00 -1.26 -4.78 119.30 120.55 2dhm s MET 9 Ca 0.30 -1.78 -0.16 0.00 0.00 0.00 0.00 55.69 54.05 2dhm s MET 9 Cb -0.10 -4.88 -0.12 0.00 0.00 0.00 0.00 34.83 29.73 2dhm s MET 9 CO -0.08 -1.75 -0.23 -0.89 0.00 0.00 0.00 175.02 172.08 2dhm n ILE 10 N 5.42 1.52 0.31 2.53 2.08 -1.26 -3.40 119.36 126.56 2dhm n ILE 10 Ca 0.23 -0.19 0.19 0.00 0.56 0.00 0.00 62.75 63.54 2dhm n ILE 10 Cb 0.49 -2.02 1.02 0.00 -0.75 0.00 0.00 39.64 38.38 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 -1.00 0.00 0.06 0.38 2.43 -2.00 -0.11 114.38 114.14 2dhm h ARG 11 Ca -0.48 0.00 -0.26 0.00 -0.81 0.00 0.00 59.98 58.43 2dhm h ARG 11 Cb 1.39 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.92 2dhm h ARG 11 CO -0.29 0.00 -1.36 0.93 -1.51 0.00 0.00 179.97 177.74 2dhm h GLU 12 N 0.00 0.12 -0.59 0.20 5.08 -1.95 -3.30 114.58 114.14 2dhm h GLU 12 Ca 0.02 -0.21 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 2dhm h GLU 12 Cb 0.29 0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.59 2dhm h GLU 12 CO -0.00 1.10 0.26 0.07 -1.00 0.00 0.00 179.01 179.44 2dhm h ARG 13 N -0.59 0.84 0.19 2.33 0.11 -1.38 -0.47 114.38 115.41 2dhm h ARG 13 Ca -0.33 -0.11 -0.01 0.00 0.10 0.00 0.00 59.98 59.63 2dhm h ARG 13 Cb 1.56 -0.16 0.00 0.00 1.11 0.00 0.00 29.97 32.49 2dhm h ARG 13 CO -0.06 0.67 -0.09 0.82 0.10 0.00 0.00 179.97 181.40 2dhm h ILE 14 N 0.83 0.00 0.16 0.08 2.04 -1.21 -3.01 117.51 116.40 2dhm h ILE 14 Ca 0.20 -0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.08 2dhm h ILE 14 Cb 0.12 0.00 -0.04 0.00 -0.74 0.00 0.00 36.82 36.17 2dhm h ILE 14 CO -0.02 0.00 -0.32 -0.33 0.00 0.00 0.00 178.15 177.48 2dhm h GLU 15 N -0.26 -0.55 -1.56 2.37 5.08 -1.63 -1.14 114.58 116.90 2dhm h GLU 15 Ca -0.03 0.04 0.45 0.00 -1.00 0.00 0.00 59.36 58.82 2dhm h GLU 15 Cb 0.20 0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.51 2dhm h GLU 15 CO 0.04 -0.37 1.19 0.39 -1.00 0.00 0.00 179.01 179.27 2dhm n GLU 16 N -5.42 0.00 -0.09 2.33 1.02 -0.19 0.91 120.64 119.21 2dhm n GLU 16 Ca -0.07 0.92 -0.17 0.00 -0.02 0.00 0.00 57.16 57.82 2dhm n GLU 16 Cb 0.33 -2.15 -0.11 0.00 -0.02 0.00 0.00 31.44 29.49 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 0.00 -0.11 3.49 1.79 -1.08 -3.35 116.57 117.31 2dhm h LYS 17 Ca 0.74 0.00 0.03 0.00 -2.18 0.00 0.00 60.65 59.24 2dhm h LYS 17 Cb 3.12 0.00 -0.00 0.00 -1.58 0.00 0.00 32.23 33.76 2dhm h LYS 17 CO -0.01 0.86 0.15 -0.07 -1.08 0.00 0.00 179.45 179.30 2dhm h LEU 18 N -1.00 0.00 0.12 2.94 3.38 0.10 0.35 115.31 121.21 2dhm h LEU 18 Ca -0.19 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.78 2dhm h LEU 18 Cb 1.07 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 2dhm h LEU 18 CO -0.11 0.00 -0.10 0.03 0.09 0.00 0.00 178.44 178.35 2dhm h ARG 19 N 0.00 -0.22 0.00 1.13 2.47 -0.74 -2.66 114.38 114.35 2dhm h ARG 19 Ca 0.05 0.02 -0.19 0.00 -1.26 0.00 0.00 59.98 58.60 2dhm h ARG 19 Cb 0.35 0.05 -0.03 0.00 -1.65 0.00 0.00 29.97 28.69 2dhm h ARG 19 CO -0.00 -0.15 -1.45 0.00 0.56 0.00 0.00 179.97 178.93 2dhm n ALA 20 N -2.26 1.86 0.19 0.04 0.00 -0.82 -2.06 120.51 117.46 2dhm n ALA 20 Ca -0.08 -0.57 -0.16 0.00 0.00 0.00 0.00 53.44 52.64 2dhm n ALA 20 Cb 0.14 -0.95 -0.09 0.00 0.00 0.00 0.00 19.45 18.55 2dhm n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dhm h ALA 21 