#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1um7 s SER 2 N 0.00 -0.15 -0.07 1.61 1.04 -1.26 -5.19 113.70 109.68 1um7 s SER 2 Ca 0.00 0.01 -0.32 0.00 0.48 0.00 0.00 55.95 56.12 1um7 s SER 2 Cb 0.00 0.16 0.13 0.00 0.10 0.00 0.00 66.02 66.41 1um7 s SER 2 CO 0.00 -0.25 1.38 -0.94 0.98 0.00 0.00 173.24 174.41 1um7 s SER 3 N -2.16 -0.01 -0.27 7.02 1.04 -1.26 -5.19 113.70 112.88 1um7 s SER 3 Ca 0.09 -0.06 -0.28 0.00 0.48 0.00 0.00 55.95 56.18 1um7 s SER 3 Cb -0.01 0.06 0.17 0.00 0.10 0.00 0.00 66.02 66.34 1um7 s SER 3 CO -0.05 -0.11 1.29 -0.83 0.98 0.00 0.00 173.24 174.52 1um7 s GLY 4 N -3.22 0.08 0.06 7.32 0.00 -1.26 -5.19 107.32 105.11 1um7 s GLY 4 Ca 0.19 2.88 -0.27 0.00 0.00 0.00 0.00 44.72 47.52 1um7 s GLY 4 CO -0.05 1.40 1.18 -1.35 0.00 0.00 0.00 173.10 174.28 1um7 s SER 5 N -0.62 -0.03 0.39 1.64 1.04 -1.26 -5.18 113.70 109.68 1um7 s SER 5 Ca 0.06 -0.35 0.08 0.00 0.48 0.00 0.00 55.95 56.22 1um7 s SER 5 Cb -0.02 0.29 -0.05 0.00 0.10 0.00 0.00 66.02 66.34 1um7 s SER 5 CO -0.08 -0.57 0.17 -0.44 0.98 0.00 0.00 173.24 173.30 1um7 s SER 6 N -3.38 4.50 -0.27 7.02 0.01 -1.26 -5.13 113.70 115.20 1um7 s SER 6 Ca 0.21 -0.98 -0.00 0.00 1.31 0.00 0.00 55.95 56.49 1um7 s SER 6 Cb 0.00 -0.54 0.15 0.00 0.21 0.00 0.00 66.02 65.84 1um7 s SER 6 CO 0.01 -0.47 0.40 -0.83 0.41 0.00 0.00 173.24 172.76 1um7 s GLY 7 N -3.89 -0.51 0.44 3.44 0.00 -1.26 -5.15 107.32 100.38 1um7 s GLY 7 Ca 0.40 0.59 -0.23 0.00 0.00 0.00 0.00 44.72 45.48 1um7 s GLY 7 CO 0.23 2.88 1.06 0.50 0.00 0.00 0.00 173.10 177.78 1um7 s ARG 8 N 2.55 3.98 1.00 2.90 0.52 -1.26 -5.04 118.95 123.60 1um7 s ARG 8 Ca 0.11 1.51 -0.15 0.00 -0.52 0.00 0.00 55.73 56.68 1um7 s ARG 8 Cb -0.14 -2.37 0.19 0.00 0.52 0.00 0.00 34.95 33.15 1um7 s ARG 8 CO -0.23 -0.30 1.18 -1.25 0.02 0.00 0.00 175.30 174.71 1um7 s PRO 9 N -2.77 0.40 0.00 3.54 0.04 -1.26 -5.05 135.00 129.90 1um7 s PRO 9 Ca 0.62 0.01 0.00 0.00 0.04 0.00 0.00 61.00 61.67 1um7 s PRO 9 Cb -0.21 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1um7 s PRO 9 CO 0.26 -2.65 0.00 0.41 0.04 0.00 0.00 177.00 175.07 1um7 n GLY 10 N -2.30 4.58 0.00 0.56 0.00 -1.26 -5.19 105.19 101.57 1um7 n GLY 10 Ca 0.11 -0.99 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1um7 n GLY 10 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1um7 n GLY 11 N -1.18 0.33 0.91 -0.02 0.00 -1.26 -5.03 105.19 98.94 1um7 n GLY 11 Ca 0.00 -0.87 0.05 0.00 0.00 0.00 0.00 46.02 45.20 1um7 n GLY 11 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1um7 n ASP 12 N 0.00 1.41 -3.27 1.61 8.00 -1.26 -4.97 116.55 118.07 1um7 n ASP 12 Ca 0.00 -3.06 -0.16 0.00 0.71 0.00 0.00 54.79 52.28 1um7 n ASP 12 Cb 0.00 -0.42 0.08 0.00 -0.02 0.00 0.00 41.12 40.76 1um7 n ASP 12 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1um7 n ALA 13 N -0.47 -1.94 -0.04 2.24 0.00 -1.26 -4.93 120.51 114.10 1um7 n ALA 13 Ca 0.13 -0.04 -0.06 0.00 0.00 0.00 0.00 53.44 53.47 1um7 n ALA 13 Cb 0.86 -2.62 -0.03 0.00 0.00 0.00 0.00 19.45 17.66 1um7 n ALA 13 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1um7 n ARG 14 N -3.86 0.19 -0.89 0.00 5.12 -1.26 -4.32 116.66 111.64 1um7 n ARG 14 Ca -0.25 0.05 -0.29 0.00 -1.93 0.00 0.00 57.85 55.43 1um7 n ARG 14 Cb 0.66 -1.08 0.23 0.00 -1.16 0.00 0.00 32.46 31.11 1um7 n ARG 14 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 1um7 s GLU 15 N -2.16 -0.97 0.85 5.56 2.02 -1.26 -4.36 118.70 118.38 1um7 s GLU 15 Ca -0.11 0.32 -0.12 0.00 0.02 0.00 0.00 54.97 55.08 1um7 s GLU 15 Cb 0.03 -1.59 0.10 0.00 0.10 0.00 0.00 34.13 32.77 1um7 s GLU 15 CO 0.17 -3.63 1.11 -1.25 0.02 0.00 0.00 175.26 171.69 1um7 s PRO 