N 1.35 -1.04 0.00 0.00 0.00 -0.27 -3.38 119.26 115.91 2dhm h ALA 21 Ca -0.18 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.45 2dhm h ALA 21 Cb 1.65 0.76 -0.02 0.00 0.00 0.00 0.00 17.79 20.18 2dhm h ALA 21 CO 0.05 -1.11 -1.52 1.19 0.00 0.00 0.00 179.25 177.86 2dhm n PHE 22 N -5.16 0.00 -2.60 0.00 3.72 -1.03 -5.06 117.46 107.33 2dhm n PHE 22 Ca -0.09 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.23 2dhm n PHE 22 Cb 0.39 -0.35 0.04 0.00 -0.94 0.00 0.00 39.48 38.62 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 -2.72 -2.76 0.00 -1.08 6.02 -0.87 -5.05 117.38 110.92 2dhm n GLN 23 Ca -0.16 0.38 0.00 0.00 -0.01 0.00 0.00 57.00 57.22 2dhm n GLN 23 Cb 0.68 -3.96 0.00 0.00 1.02 0.00 0.00 30.24 27.98 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 -2.40 -0.26 -0.13 -1.09 -0.04 -1.26 -5.03 135.00 124.79 2dhm n PRO 24 Ca -0.12 0.00 -0.18 0.00 -0.04 0.00 0.00 63.50 63.16 2dhm n PRO 24 Cb 0.57 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.92 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 -1.76 1.47 -4.15 0.52 0.24 -1.11 -4.98 118.33 108.56 2dhm n VAL 25 Ca 0.00 -0.56 -0.30 0.00 -2.04 0.00 0.00 64.34 61.44 2dhm n VAL 25 Cb 0.00 -1.41 -0.08 0.00 -1.47 0.00 0.00 33.84 30.88 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 -2.51 2.99 -0.30 6.34 5.36 -1.24 -5.01 117.98 123.61 2dhm s PHE 26 Ca -0.35 -0.02 -0.10 0.00 -0.96 0.00 0.00 56.93 55.50 2dhm s PHE 26 Cb 0.09 -1.55 0.14 0.00 -0.34 0.00 0.00 43.02 41.36 2dhm s PHE 26 CO 0.59 0.48 0.69 -1.17 -1.46 0.00 0.00 175.22 174.34 2dhm s LEU 27 N -2.23 -1.09 -0.29 6.12 2.96 -1.26 -3.29 118.68 119.61 2dhm s LEU 27 Ca 0.25 1.45 -0.14 0.00 -0.22 0.00 0.00 54.13 55.47 2dhm s LEU 27 Cb -0.12 2.23 0.10 0.00 0.50 0.00 0.00 46.19 48.90 2dhm s LEU 27 CO 0.17 -0.21 0.68 -0.70 -1.32 0.00 0.00 176.35 174.97 2dhm s GLU 28 N 2.85 0.66 -0.06 1.98 2.12 -0.77 -5.03 118.70 120.45 2dhm s GLU 28 Ca -0.04 1.30 0.04 0.00 0.36 0.00 0.00 54.97 56.63 2dhm s GLU 28 Cb -0.11 0.39 -0.02 0.00 0.26 0.00 0.00 34.13 34.64 2dhm s GLU 28 CO -0.19 -0.17 -0.18 0.08 -0.54 0.00 0.00 175.26 174.26 2dhm s VAL 29 N 2.06 2.69 -0.29 3.70 1.01 -1.26 -0.38 120.40 127.92 2dhm s VAL 29 Ca -0.09 -0.84 -0.06 0.00 0.00 0.00 0.00 61.98 60.99 2dhm s VAL 29 Cb -0.07 -2.04 0.02 0.00 0.00 0.00 0.00 36.38 34.28 2dhm s VAL 29 CO -0.20 0.57 0.06 -0.69 0.00 0.00 0.00 175.10 174.85 2dhm s VAL 30 N -0.38 3.75 0.30 2.92 1.01 -0.75 -5.03 120.40 122.23 2dhm s VAL 30 Ca 0.03 -0.82 -0.09 0.00 0.00 0.00 0.00 61.98 61.10 2dhm s VAL 30 Cb -0.12 -2.96 -0.07 0.00 0.00 0.00 0.00 36.38 33.23 2dhm s VAL 30 CO 0.02 0.06 0.63 1.51 0.00 0.00 0.00 175.10 177.31 2dhm s ASP 31 N 1.45 6.58 -0.57 3.32 -4.77 -1.26 -3.20 116.67 118.21 2dhm s ASP 31 Ca 0.01 0.96 0.05 0.00 -3.30 0.00 0.00 52.55 50.27 2dhm s ASP 31 Cb -0.17 -2.25 0.17 0.00 -1.09 0.00 0.00 42.92 39.58 2dhm s ASP 31 CO 0.01 -0.20 0.43 -0.62 0.70 0.00 0.00 175.17 175.49 2dhm n GLU 32 N -0.64 1.08 -1.15 2.11 -0.58 -1.26 -5.05 120.64 115.15 2dhm n GLU 32 Ca 0.01 -3.89 -0.42 0.00 -0.42 0.00 0.00 57.16 52.44 2dhm n GLU 32 Cb 0.53 -2.00 -0.04 0.00 -0.57 0.00 0.00 31.44 29.35 2dhm n GLU 32 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2dhm n SER 33 N 2.35 -0.47 -2.50 1.62 3.41 -1.26 -4.65 113.62 112.12 2dhm n SER 33 Ca 0.25 0.90 -0.31 0.00 -0.26 0.00 0.00 58.87 59.45 2dhm n SER 33 Cb 0.41 -0.74 0.02 0.00 -0.26 0.00 0.00 64.21 63.64 2dhm n SER 33 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dhm n TYR 34 N 0.62 3.18 0.03 7.33 4.11 -1.26 -4.79 117.16 126.37 2dhm n TYR 34 Ca 0.15 -2.75 -0.06 0.00 -0.00 0.00 0.00 57.90 55.24 2dhm n TYR 34 Cb 0.13 -0.54 0.03 0.00 -0.00 0.00 0.00 39.34 38.96 2dhm n TYR 34 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.86 177.40 2dhm n ARG 35 N -0.57 1.28 -0.09 -3.48 5.12 -1.26 -3.93 116.66 113.72 2dhm n ARG 35 Ca 0.46 -0.60 -0.17 0.00 -1.93 0.00 0.00 57.85 55.61 2dhm n ARG 35 Cb 0.60 -1.23 -0.06 0.00 -1.16 0.00 0.00 32.46 30.61 2dhm n ARG 35 CO 0.00 0.00 0.00 -2.39 -1.93 0.00 0.00 177.63 173.31 2dhm n HIS 36 N 0.56 0.00 -3.39 -1.55 1.44 -1.26 -5.05 115.22 105.98 2dhm n HIS 36 Ca 0.12 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.66 2dhm n HIS 36 Cb 0.64 -0.62 0.07 0.00 0.12 0.00 0.00 29.99 30.20 2dhm n HIS 36 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 2dhm n ASN 37 N -4.07 -4.16 -3.80 4.39 3.02 -1.25 -5.02 115.26 104.36 2dhm n ASN 37 Ca -0.30 -0.70 -0.12 0.00 -0.03 0.00 0.00 54.58 53.43 2dhm n ASN 37 Cb 0.65 -4.99 -0.09 0.00 -0.61 0.00 0.00 39.78 34.74 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 -3.41 0.08 -0.53 2.41 -7.23 -1.26 -5.11 120.40 105.35 2dhm s VAL 38 Ca 0.23 -0.62 -0.27 0.00 -1.81 0.00 0.00 61.98 59.50 2dhm s VAL 38 Cb -0.03 -0.67 -0.02 0.00 0.56 0.00 0.00 36.38 36.22 2dhm s VAL 38 CO 0.75 -0.34 1.81 -2.16 -0.31 0.00 0.00 175.10 174.85 2dhm s PRO 39 N -1.72 2.85 0.04 4.82 0.04 -1.26 -4.92 135.00 134.86 2dhm s PRO 39 Ca -0.11 0.81 -0.20 0.00 0.04 0.00 0.00 61.00 61.55 2dhm s PRO 39 Cb -0.04 -4.32 0.04 0.00 0.04 0.00 0.00 34.50 30.22 2dhm s PRO 39 CO 0.01 -2.45 0.45 0.00 0.04 0.00 0.00 177.00 175.05 2dhm s ALA 40 N 8.33 -1.12 0.18 8.56 0.00 -1.26 -5.06 121.76 131.39 2dhm s ALA 40 Ca 0.70 0.41 -0.20 0.00 0.00 0.00 0.00 51.96 52.86 2dhm s ALA 40 Cb -0.15 0.36 0.12 0.00 0.00 0.00 0.00 23.12 23.45 2dhm s ALA 40 CO 0.24 -0.47 1.60 0.78 0.00 0.00 0.00 175.76 177.92 2dhm h GLY 41 N 2.94 -0.03 -7.39 0.00 0.00 -2.06 -3.28 103.07 93.25 2dhm h GLY 41 Ca -0.31 0.36 -0.68 0.00 0.00 0.00 0.00 47.33 46.70 2dhm h GLY 41 CO 0.43 -0.21 0.67 -1.35 0.00 0.00 0.00 176.54 176.07 2dhm s SER 42 N -5.14 6.49 -0.02 0.19 1.04 -1.26 -4.76 113.70 110.24 2dhm s SER 42 Ca -0.14 -1.78 -0.07 0.00 0.48 0.00 0.00 55.95 54.44 2dhm s SER 42 Cb 0.15 -2.39 -0.02 0.00 0.10 0.00 0.00 66.02 63.86 2dhm s SER 42 CO 0.70 -1.13 -0.14 1.21 0.98 0.00 0.00 173.24 174.85 2dhm n GLU 43 N 6.69 0.22 -4.01 4.02 2.13 -1.24 -4.97 120.64 123.48 2dhm n GLU 43 Ca 0.14 0.09 -0.31 0.00 0.66 0.00 0.00 57.16 57.74 2dhm n GLU 43 Cb 0.48 -0.86 -0.15 0.00 0.27 0.00 0.00 31.44 31.17 2dhm n GLU 43 CO 0.00 0.00 0.00 -1.12 -0.41 0.00 0.00 177.13 175.60 2dhm s SER 44 N -5.89 4.59 0.11 4.31 0.01 -1.26 -4.76 113.70 110.82 2dhm s SER 44 Ca -0.12 -1.89 0.10 0.00 1.31 0.00 0.00 55.95 55.34 2dhm s SER 44 Cb 0.02 -1.53 -0.04 0.00 0.21 0.00 0.00 66.02 64.67 2dhm s SER 44 CO 0.18 -0.33 -0.21 -1.00 0.41 0.00 0.00 173.24 172.28 2dhm s HIS 45 N 1.02 2.46 -0.18 2.43 3.76 -1.26 -4.19 115.29 119.32 2dhm s HIS 45 Ca 0.05 -0.31 -0.24 0.00 -0.15 0.00 0.00 55.06 54.42 