16 N -5.02 1.69 -0.20 0.39 0.04 -1.26 -4.17 135.00 126.47 1um7 s PRO 16 Ca 0.68 0.49 -0.12 0.00 0.04 0.00 0.00 61.00 62.09 1um7 s PRO 16 Cb -0.16 -1.89 0.06 0.00 0.04 0.00 0.00 34.50 32.55 1um7 s PRO 16 CO 0.59 -1.86 0.49 -0.98 0.04 0.00 0.00 177.00 175.27 1um7 s ARG 17 N -5.21 0.50 -0.40 4.56 1.70 -0.13 -4.91 118.95 115.05 1um7 s ARG 17 Ca 0.62 0.87 -0.29 0.00 -0.47 0.00 0.00 55.73 56.47 1um7 s ARG 17 Cb -0.15 0.06 0.00 0.00 -0.57 0.00 0.00 34.95 34.30 1um7 s ARG 17 CO 0.54 -0.14 1.48 0.21 -1.08 0.00 0.00 175.30 176.31 1um7 s LYS 18 N 1.27 3.53 -0.07 3.89 2.20 -1.26 -2.69 119.74 126.61 1um7 s LYS 18 Ca -0.08 1.02 0.01 0.00 -0.36 0.00 0.00 55.97 56.56 1um7 s LYS 18 Cb -0.07 -4.06 -0.03 0.00 -1.51 0.00 0.00 37.83 32.17 1um7 s LYS 18 CO -0.12 -1.62 -0.06 0.42 -0.36 0.00 0.00 175.35 173.60 1um7 s ILE 19 N 5.69 3.75 -0.28 5.43 1.01 0.53 -4.98 121.20 132.35 1um7 s ILE 19 Ca 0.65 -0.46 0.02 0.00 0.00 0.00 0.00 60.65 60.85 1um7 s ILE 19 Cb -0.15 -2.54 0.08 0.00 0.01 0.00 0.00 42.46 39.86 1um7 s ILE 19 CO 0.33 0.60 -0.00 -0.63 0.00 0.00 0.00 174.94 175.24 1um7 s ILE 20 N -0.81 1.72 0.07 2.92 1.01 -1.26 0.19 121.20 125.03 1um7 s ILE 20 Ca 0.12 -1.66 -0.05 0.00 0.00 0.00 0.00 60.65 59.06 1um7 s ILE 20 Cb -0.11 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.20 1um7 s ILE 20 CO 0.01 -0.35 0.31 -0.76 0.00 0.00 0.00 174.94 174.15 1um7 s LEU 21 N 1.24 4.33 -0.36 2.97 2.01 -0.53 -4.93 118.68 123.41 1um7 s LEU 21 Ca 0.02 0.55 -0.03 0.00 0.01 0.00 0.00 54.13 54.68 1um7 s LEU 21 Cb -0.19 -2.95 0.08 0.00 0.01 0.00 0.00 46.19 43.14 1um7 s LEU 21 CO -0.10 0.17 0.13 -1.00 1.01 0.00 0.00 176.35 176.55 1um7 s HIS 22 N -1.46 3.42 -0.50 0.29 3.76 -1.26 -2.19 115.29 117.35 1um7 s HIS 22 Ca 0.33 -2.03 -0.45 0.00 -0.15 0.00 0.00 55.06 52.77 1um7 s HIS 22 Cb -0.13 -2.70 -0.19 0.00 1.11 0.00 0.00 32.58 30.67 1um7 s HIS 22 CO 0.21 -0.87 2.04 1.63 -0.85 0.00 0.00 174.74 176.89 1um7 n LYS 23 N 4.66 0.00 -0.03 1.40 5.02 -0.71 -4.65 118.16 123.85 1um7 n LYS 23 Ca -0.08 0.00 -0.13 0.00 -2.02 0.00 0.00 58.31 56.08 1um7 n LYS 23 Cb 0.43 -1.50 -0.10 0.00 -0.02 0.00 0.00 35.03 33.84 1um7 n LYS 23 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1um7 h GLY 24 N 8.23 0.10 0.00 0.72 0.00 -1.86 -3.47 103.07 106.79 1um7 h GLY 24 Ca -0.16 -0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.04 1um7 h GLY 24 CO 1.07 0.11 0.00 1.44 0.00 0.00 0.00 176.54 179.16 1um7 n SER 25 N -4.72 0.00 -0.05 0.19 7.64 -1.26 -4.97 113.62 110.45 1um7 n SER 25 Ca -0.08 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.58 1um7 n SER 25 Cb 0.33 0.00 -0.13 0.00 -1.01 0.00 0.00 64.21 63.40 1um7 n SER 25 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1um7 n THR 26 N -0.64 1.67 0.00 0.44 -2.24 -1.26 -5.09 114.28 107.16 1um7 n THR 26 Ca 0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1um7 n THR 26 Cb 0.00 -1.77 0.00 0.00 -2.10 0.00 0.00 70.33 66.46 1um7 n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1um7 n GLY 27 N 1.86 -0.83 0.02 3.38 0.00 -1.26 -4.95 105.19 103.41 1um7 n GLY 27 Ca -0.35 -0.24 0.13 0.00 0.00 0.00 0.00 46.02 45.56 1um7 n GLY 27 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1um7 n LEU 28 N 0.00 0.23 -1.45 0.99 7.99 -1.26 -2.56 117.00 120.94 1um7 n LEU 28 Ca 0.00 0.25 -0.05 0.00 -0.01 0.00 0.00 56.01 56.21 1um7 n LEU 28 Cb 0.00 -0.36 0.02 0.00 -0.11 0.00 0.00 43.42 42.97 1um7 n LEU 28 CO 0.00 0.05 0.04 0.61 -1.51 0.00 0.00 177.39 176.58 1um7 n GLY 29 N 1.45 0.38 3.59 -0.72 0.00 -1.26 -0.74 105.19 107.89 1um7 n GLY 29 Ca 0.08 -0.38 -0.09 0.00 0.00 0.00 0.00 46.02 45.63 1um7 n GLY 29 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1um7 s PHE 30 N -3.08 -0.34 0.44 1.61 -0.12 -1.26 0.75 117.98 115.97 1um7 s PHE 30 Ca 0.05 0.63 0.08 0.00 -0.05 0.00 0.00 56.93 57.64 1um7 s PHE 30 Cb -0.02 0.44 0.01 0.00 -0.63 0.00 0.00 43.02 42.82 1um7 s PHE 30 CO 0.17 -0.29 0.51 1.21 -0.05 0.00 0.00 175.22 176.78 1um7 s ASN 31 N -0.91 5.32 0.05 1.98 3.84 0.12 -4.94 114.94 120.40 1um7 s ASN 31 Ca 0.00 -0.63 0.00 0.00 0.21 0.00 0.00 52.86 52.45 1um7 s ASN 31 Cb -0.01 -0.47 -0.03 0.00 -0.55 0.00 0.00 41.25 40.19 1um7 s ASN 31 CO -0.01 -0.80 -0.05 0.27 -2.79 0.00 0.00 177.10 173.73 1um7 s ILE 32 N -2.45 0.35 0.30 -5.21 -4.36 -1.26 -1.91 121.20 106.67 1um7 s ILE 32 Ca 0.52 -1.45 0.05 0.00 -0.26 0.00 0.00 60.65 59.52 1um7 s ILE 32 Cb -0.07 -1.03 -0.03 0.00 1.25 0.00 0.00 42.46 42.58 1um7 s ILE 32 CO 0.31 -0.71 0.26 0.68 0.24 0.00 0.00 174.94 175.71 1um7 s VAL 33 N -2.68 0.00 0.00 8.37 -7.23 0.45 -4.61 120.40 114.70 1um7 s VAL 33 Ca -0.02 -1.98 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1um7 s VAL 33 Cb -0.01 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.43 1um7 s VAL 33 CO -0.04 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.36 1um7 n GLY 34 N -0.54 -2.35 0.00 2.32 0.00 -1.26 -1.50 105.19 101.86 1um7 n GLY 34 Ca 0.06 -2.12 0.00 0.00 0.00 0.00 0.00 46.02 43.96 1um7 n GLY 34 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1um7 n GLY 35 N -0.07 0.81 2.70 -0.02 0.00 -1.13 -3.69 105.19 103.78 1um7 n GLY 35 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 1um7 n GLY 35 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1um7 s GLU 36 N 0.38 -0.06 -1.49 1.61 2.02 -1.26 -4.57 118.70 115.33 1um7 s GLU 36 Ca 0.00 0.39 -0.15 0.00 0.02 0.00 0.00 54.97 55.22 1um7 s GLU 36 Cb 0.00 -0.46 0.13 0.00 0.10 0.00 0.00 34.13 33.90 1um7 s GLU 36 CO 0.00 -0.31 0.63 -3.47 0.02 0.00 0.00 175.26 172.13 1um7 n ASP 37 N 5.21 -3.17 -3.76 -0.19 2.03 -1.26 -0.53 116.55 114.88 1um7 n ASP 37 Ca -0.05 -0.75 -0.29 0.00 0.52 0.00 0.00 54.79 54.22 1um7 n ASP 37 Cb 0.50 -2.63 0.03 0.00 -0.72 0.00 0.00 41.12 38.30 1um7 n ASP 37 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1um7 n GLY 38 N -1.23 -0.72 0.07 0.27 0.00 -1.26 -4.88 105.19 97.44 1um7 n GLY 38 Ca 0.05 0.34 -0.07 0.00 0.00 0.00 0.00 46.02 46.34 1um7 n GLY 38 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1um7 h GLU 39 N -1.90 0.00 0.00 1.61 4.11 -1.09 -3.45 114.58 113.87 1um7 h GLU 39 Ca -0.65 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.78 1um7 h GLU 39 Cb 1.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.62 1um7 h GLU 39 CO 0.53 0.73 0.00 0.41 0.07 0.00 0.00 179.01 180.75 1um7 n GLY 40 N 1.44 0.57 3.17 1.06 0.00 -1.25 -5.02 105.19 105.16 1um7 n GLY 40 Ca -0.08 -2.19 -0.22 0.00 0.00 0.00 0.00 46.02 43.53 1um7 n GLY 40 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1um7 s ILE 41 N -0.71 1.27 -0.05 -0.61 -1.09 -1.25 -2.83 121.20 115.92 1um7 s ILE 41 Ca 0.00 -1.00 -0.09 0.00 -2.23 0.00 0.00 60.65 57.33 1um7 s ILE 41 Cb 0.00 -1.12 0.02 0.00 -1.58 0.00 0.00 42.46 39.77 1um7 s ILE 41 CO 0.00 0.11 0.21 -0.36 -1.23 0.00 0.00 174.94 173.67 1um7 s PHE 42 N -0.77 -0.15 0.38 3.97 0.40 -0.56 -0.85 117.98 120.40 1um7 s PHE 42 Ca 0.04 0.34 -0.28 0.00 -0.60 0.00 0.00 56.93 56.43 1um7 s PHE 42 Cb -0.08 0.05 -0.10 0.00 0.51 0.00 0.00 43.02 43.40 1um7 s PHE 42 CO 0.01 -0.21 1.43 0.08 0.70 0.00 0.00 175.22 177.23 1um7 s VAL 43 N -0.55 2.22 -0.18 -0.44 1.01 0.62 0.17 120.40 123.25 1um7 s VAL 43 Ca -0.06 0.22 0.18 0.00 0.00 0.00 0.00 61.98 62.31 1um7 s VAL 43 Cb -0.04 -3.14 -0.27 0.00 0.00 0.00 0.00 36.38 32.94 1um7 