2dhm s HIS 45 Cb -0.19 -1.32 0.06 0.00 1.11 0.00 0.00 32.58 32.24 2dhm s HIS 45 CO -0.08 0.36 0.63 0.12 -0.85 0.00 0.00 174.74 174.91 2dhm s PHE 46 N -1.09 -0.66 -0.02 1.40 5.36 -1.22 -4.04 117.98 117.71 2dhm s PHE 46 Ca 0.16 1.50 -0.07 0.00 -0.96 0.00 0.00 56.93 57.56 2dhm s PHE 46 Cb -0.10 0.27 0.01 0.00 -0.34 0.00 0.00 43.02 42.86 2dhm s PHE 46 CO 0.08 -0.41 0.14 0.21 -1.46 0.00 0.00 175.22 173.79 2dhm s LYS 47 N -0.13 0.39 -0.06 10.12 2.20 -1.19 -0.32 119.74 130.75 2dhm s LYS 47 Ca -0.03 -0.21 -0.02 0.00 -0.36 0.00 0.00 55.97 55.34 2dhm s LYS 47 Cb -0.03 0.17 0.04 0.00 -1.51 0.00 0.00 37.83 36.49 2dhm s LYS 47 CO 0.03 -0.09 0.10 0.08 -0.36 0.00 0.00 175.35 175.12 2dhm s VAL 48 N -0.93 -0.17 -0.33 4.02 1.01 -1.04 -1.81 120.40 121.15 2dhm s VAL 48 Ca -0.10 0.39 -0.12 0.00 0.00 0.00 0.00 61.98 62.15 2dhm s VAL 48 Cb -0.06 -0.21 -0.02 0.00 0.00 0.00 0.00 36.38 36.10 2dhm s VAL 48 CO 0.01 0.16 0.22 -0.69 0.00 0.00 0.00 175.10 174.81 2dhm s VAL 49 N 2.17 5.18 -0.19 2.92 1.01 0.49 -1.16 120.40 130.81 2dhm s VAL 49 Ca 0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 61.98 61.76 2dhm s VAL 49 Cb -0.12 -3.65 0.06 0.00 0.00 0.00 0.00 36.38 32.67 2dhm s VAL 49 CO -0.04 0.02 0.03 -0.22 0.00 0.00 0.00 175.10 174.88 2dhm s LEU 50 N 1.71 1.25 -0.46 3.92 0.20 -1.18 -1.85 118.68 122.27 2dhm s LEU 50 Ca 0.06 -0.82 -0.20 0.00 0.69 0.00 0.00 54.13 53.86 2dhm s LEU 50 Cb -0.17 -0.63 0.03 0.00 -0.43 0.00 0.00 46.19 44.99 2dhm s LEU 50 CO 0.10 -0.30 0.62 -0.69 -0.29 0.00 0.00 176.35 175.79 2dhm s VAL 51 N 1.83 4.86 0.13 1.68 1.01 -1.21 -3.34 120.40 125.37 2dhm s VAL 51 Ca -0.01 -0.10 0.09 0.00 0.00 0.00 0.00 61.98 61.96 2dhm s VAL 51 Cb -0.17 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 31.95 2dhm s VAL 51 CO -0.08 -0.64 -0.20 -0.55 0.00 0.00 0.00 175.10 173.63 2dhm s SER 52 N 2.17 2.67 0.00 3.32 0.15 -1.18 -2.74 113.70 118.10 2dhm s SER 52 Ca 0.19 -0.77 -0.09 0.00 0.70 0.00 0.00 55.95 55.98 2dhm s SER 52 Cb -0.16 -0.16 -0.31 0.00 -1.71 0.00 0.00 66.02 63.69 2dhm s SER 52 CO 0.16 0.03 0.87 -0.78 1.20 0.00 0.00 173.24 174.72 2dhm h ASP 53 N 3.67 0.58 -1.56 5.45 1.82 -1.96 -3.32 116.42 121.09 2dhm h ASP 53 Ca -0.45 -0.74 0.45 0.00 -0.39 0.00 0.00 57.03 55.91 2dhm h ASP 53 Cb 1.19 -0.19 -0.06 0.00 0.68 0.00 0.00 39.33 40.95 2dhm h ASP 53 CO 0.45 1.60 1.31 0.54 -1.61 0.00 0.00 179.24 181.53 2dhm n ARG 54 N -3.57 0.01 -0.87 0.28 5.12 -1.26 0.15 116.66 116.51 2dhm n ARG 54 Ca -0.18 1.02 -0.17 0.00 -1.93 0.00 0.00 57.85 56.59 2dhm n ARG 54 Cb 1.07 -2.44 0.05 0.00 -1.16 0.00 0.00 32.46 29.98 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 -3.59 1.68 0.26 -1.55 3.72 -1.25 -4.46 117.46 112.26 2dhm n PHE 55 Ca 0.35 -1.89 0.10 0.00 -0.05 0.00 0.00 57.45 55.96 2dhm n PHE 55 Cb 1.77 -0.92 0.68 0.00 -0.94 0.00 0.00 39.48 40.07 2dhm n PHE 55 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2dhm h THR 56 N 0.90 0.80 0.00 4.37 1.03 0.11 -3.35 112.91 116.77 2dhm h THR 56 Ca 0.32 -0.40 -0.11 0.00 -0.01 0.00 0.00 66.41 66.21 2dhm h THR 56 Cb 1.12 1.23 -0.11 0.00 -1.07 0.00 0.00 68.15 69.32 2dhm h THR 56 CO 0.78 0.10 -0.24 0.61 -0.01 0.00 0.00 175.52 176.76 2dhm n GLY 57 N -1.03 0.47 3.92 2.99 0.00 -1.26 -5.12 105.19 105.17 2dhm n GLY 57 Ca -0.02 -0.01 -0.26 0.00 0.00 0.00 