s VAL 43 CO 0.01 0.05 0.47 -1.54 0.00 0.00 0.00 175.10 174.09 1um7 n SER 44 N 0.41 0.83 0.00 3.32 3.41 -0.80 -3.28 113.62 117.52 1um7 n SER 44 Ca 0.01 -0.17 0.00 0.00 -0.26 0.00 0.00 58.87 58.45 1um7 n SER 44 Cb 0.40 1.68 0.00 0.00 -0.26 0.00 0.00 64.21 66.03 1um7 n SER 44 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1um7 n PHE 45 N -2.00 0.00 -3.96 7.33 7.35 -1.26 -4.91 117.46 120.02 1um7 n PHE 45 Ca -0.02 0.00 -0.25 0.00 -0.76 0.00 0.00 57.45 56.42 1um7 n PHE 45 Cb 0.44 0.00 -0.17 0.00 0.35 0.00 0.00 39.48 40.10 1um7 n PHE 45 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1um7 s ILE 46 N -2.00 0.80 0.34 -2.13 -1.09 -1.26 0.14 121.20 116.00 1um7 s ILE 46 Ca 0.00 -0.17 -0.28 0.00 -2.23 0.00 0.00 60.65 57.96 1um7 s ILE 46 Cb 0.00 -0.85 -0.12 0.00 -1.58 0.00 0.00 42.46 39.92 1um7 s ILE 46 CO 0.00 0.32 1.43 -0.11 -1.23 0.00 0.00 174.94 175.35 1um7 n LEU 47 N 4.79 4.17 -4.60 2.97 -0.00 0.23 -4.90 117.00 119.66 1um7 n LEU 47 Ca -0.13 1.20 -0.43 0.00 -0.00 0.00 0.00 56.01 56.65 1um7 n LEU 47 Cb 0.50 -1.55 -0.03 0.00 -0.00 0.00 0.00 43.42 42.34 1um7 n LEU 47 CO 0.16 -0.12 0.87 0.00 -0.00 0.00 0.00 177.39 178.31 1um7 s ALA 48 N -0.89 3.31 0.00 1.96 0.00 -1.26 -2.92 121.76 121.96 1um7 s ALA 48 Ca 0.56 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.06 1um7 s ALA 48 Cb -0.52 -3.69 0.00 0.00 0.00 0.00 0.00 23.12 18.91 1um7 s ALA 48 CO 0.60 -1.87 0.00 0.41 0.00 0.00 0.00 175.76 174.90 1um7 n GLY 49 N 4.55 1.10 1.83 0.00 0.00 -1.26 -5.08 105.19 106.33 1um7 n GLY 49 Ca 0.09 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.95 1um7 n GLY 49 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1um7 n GLY 50 N -1.63 -2.78 0.17 -0.02 0.00 -1.15 -4.54 105.19 95.23 1um7 n GLY 50 Ca 0.00 -1.44 -0.13 0.00 0.00 0.00 0.00 46.02 44.45 1um7 n GLY 50 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1um7 h PRO 51 N 0.00 0.44 0.00 1.61 0.13 -1.82 0.57 132.00 132.93 1um7 h PRO 51 Ca -0.22 -0.43 0.00 0.00 -0.87 0.00 0.00 66.00 64.48 1um7 h PRO 51 Cb 0.67 0.11 0.00 0.00 0.13 0.00 0.00 31.00 31.91 1um7 h PRO 51 CO 0.14 1.08 0.00 0.00 -0.23 0.00 0.00 178.00 178.99 1um7 h ALA 52 N 0.78 1.00 0.00 -0.56 0.00 -1.12 -0.22 119.26 119.13 1um7 h ALA 52 Ca -0.06 0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 1um7 h ALA 52 Cb 1.48 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 19.25 1um7 h ALA 52 CO 0.15 0.00 -1.39 -3.47 0.00 0.00 0.00 179.25 174.54 1um7 n ASP 53 N -2.83 1.94 -0.26 0.00 2.03 -1.10 -3.53 116.55 112.79 1um7 n ASP 53 Ca 0.00 0.35 0.08 0.00 0.52 0.00 0.00 54.79 55.74 1um7 n ASP 53 Cb 0.23 -0.77 0.21 0.00 -0.72 0.00 0.00 41.12 40.06 1um7 n ASP 53 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1um7 h LEU 54 N -1.00 -0.01 -0.80 -2.67 3.38 0.13 0.51 115.31 114.84 1um7 h LEU 54 Ca -0.20 0.16 0.08 0.00 0.09 0.00 0.00 57.88 58.01 1um7 h LEU 54 Cb 1.14 0.23 -0.07 0.00 0.09 0.00 0.00 40.66 42.05 1um7 h LEU 54 CO -0.12 -0.08 0.46 0.77 0.09 0.00 0.00 178.44 179.57 1um7 h SER 55 N 0.25 0.68 0.00 -0.43 4.64 -1.23 -3.46 113.55 114.00 1um7 h SER 55 Ca 0.45 0.04 0.00 0.00 -0.47 0.00 0.00 61.79 61.81 1um7 h SER 55 Cb 0.82 -0.10 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1um7 h SER 55 CO -0.56 0.42 0.00 0.61 -0.87 0.00 0.00 176.83 176.42 1um7 n GLY 56 N -1.31 3.18 0.15 -0.77 0.00 0.18 -4.87 105.19 101.75 1um7 n GLY 56 Ca 0.12 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.09 1um7 n GLY 56 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1um7 h GLU 57 N 1.74 -0.33 -6.43 1.61 4.39 -1.82 -3.43 114.58 110.30 1um7 h GLU 57 Ca 0.00 0.02 -0.53 0.00 0.34 0.00 0.00 