0.00 46.02 45.72 2dhm n GLY 57 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dhm s GLU 58 N 0.01 3.07 0.66 1.61 8.01 -1.26 -5.08 118.70 125.72 2dhm s GLU 58 Ca 0.01 -0.03 -0.11 0.00 0.01 0.00 0.00 54.97 54.84 2dhm s GLU 58 Cb 0.04 -2.33 -0.02 0.00 -4.31 0.00 0.00 34.13 27.51 2dhm s GLU 58 CO -0.01 -0.54 1.05 1.03 0.01 0.00 0.00 175.26 176.80 2dhm s ARG 59 N -4.88 3.26 0.24 1.61 1.81 -1.26 -4.87 118.95 114.87 2dhm s ARG 59 Ca 0.52 0.78 -0.04 0.00 -1.72 0.00 0.00 55.73 55.26 2dhm s ARG 59 Cb -0.10 -2.04 0.41 0.00 -0.45 0.00 0.00 34.95 32.77 2dhm s ARG 59 CO 0.44 -0.82 1.80 0.74 -0.68 0.00 0.00 175.30 176.78 2dhm h PHE 60 N -0.50 0.81 -0.03 -0.53 0.04 -2.00 -0.93 116.94 113.80 2dhm h PHE 60 Ca -0.44 0.03 -0.03 0.00 2.80 0.00 0.00 57.97 60.33 2dhm h PHE 60 Cb 1.21 -0.24 0.00 0.00 2.20 0.00 0.00 35.95 39.12 2dhm h PHE 60 CO 0.62 0.30 -0.09 -0.07 -0.60 0.00 0.00 178.31 178.48 2dhm h LEU 61 N 0.74 0.14 -1.38 1.54 4.07 -1.99 -2.62 115.31 115.81 2dhm h LEU 61 Ca 0.40 -0.61 0.21 0.00 0.08 0.00 0.00 57.88 57.96 2dhm h LEU 61 Cb 0.41 -0.04 -0.08 0.00 1.08 0.00 0.00 40.66 42.03 2dhm h LEU 61 CO -0.27 0.72 0.62 0.78 -1.08 0.00 0.00 178.44 179.22 2dhm h ASN 62 N -0.44 0.50 -0.14 -0.43 4.21 -1.83 0.32 115.58 117.76 2dhm h ASN 62 Ca -0.00 0.06 -0.21 0.00 1.21 0.00 0.00 56.30 57.36 2dhm h ASN 62 Cb 0.71 -0.03 0.01 0.00 -1.12 0.00 0.00 38.32 37.89 2dhm h ASN 62 CO 0.02 0.18 -0.74 0.03 -1.29 0.00 0.00 177.43 175.63 2dhm h ARG 63 N 0.48 0.75 0.53 0.81 3.08 -1.17 -3.23 114.38 115.64 2dhm h ARG 63 Ca 0.52 -0.62 -0.03 0.00 0.07 0.00 0.00 59.98 59.92 2dhm h ARG 63 Cb 1.19 0.13 0.01 0.00 0.08 0.00 0.00 29.97 31.37 2dhm h ARG 63 CO -0.24 1.23 -0.25 0.45 -1.07 0.00 0.00 179.97 180.08 2dhm h HIS 64 N 0.47 -0.66 -0.93 3.04 3.86 -0.55 -3.11 115.15 117.27 2dhm h HIS 64 Ca -0.05 -0.02 0.38 0.00 -1.16 0.00 0.00 60.37 59.52 2dhm h HIS 64 Cb 1.37 0.22 -0.17 0.00 1.06 0.00 0.00 27.41 29.89 2dhm h HIS 64 CO 0.09 -0.35 0.47 2.89 0.86 0.00 0.00 177.93 181.89 2dhm n ARG 65 N -5.26 -0.06 0.26 2.45 1.85 0.90 0.42 116.66 117.23 2dhm n ARG 65 Ca -0.10 1.29 -0.16 0.00 -1.00 0.00 0.00 57.85 57.88 2dhm n ARG 65 Cb 0.31 -2.30 -0.08 0.00 -1.05 0.00 0.00 32.46 29.33 2dhm n ARG 65 CO 0.00 0.00 0.00 0.52 -0.01 0.00 0.00 177.63 178.14 2dhm h MET 66 N 0.00 -0.62 0.47 2.89 2.86 -1.56 -0.14 114.93 118.83 2dhm h MET 66 Ca 0.78 0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 58.45 2dhm h MET 66 Cb 2.03 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 33.82 2dhm h MET 66 CO -0.73 -0.37 -0.37 0.82 1.06 0.00 0.00 176.91 177.33 2dhm h ILE 67 N -0.73 0.25 -0.06 -1.22 1.08 0.03 -3.08 117.51 113.79 2dhm h ILE 67 Ca -0.07 0.00 0.04 0.00 -0.39 0.00 0.00 64.86 64.44 2dhm h ILE 67 Cb 0.54 0.25 -0.06 0.00 -3.07 0.00 0.00 36.82 34.48 2dhm h ILE 67 CO 0.11 0.00 -0.41 1.88 -0.69 0.00 0.00 178.15 179.04 2dhm h TYR 68 N -0.82 -1.15 -1.07 1.37 0.05 -1.15 -0.62 116.97 113.57 2dhm h TYR 68 Ca -0.05 0.04 0.37 0.00 0.05 0.00 0.00 58.73 59.14 2dhm h TYR 68 Cb 0.70 0.51 -0.10 0.00 1.01 0.00 0.00 36.73 38.86 2dhm h TYR 68 CO -0.16 -0.48 0.70 0.45 -1.05 0.00 0.00 178.16 177.62 2dhm n SER 69 N -5.44 0.15 0.02 3.88 2.88 -0.07 0.25 113.62 115.28 2dhm n SER 69 Ca -0.05 1.02 -0.18 0.00 -1.33 0.00 0.00 58.87 58.33 2dhm n SER 