59.36 59.19 1um7 h GLU 57 Cb 0.00 0.08 0.02 0.00 -0.10 0.00 0.00 28.75 28.74 1um7 h GLU 57 CO 0.00 -0.22 1.02 -1.17 -1.16 0.00 0.00 179.01 177.48 1um7 s LEU 58 N -6.58 4.37 0.02 1.33 2.96 -1.23 -4.98 118.68 114.56 1um7 s LEU 58 Ca -0.05 2.48 -0.00 0.00 -0.22 0.00 0.00 54.13 56.34 1um7 s LEU 58 Cb 0.01 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 43.12 1um7 s LEU 58 CO 0.15 -0.90 -0.03 -0.13 -1.32 0.00 0.00 176.35 174.12 1um7 s ARG 59 N 2.86 0.32 0.02 1.98 0.52 -1.26 -4.37 118.95 119.01 1um7 s ARG 59 Ca 0.75 -0.63 -0.35 0.00 -0.52 0.00 0.00 55.73 54.98 1um7 s ARG 59 Cb -0.40 0.11 -0.13 0.00 0.52 0.00 0.00 34.95 35.05 1um7 s ARG 59 CO 0.33 -0.05 1.69 -2.13 0.02 0.00 0.00 175.30 175.15 1um7 n ARG 60 N 1.56 1.99 0.00 3.54 0.63 -1.26 -1.65 116.66 121.47 1um7 n ARG 60 Ca -0.24 0.72 0.00 0.00 -0.92 0.00 0.00 57.85 57.42 1um7 n ARG 60 Cb 0.55 -2.50 0.00 0.00 0.45 0.00 0.00 32.46 30.96 1um7 n ARG 60 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1um7 n GLY 61 N 3.78 1.45 3.24 5.14 0.00 -1.20 -4.87 105.19 112.72 1um7 n GLY 61 Ca 0.20 -0.39 -0.38 0.00 0.00 0.00 0.00 46.02 45.45 1um7 n GLY 61 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1um7 n ASP 62 N 0.02 -3.68 -4.15 1.61 8.00 -0.66 -3.95 116.55 113.75 1um7 n ASP 62 Ca 0.00 0.53 -0.36 0.00 0.71 0.00 0.00 54.79 55.66 1um7 n ASP 62 Cb 0.00 -0.91 -0.12 0.00 -0.02 0.00 0.00 41.12 40.07 1um7 n ASP 62 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1um7 s ARG 63 N -1.64 2.14 0.14 -1.24 3.52 -0.12 -0.28 118.95 121.48 1um7 s ARG 63 Ca 0.55 -1.68 -0.33 0.00 -0.13 0.00 0.00 55.73 54.13 1um7 s ARG 63 Cb -0.39 -3.54 -0.13 0.00 -1.56 0.00 0.00 34.95 29.34 1um7 s ARG 63 CO 0.68 -0.98 1.68 -0.89 -0.81 0.00 0.00 175.30 174.98 1um7 n ILE 64 N 4.64 0.11 -0.06 4.11 2.08 -0.03 -2.32 119.36 127.88 1um7 n ILE 64 Ca -0.05 -0.02 -0.10 0.00 0.56 0.00 0.00 62.75 63.15 1um7 n ILE 64 Cb 0.42 -1.75 -0.06 0.00 -0.75 0.00 0.00 39.64 37.50 1um7 n ILE 64 CO 0.00 0.00 0.00 0.18 0.56 0.00 0.00 176.55 177.29 1um7 n LEU 65 N 4.19 2.77 -3.59 1.39 4.77 0.10 -3.94 117.00 122.68 1um7 n LEU 65 Ca 0.17 -0.04 -0.16 0.00 -0.03 0.00 0.00 56.01 55.96 1um7 n LEU 65 Cb 0.31 -0.44 -0.06 0.00 -2.33 0.00 0.00 43.42 40.90 1um7 n LEU 65 CO 0.65 0.67 0.30 -0.94 -1.33 0.00 0.00 177.39 176.74 1um7 s SER 66 N -5.35 -0.49 -0.07 -1.43 1.04 -0.99 -2.97 113.70 103.45 1um7 s SER 66 Ca -0.17 0.41 0.02 0.00 0.48 0.00 0.00 55.95 56.69 1um7 s SER 66 Cb 0.05 0.47 0.01 0.00 0.10 0.00 0.00 66.02 66.65 1um7 s SER 66 CO 0.29 -0.61 -0.13 -0.69 0.98 0.00 0.00 173.24 173.08 1um7 s VAL 67 N -1.63 1.19 -1.29 5.02 1.01 -1.14 -0.48 120.40 123.09 1um7 s VAL 67 Ca -0.10 -0.52 0.00 0.00 0.00 0.00 0.00 61.98 61.36 1um7 s VAL 67 Cb -0.01 -1.08 0.00 0.00 0.00 0.00 0.00 36.38 35.28 1um7 s VAL 67 CO 0.05 0.37 0.00 -3.20 0.00 0.00 0.00 175.10 172.32 1um7 n ASN 68 N 3.75 -3.41 -0.51 3.32 2.85 0.27 -0.20 115.26 121.32 1um7 n ASN 68 Ca -0.22 0.30 0.00 0.00 -0.11 0.00 0.00 54.58 54.55 1um7 n ASN 68 Cb 0.52 -3.14 0.00 0.00 1.24 0.00 0.00 39.78 38.40 1um7 n ASN 68 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1um7 n GLY 69 N -0.19 0.71 3.39 8.20 0.00 -1.26 -4.90 105.19 111.14 1um7 n GLY 69 Ca -0.12 -0.39 -0.30 0.00 0.00 0.00 0.00 46.02 45.21 1um7 n GLY 69 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1um7 s VAL 70 N -2.51 2.33 -0.45 1.61 0.11 0.72 -5.09 120.40 117.12 1um7 s VAL 70 Ca 0.00 -1.54 -0.22 0.00 -2.93 0.00 0.00 61.98 57.29 1um7 s VAL 70 Cb 0.00 -1.99 0.03 0.00 -1.53 0.00 0.00 36.38 32.89 1um7 s VAL 70 CO 0.00 0.22 0.73 0.21 -3.33 0.00 0.00 175.10 172.93 1um7 s ASN 71 N -1.71 6.38 0.00 3.54 3.84 -1.26 -2.87 114.94 122.86 1um7 s ASN 71 Ca 0.14 -0.20 0.00 0.00 0.21 0.00 0.00 52.86 53.01 1um7 s ASN 71 Cb -0.10 -2.36 0.00 0.00 -0.55 0.00 0.00 41.25 38.24 1um7 s ASN 71 CO 0.05 -0.87 0.65 0.18 -2.79 0.00 0.00 177.10 174.32 1um7 n LEU 72 N 6.55 1.22 -0.29 3.21 4.77 -1.16 -4.73 117.00 126.58 1um7 n LEU 72 Ca 0.01 -1.22 0.24 0.00 -0.03 0.00 0.00 56.01 55.00 1um7 n LEU 72 Cb 0.48 0.00 0.44 0.00 -2.33 0.00 0.00 43.42 42.01 1um7 n LEU 72 CO 0.57 0.31 0.87 0.54 -1.33 0.00 0.00 177.39 178.35 1um7 n ARG 73 N -0.19 -0.06 -2.59 3.23 1.74 -1.20 -0.22 116.66 117.37 1um7 n ARG 73 Ca 0.00 1.26 -0.15 0.00 -0.77 0.00 0.00 57.85 58.19 1um7 n ARG 73 Cb 0.15 -2.18 0.02 0.00 -1.02 0.00 0.00 32.46 29.43 1um7 n ARG 73 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1um7 n ASN 74 N -5.10 2.59 -4.77 0.55 4.13 -1.26 -3.80 115.26 107.59 1um7 n ASN 74 Ca 0.30 -3.04 -0.26 0.00 1.68 0.00 0.00 54.58 53.27 1um7 n ASN 74 Cb 1.00 -0.50 -0.06 0.00 -1.54 0.00 0.00 39.78 38.69 1um7 n ASN 74 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1um7 s ALA 75 N -3.29 3.50 0.57 5.41 0.00 0.70 -4.78 121.76 123.86 1um7 s ALA 75 Ca 0.34 -1.28 -0.15 0.00 0.00 0.00 0.00 51.96 50.88 1um7 s ALA 75 Cb 0.43 -1.28 -0.06 0.00 0.00 0.00 0.00 23.12 22.22 1um7 s ALA 75 CO -0.04 0.46 1.02 0.95 0.00 0.00 0.00 175.76 178.15 1um7 s THR 76 N -1.81 4.38 0.20 0.00 -4.23 -1.26 -4.33 115.64 108.59 1um7 s THR 76 Ca 0.31 1.03 -0.22 0.00 -1.18 0.00 0.00 61.69 61.62 1um7 s THR 76 Cb -0.10 -3.66 0.13 0.00 1.34 0.00 0.00 72.50 70.21 1um7 s THR 76 CO 0.23 -0.76 1.55 -0.74 -0.54 0.00 0.00 174.62 174.36 1um7 h HIS 77 N 0.44 -1.37 0.03 3.99 2.76 -1.81 0.27 115.15 119.47 1um7 h HIS 77 Ca -0.46 0.11 0.02 0.00 -2.20 0.00 0.00 60.37 57.85 1um7 h HIS 77 Cb 1.19 0.74 -0.05 0.00 1.55 0.00 0.00 27.41 30.84 1um7 h HIS 77 CO 0.63 -0.39 -0.47 1.49 -1.30 0.00 0.00 177.93 177.89 1um7 h GLU 78 N -0.02 -0.62 -0.81 5.26 4.81 -1.92 0.10 114.58 121.39 1um7 h GLU 78 Ca 0.27 0.04 0.20 0.00 -0.13 0.00 0.00 59.36 59.74 1um7 h GLU 78 Cb 0.53 0.14 -0.13 0.00 0.63 0.00 0.00 28.75 29.92 1um7 h GLU 78 CO -0.95 -0.41 0.13 1.96 -0.73 0.00 0.00 179.01 179.01 1um7 h GLN 79 N -0.64 0.17 -0.25 1.92 4.20 -1.08 1.82 115.11 121.25 1um7 h GLN 79 Ca 0.03 -0.01 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1um7 h GLN 79 Cb 0.70 -0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1um7 h GLN 79 CO -0.32 0.11 0.06 0.00 -0.67 0.00 0.00 178.83 178.01 1um7 h ALA 80 N 1.72 1.64 0.04 3.87 0.00 0.69 -1.60 119.26 125.62 1um7 h ALA 80 Ca 0.47 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 55.17 1um7 h ALA 80 Cb 0.89 -0.11 0.01 0.00 0.00 0.00 0.00 17.79 18.58 1um7 h ALA 80 CO -0.64 0.28 -0.45 0.00 0.00 0.00 0.00 179.25 178.45 1um7 h ALA 81 N 1.72 -0.00 -0.59 0.00 0.00 0.42 -3.16 119.26 117.65 1um7 h ALA 81 Ca 0.09 -0.56 0.17 0.00 0.00 0.00 0.00 54.91 54.61 1um7 h ALA 81 Cb 0.15 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1um7 h ALA 81 CO -0.00 0.21 0.53 0.00 0.00 0.00 0.00 179.25 179.98 1um7 h ALA 82 N 0.18 2.40 -0.03 0.00 0.00 0.26 1.39 119.26 123.47 1um7 h ALA 82 Ca -0.07 -0.02 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 1um7 h ALA 82 Cb 1.25 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 1um7 h ALA 82 CO 0.09 -0.83 -0.48 0.00 0.00 0.00 0.00 179.25 178.03 1um7 h ALA 83 N 1.50 1.16 0.00 0.00 0.00 -1.27 -0.51 119.26 120.15 1um7 h ALA 83 Ca 0.28 -0.44 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1um7 h ALA 83 Cb 1.33 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1um7 h ALA 83 CO -0.00 0.61 -0.58 -0.07 0.00 0.00 0.00 