69 Cb 0.36 -0.50 -0.12 0.00 -0.75 0.00 0.00 64.21 63.19 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 1.48 -0.86 2.46 2.02 -1.09 -3.35 112.91 113.58 2dhm h THR 70 Ca 0.67 -2.25 -0.58 0.00 0.77 0.00 0.00 66.41 65.01 2dhm h THR 70 Cb 2.19 2.87 -0.40 0.00 -1.74 0.00 0.00 68.15 71.07 2dhm h THR 70 CO -0.33 0.64 -0.42 0.18 0.37 0.00 0.00 175.52 175.96 2dhm n LEU 71 N -4.22 5.56 0.06 2.58 4.77 0.63 -4.84 117.00 121.53 2dhm n LEU 71 Ca -0.12 -4.67 -0.05 0.00 -0.03 0.00 0.00 56.01 51.14 2dhm n LEU 71 Cb 0.71 -0.49 -0.03 0.00 -2.33 0.00 0.00 43.42 41.28 2dhm n LEU 71 CO 0.46 1.97 0.51 0.00 -1.33 0.00 0.00 177.39 179.00 2dhm h ALA 72 N 2.17 -0.76 0.23 -1.18 0.00 0.32 -2.65 119.26 117.38 2dhm h ALA 72 Ca 0.42 -0.04 -0.33 0.00 0.00 0.00 0.00 54.91 54.96 2dhm h ALA 72 Cb 1.33 0.50 0.03 0.00 0.00 0.00 0.00 17.79 19.66 2dhm h ALA 72 CO 0.95 -0.79 -1.45 1.05 0.00 0.00 0.00 179.25 179.01 2dhm h GLU 73 N -0.26 0.48 -0.97 0.00 4.11 -1.89 -3.29 114.58 112.77 2dhm h GLU 73 Ca -0.01 -0.83 0.19 0.00 0.07 0.00 0.00 59.36 58.79 2dhm h GLU 73 Cb 0.24 0.31 -0.18 0.00 0.50 0.00 0.00 28.75 29.62 2dhm h GLU 73 CO -0.06 1.39 -0.25 0.39 0.07 0.00 0.00 179.01 180.55 2dhm n GLU 74 N -3.67 -0.10 0.18 1.06 -0.58 -1.23 0.23 120.64 116.52 2dhm n GLU 74 Ca -0.15 1.52 0.04 0.00 -0.42 0.00 0.00 57.16 58.14 2dhm n GLU 74 Cb 1.09 -2.27 0.32 0.00 -0.57 0.00 0.00 31.44 30.01 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 0.00 -0.70 -4.62 3.38 -1.59 -2.65 115.31 109.13 2dhm h LEU 75 Ca 0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.43 2dhm h LEU 75 Cb 0.70 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.45 2dhm h LEU 75 CO -1.00 0.43 0.00 -1.20 0.09 0.00 0.00 178.44 176.75 2dhm n SER 76 N -3.71 0.82 -0.08 -0.43 7.64 0.61 -3.17 113.62 115.30 2dhm n SER 76 Ca -0.01 -2.03 -0.08 0.00 1.01 0.00 0.00 58.87 57.76 2dhm n SER 76 Cb 0.50 -0.28 -0.03 0.00 -1.01 0.00 0.00 64.21 63.39 2dhm n SER 76 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2dhm n THR 77 N -0.15 1.44 0.00 0.44 -1.04 -0.72 -4.92 114.28 109.33 2dhm n THR 77 Ca 0.02 0.17 0.00 0.00 -2.04 0.00 0.00 64.05 62.20 2dhm n THR 77 Cb 0.18 -2.34 0.00 0.00 -1.82 0.00 0.00 70.33 66.35 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 -4.57 0.06 -1.82 12.58 5.66 -1.25 -5.03 114.28 119.91 2dhm n THR 78 Ca -0.12 0.02 -0.42 0.00 -3.05 0.00 0.00 64.05 60.48 2dhm n THR 78 Cb 0.35 -1.29 -0.03 0.00 -1.55 0.00 0.00 70.33 67.81 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 -2.00 2.80 0.00 1.08 1.01 -1.19 -4.95 120.40 117.16 2dhm s VAL 79 Ca 0.00 0.27 0.00 0.00 0.00 0.00 0.00 61.98 62.25 2dhm s VAL 79 Cb 0.00 -3.17 0.00 0.00 0.00 0.00 0.00 36.38 33.21 2dhm s VAL 79 CO 0.00 -0.00 0.04 1.41 0.00 0.00 0.00 175.10 176.55 2dhm n HIS 80 N 5.70 0.00 -4.11 5.22 -0.00 -1.26 -4.33 115.22 116.44 2dhm n HIS 80 Ca 0.17 0.00 -0.26 0.00 -0.00 0.00 0.00 57.72 57.63 2dhm n HIS 80 Cb 0.39 -0.35 -0.06 0.00 -0.00 0.00 0.00 29.99 29.98 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 -3.28 3.51 -0.14 -1.41 0.00 -1.26 -4.95 121.76 114.24 2dhm s ALA 81 Ca 0.00 -1.26 -0.15 0.00 0.00 0.00 0.00 51.96 50.55 2dhm s ALA 81 Cb 0.00 -1.30 0.04 0.00 0.00 0.00 0.00 23.12 21.86 2dhm s ALA 81 CO 0.00 0.48 0.42 -1.17 0.00 0.00 0.00 175.76 175.49 2dhm s