179.25 179.20 1um7 h LEU 84 N 0.05 0.00 -0.01 0.00 -0.00 0.17 -2.68 115.31 112.83 1um7 h LEU 84 Ca -0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.88 57.69 1um7 h LEU 84 Cb 0.86 0.00 -0.03 0.00 -0.00 0.00 0.00 40.66 41.50 1um7 h LEU 84 CO 0.06 0.11 -0.92 0.11 -0.00 0.00 0.00 178.44 177.81 1um7 h LYS 85 N 0.00 0.00 -0.00 1.13 6.56 -0.41 -3.13 116.57 120.72 1um7 h LYS 85 Ca -0.02 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 1um7 h LYS 85 Cb 1.10 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.76 1um7 h LYS 85 CO 0.01 0.92 -0.47 2.89 -2.06 0.00 0.00 179.45 180.73 1um7 n ARG 86 N -3.34 0.09 0.00 3.15 1.85 -0.25 -4.84 116.66 113.33 1um7 n ARG 86 Ca 0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 57.85 56.80 1um7 n ARG 86 Cb 0.90 -1.50 0.00 0.00 -1.05 0.00 0.00 32.46 30.81 1um7 n ARG 86 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1um7 n ALA 87 N -1.41 0.00 -2.54 2.89 0.00 -1.01 -5.08 120.51 113.36 1um7 n ALA 87 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.50 1um7 n ALA 87 Cb 0.34 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.79 1um7 n ALA 87 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1um7 n GLY 88 N 2.26 1.10 0.08 0.00 0.00 -1.26 -5.03 105.19 102.35 1um7 n GLY 88 Ca 0.00 0.14 -0.13 0.00 0.00 0.00 0.00 46.02 46.04 1um7 n GLY 88 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1um7 h GLN 89 N 0.00 -0.04 -4.01 1.61 4.20 -1.94 -3.41 115.11 111.52 1um7 h GLN 89 Ca 0.00 0.00 -0.77 0.00 0.06 0.00 0.00 58.65 57.95 1um7 h GLN 89 Cb 0.00 0.01 -0.25 0.00 0.30 0.00 0.00 27.48 27.54 1um7 h GLN 89 CO 0.00 0.60 -0.13 -1.54 -0.67 0.00 0.00 178.83 177.09 1um7 s SER 90 N -5.83 6.33 -0.17 1.46 1.04 -1.26 -1.73 113.70 113.54 1um7 s SER 90 Ca -0.16 -2.08 -0.06 0.00 0.48 0.00 0.00 55.95 54.13 1um7 s SER 90 Cb -0.00 -2.20 -0.03 0.00 0.10 0.00 0.00 66.02 63.88 1um7 s SER 90 CO 0.62 -0.76 0.02 -0.69 0.98 0.00 0.00 173.24 173.40 1um7 s VAL 91 N 1.13 4.38 -0.56 5.02 1.01 -0.93 -4.99 120.40 125.46 1um7 s VAL 91 Ca 0.08 -0.18 -0.17 0.00 0.00 0.00 0.00 61.98 61.70 1um7 s VAL 91 Cb -0.24 -2.95 0.11 0.00 0.00 0.00 0.00 36.38 33.31 1um7 s VAL 91 CO -0.01 0.48 0.59 -0.89 0.00 0.00 0.00 175.10 175.28 1um7 s THR 92 N 0.30 5.02 -0.34 3.92 2.01 -1.26 -1.46 115.64 123.83 1um7 s THR 92 Ca 0.00 -1.18 -0.13 0.00 0.31 0.00 0.00 61.69 60.69 1um7 s THR 92 Cb -0.13 -4.39 -0.02 0.00 0.01 0.00 0.00 72.50 67.97 1um7 s THR 92 CO 0.01 -0.96 0.26 -0.63 -0.69 0.00 0.00 174.62 172.61 1um7 s ILE 93 N 2.15 5.27 -0.50 1.82 1.09 0.49 0.94 121.20 132.46 1um7 s ILE 93 Ca 0.08 -0.19 -0.13 0.00 -1.10 0.00 0.00 60.65 59.30 1um7 s ILE 93 Cb -0.26 -3.73 0.11 0.00 -1.06 0.00 0.00 42.46 37.52 1um7 s ILE 93 CO 0.05 -0.02 0.42 -0.69 -0.10 0.00 0.00 174.94 174.60 1um7 s VAL 94 N 1.75 4.83 0.25 2.92 1.01 0.37 -0.35 120.40 131.20 1um7 s VAL 94 Ca 0.07 -1.52 0.04 0.00 0.00 0.00 0.00 61.98 60.57 1um7 s VAL 94 Cb -0.17 -4.08 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 1um7 s VAL 94 CO 0.11 -0.77 -0.01 0.00 0.00 0.00 0.00 175.10 174.43 1um7 s ALA 95 N 1.52 2.00 -0.09 5.51 0.00 -1.09 0.01 121.76 129.61 1um7 s ALA 95 Ca 0.04 -1.84 0.02 0.00 0.00 0.00 0.00 51.96 50.18 1um7 s ALA 95 Cb -0.28 0.46 0.01 0.00 0.00 0.00 0.00 23.12 23.31 1um7 s ALA 95 CO 0.02 -0.22 -0.15 1.14 0.00 0.00 0.00 175.76 176.55 1um7 s GLN 96 N -3.84 2.13 -0.65 0.00 -2.07 -0.98 -0.96 119.66 113.29 1um7 s GLN 96 Ca 0.30 -0.54 -0.26 0.00 -1.82 0.00 0.00 55.36 53.04 1um7 s GLN 96 Cb 0.06 -1.78 -0.12 0.00 -1.09 0.00 0.00 33.01 30.08 1um7 s GLN 96 CO 0.10 -0.02 2.44 0.98 -1.32 0.00 0.00 175.29 177.48 1um7 n TYR 97 N 