LEU 82 N -3.14 0.40 -0.33 0.00 2.96 -1.26 -3.42 118.68 113.89 2dhm s LEU 82 Ca 0.31 0.75 0.02 0.00 -0.22 0.00 0.00 54.13 54.98 2dhm s LEU 82 Cb -0.10 1.48 0.09 0.00 0.50 0.00 0.00 46.19 48.15 2dhm s LEU 82 CO 0.23 -0.21 0.03 0.00 -1.32 0.00 0.00 176.35 175.08 2dhm s ALA 83 N -0.03 2.85 0.06 5.97 0.00 0.57 -4.97 121.76 126.20 2dhm s ALA 83 Ca -0.02 -2.25 -0.30 0.00 0.00 0.00 0.00 51.96 49.39 2dhm s ALA 83 Cb -0.03 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 21.09 2dhm s ALA 83 CO 0.01 -1.53 1.00 -0.51 0.00 0.00 0.00 175.76 174.73 2dhm s LEU 84 N 1.04 4.43 -0.69 0.00 1.43 -1.26 -2.50 118.68 121.12 2dhm s LEU 84 Ca 0.03 1.76 0.05 0.00 -1.03 0.00 0.00 54.13 54.94 2dhm s LEU 84 Cb -0.20 -3.58 0.17 0.00 0.03 0.00 0.00 46.19 42.61 2dhm s LEU 84 CO -0.06 -0.20 0.48 -1.00 0.23 0.00 0.00 176.35 175.80 2dhm s HIS 85 N 0.56 3.55 -0.20 0.29 3.76 -0.31 -4.96 115.29 117.99 2dhm s HIS 85 Ca 0.50 -3.32 -0.24 0.00 -0.15 0.00 0.00 55.06 51.85 2dhm s HIS 85 Cb -0.23 -2.73 -0.02 0.00 1.11 0.00 0.00 32.58 30.71 2dhm s HIS 85 CO 0.29 -0.57 0.77 0.95 -0.85 0.00 0.00 174.74 175.33 2dhm s THR 86 N -1.35 4.91 -0.01 1.30 -4.23 -1.26 -3.09 115.64 111.90 2dhm s THR 86 Ca 0.24 1.47 0.03 0.00 -1.18 0.00 0.00 61.69 62.25 2dhm s THR 86 Cb -0.07 -4.07 -0.00 0.00 1.34 0.00 0.00 72.50 69.70 2dhm s THR 86 CO -0.15 0.03 -0.09 -0.31 -0.54 0.00 0.00 174.62 173.55 2dhm s TYR 87 N 2.26 0.89 1.07 3.99 1.51 -1.21 -5.01 117.35 120.85 2dhm s TYR 87 Ca 0.34 -0.19 -0.16 0.00 -1.01 0.00 0.00 57.07 56.06 2dhm s TYR 87 Cb -0.16 -0.60 0.22 0.00 -0.11 0.00 0.00 41.96 41.31 2dhm s TYR 87 CO 0.10 -0.04 1.14 0.95 -1.11 0.00 0.00 175.55 176.59 2dhm s THR 88 N -0.08 1.83 0.30 -0.71 -4.23 -1.26 -3.07 115.64 108.42 2dhm s THR 88 Ca 0.01 0.00 0.03 0.00 -1.18 0.00 0.00 61.69 60.56 2dhm s THR 88 Cb -0.05 -2.62 0.10 0.00 1.34 0.00 0.00 72.50 71.27 2dhm s THR 88 CO -0.00 0.00 1.78 0.40 -0.54 0.00 0.00 174.62 176.26 2dhm h ILE 89 N -2.08 1.24 0.00 2.99 5.03 -1.92 -2.47 117.51 120.29 2dhm h ILE 89 Ca -0.48 -1.09 -0.00 0.00 -0.12 0.00 0.00 64.86 63.16 2dhm h ILE 89 Cb 1.30 1.21 -0.00 0.00 -3.03 0.00 0.00 36.82 36.30 2dhm h ILE 89 CO 0.46 0.35 -0.09 0.50 -0.68 0.00 0.00 178.15 178.69 2dhm h LYS 90 N 0.44 0.00 -0.05 2.37 1.63 -1.98 -2.50 116.57 116.48 2dhm h LYS 90 Ca 0.08 0.00 0.01 0.00 -0.85 0.00 0.00 60.65 59.89 2dhm h LYS 90 Cb 0.54 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 32.17 2dhm h LYS 90 CO 0.04 0.12 0.58 1.05 -3.45 0.00 0.00 179.45 177.78 2dhm h GLU 91 N -1.00 0.00 0.04 1.90 4.11 -1.94 0.60 114.58 118.29 2dhm h GLU 91 Ca -0.01 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 59.08 2dhm h GLU 91 Cb 0.19 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.39 2dhm h GLU 91 CO -0.00 0.00 -2.02 1.87 0.07 0.00 0.00 179.01 178.93 2dhm n TRP 92 N -2.81 0.79 -0.48 2.06 -0.00 -0.93 -2.82 117.44 113.25 2dhm n TRP 92 Ca -0.00 0.22 0.40 0.00 -0.00 0.00 0.00 57.50 58.13 2dhm n TRP 92 Cb 0.62 -1.12 0.67 0.00 -0.00 0.00 0.00 31.31 31.48 2dhm n TRP 92 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 177.69 178.08 2dhm n GLU 93 N -3.17 -0.03 -2.68 5.87 1.02 0.21 -3.59 120.64 118.27 2dhm n GLU 93 Ca -0.28 1.22 -0.05 0.00 -0.02 0.00 0.00 57.16 58.02 2dhm n GLU 93 Cb 1.06 -2.42 0.09 0.00 -0.02 0.00 0.00 31.44 30.15 2dhm n GLU 93 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dhm n GLY 94 N -1.54 -1.04 0.33 0.62 0.00 -1.23 -5.02 105.19 97.31 2dhm n GLY 94 Ca 0.40 0.68 0.06 0.00 0.00 0.00 0.00 46.02 47.16 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 2.76 -0.75 0.14 0.99 5.85 -1.58 0.17 115.31 122.90 2dhm h LEU 95 Ca -0.24 0.27 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 2dhm h LEU 95 Cb 1.18 0.54 0.00 0.00 0.37 0.00 0.00 40.66 42.75 2dhm h LEU 95 CO 0.00 -0.30 -0.07 1.56 -0.34 0.00 0.00 178.44 179.29 2dhm h GLN 96 N 0.01 -0.18 -6.36 1.25 1.08 -1.92 -3.46 115.11 105.52 2dhm h GLN 96 Ca 0.47 0.01 -0.48 0.00 -1.45 0.00 0.00 58.65 57.20 2dhm h GLN 96 Cb 0.78 0.04 -0.05 0.00 -0.05 0.00 0.00 27.48 28.20 2dhm h GLN 96 CO -0.92 -0.12 -0.79 -3.47 -0.95 0.00 0.00 178.83 172.57 2dhm n ASP 97 N -5.17 -3.60 -0.13 1.46 2.03 0.60 -4.87 116.55 106.86 2dhm n ASP 97 Ca -0.08 -0.84 -0.09 0.00 0.52 0.00 0.00 54.79 54.29 2dhm n ASP 97 Cb 0.10 -3.66 -0.01 0.00 -0.72 0.00 0.00 41.12 36.83 2dhm n ASP 97 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2dhm h THR 98 N -1.94 1.22 -2.41 5.18 1.35 -1.90 -3.43 112.91 110.98 2dhm h THR 98 Ca -0.59 -0.73 -0.61 0.00 -0.55 0.00 0.00 66.41 63.93 2dhm h THR 98 Cb 1.37 0.96 0.08 0.00 -1.73 0.00 0.00 68.15 68.83 2dhm h THR 98 CO 0.67 0.26 0.48 1.33 -0.25 0.00 0.00 175.52 178.00 2dhm n VAL 99 N -4.59 0.96 -0.13 6.82 0.24 -1.26 -4.92 118.33 115.44 2dhm n VAL 99 Ca -0.00 -0.24 -0.27 0.00 -2.04 0.00 0.00 64.34 61.78 2dhm n VAL 99 Cb 0.19 -1.24 -0.11 0.00 -1.47 0.00 0.00 33.84 31.21 2dhm n VAL 99 CO 0.00 0.00 0.00 0.49 -2.14 0.00 0.00 176.83 175.18 2dhm n PHE 100 N 1.71 0.28 -1.57 6.34 3.72 -1.26 -4.97 117.46 121.71 2dhm n PHE 100 Ca 0.13 0.12 -0.41 0.00 -0.05 0.00 0.00 57.45 57.23 2dhm n PHE 100 Cb 0.29 -1.03 0.01 0.00 -0.94 0.00 0.00 39.48 37.81 2dhm n PHE 100 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2dhm n ALA 101 N -3.97 -0.25 -3.58 4.37 0.00 -1.26 -5.00 120.51 110.80 2dhm n ALA 101 Ca -0.48 0.22 -0.14 0.00 0.00 0.00 0.00 53.44 53.03 2dhm n ALA 101 Cb 0.84 -2.00 -0.06 0.00 0.00 0.00 0.00 19.45 18.23 2dhm n ALA 101 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2dhm s SER 102 N -0.81 -0.61 0.51 0.00 0.01 -1.26 -5.16 113.70 106.38 2dhm s SER 102 Ca 0.64 0.92 -0.21 0.00 1.31 0.00 0.00 55.95 58.61 2dhm s SER 102 Cb -0.57 0.85 -0.07 0.00 0.21 0.00 0.00 66.02 66.44 2dhm s SER 102 CO 0.57 -0.38 1.14 -2.16 0.41 0.00 0.00 173.24 172.83 2dhm s PRO 103 N -0.45 3.54 0.72 12.44 0.04 -1.26 -5.04 135.00 144.98 2dhm s PRO 103 Ca -0.04 1.68 -0.12 0.00 0.04 0.00 0.00 61.00 62.56 2dhm s PRO 103 Cb -0.02 -2.18 0.18 0.00 0.04 0.00 0.00 34.50 32.51 2dhm s PRO 103 CO 0.03 -0.71 0.64 -0.35 0.04 0.00 0.00 177.00 176.64 2dhm n PRO 104 N -0.94 -2.26 -4.18 0.56 -0.04 -1.26 -5.10 135.00 121.78 2dhm n PRO 104 Ca 0.10 -1.02 -0.13 0.00 -0.04 0.00 0.00 63.50 62.40 2dhm n PRO 104 Cb 0.50 -0.95 -0.08 0.00 -0.04 0.00 0.00 33.50 32.92 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 -3.88 1.08 0.00 0.00 3.52 -1.26 -5.36 118.95 113.04 2dhm s ARG 106 Ca 0.36 -0.63 0.00 0.00 -0.13 0.00 0.00 55.73 55.33 2dhm s ARG 106 Cb 0.04 0.48 0.00 0.00 -1.56 0.00 0.00 34.95 33.91 2dhm s ARG 106 CO 0.16 -0.42 0.44 0.41 -0.81 0.00 0.00 175.30 175.08