4.04 1.19 -3.55 9.60 4.19 -1.26 -0.95 117.16 130.42 1um7 n TYR 97 Ca -0.20 0.11 -0.28 0.00 3.31 0.00 0.00 57.90 60.84 1um7 n TYR 97 Cb 0.52 -2.50 -0.11 0.00 0.49 0.00 0.00 39.34 37.74 1um7 n TYR 97 CO 0.00 0.00 0.00 0.50 0.91 0.00 0.00 176.86 178.27 1um7 s ARG 98 N 8.47 1.24 0.30 2.98 3.52 -1.25 -4.46 118.95 129.75 1um7 s ARG 98 Ca 1.03 -2.25 0.15 0.00 -0.13 0.00 0.00 55.73 54.53 1um7 s ARG 98 Cb -0.33 -1.95 0.38 0.00 -1.56 0.00 0.00 34.95 31.49 1um7 s ARG 98 CO 0.26 -1.31 1.59 -1.00 -0.81 0.00 0.00 175.30 174.03 1um7 h PRO 99 N 5.92 0.00 0.43 5.12 0.13 -1.88 -3.09 132.00 138.63 1um7 h PRO 99 Ca 0.18 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.30 1um7 h PRO 99 Cb 0.89 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.00 1um7 h PRO 99 CO 0.44 0.52 -0.39 1.49 -0.23 0.00 0.00 178.00 179.84 1um7 h GLU 100 N 0.00 -0.79 0.72 0.86 4.22 -1.91 0.51 114.58 118.18 1um7 h GLU 100 Ca -0.01 0.05 -0.03 0.00 0.08 0.00 0.00 59.36 59.46 1um7 h GLU 100 Cb 1.15 0.18 -0.00 0.00 0.50 0.00 0.00 28.75 30.57 1um7 h GLU 100 CO 0.07 -0.53 -0.45 0.93 -2.18 0.00 0.00 179.01 176.85 1um7 h GLU 101 N -0.82 -1.06 -0.03 1.92 4.39 -1.93 -1.30 114.58 115.75 1um7 h GLU 101 Ca -0.04 0.07 0.01 0.00 0.34 0.00 0.00 59.36 59.74 1um7 h GLU 101 Cb 0.72 0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 29.61 1um7 h GLU 101 CO -0.04 -0.71 0.27 -0.92 -1.16 0.00 0.00 179.01 176.45 1um7 h TYR 102 N -1.10 0.00 -1.10 4.33 3.20 -1.48 -0.79 116.97 120.04 1um7 h TYR 102 Ca -0.09 0.00 0.31 0.00 3.14 0.00 0.00 58.73 62.09 1um7 h TYR 102 Cb 0.89 0.00 -0.06 0.00 1.54 0.00 0.00 36.73 39.10 1um7 h TYR 102 CO -0.11 0.00 0.77 1.03 -1.64 0.00 0.00 178.16 178.21 1um7 h SER 103 N 0.00 0.15 -0.31 -2.11 0.87 0.13 1.14 113.55 113.42 1um7 h SER 103 Ca 0.01 0.03 -0.03 0.00 -1.23 0.00 0.00 61.79 60.57 1um7 h SER 103 Cb 0.56 0.01 -0.02 0.00 -0.44 0.00 0.00 62.40 62.50 1um7 h SER 103 CO -0.00 0.03 0.11 0.08 -0.53 0.00 0.00 176.83 176.51 1um7 h ARG 104 N 0.13 0.55 0.00 2.24 0.11 -1.26 -1.89 114.38 114.25 1um7 h ARG 104 Ca 0.56 -0.08 -0.18 0.00 0.10 0.00 0.00 59.98 60.37 1um7 h ARG 104 Cb 1.95 -0.10 -0.03 0.00 1.11 0.00 0.00 29.97 32.91 1um7 h ARG 104 CO -0.10 0.49 -0.86 0.74 0.10 0.00 0.00 179.97 180.34 1um7 h PHE 105 N 0.54 0.00 0.50 4.08 0.04 0.11 -3.12 116.94 119.09 1um7 h PHE 105 Ca 0.13 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.87 1um7 h PHE 105 Cb 0.19 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.34 1um7 h PHE 105 CO 0.01 0.86 -0.24 0.93 -0.60 0.00 0.00 178.31 179.27 1um7 h GLU 106 N 0.00 -0.64 -0.05 1.51 4.39 -0.50 -3.24 114.58 116.05 1um7 h GLU 106 Ca -0.01 0.04 0.03 0.00 0.34 0.00 0.00 59.36 59.76 1um7 h GLU 106 Cb 1.66 0.15 -0.06 0.00 -0.10 0.00 0.00 28.75 30.40 1um7 h GLU 106 CO 0.11 -0.43 -0.53 1.03 -1.16 0.00 0.00 179.01 178.03 1um7 h SER 107 N -0.72 -1.65 -2.15 1.42 0.87 -1.58 -3.24 113.55 106.49 1um7 h SER 107 Ca -0.07 0.19 -0.67 0.00 -1.23 0.00 0.00 61.79 60.01 1um7 h SER 107 Cb 0.51 0.63 -0.16 0.00 -0.44 0.00 0.00 62.40 62.95 1um7 h SER 107 CO 0.11 -0.51 0.96 -0.44 -0.53 0.00 0.00 176.83 176.43 1um7 s SER 108 N -4.79 6.59 0.28 6.23 0.01 -1.18 -5.01 113.70 115.83 1um7 s SER 108 Ca -0.16 -1.90 -0.13 0.00 1.31 0.00 0.00 55.95 55.08 1um7 s SER 108 Cb 0.07 -2.43 -0.08 0.00 0.21 0.00 0.00 66.02 63.79 1um7 s SER 108 CO 0.61 -1.16 0.65 -0.83 0.41 0.00 0.00 173.24 172.92 1um7 s GLY 109 N 3.90 2.32 -1.02 3.44 0.00 -1.22 -4.59 107.32 110.14 1um7 s GLY 109 Ca 0.35 -0.10 -0.07 0.00 0.00 0.00 0.00 44.72 44.91 1um7 s GLY 109 CO -0.09 0.09 2.54 -1.55 0.00 0.00 0.00 173.10 174.09 1um7 n PRO 110 N -0.22 2.58 0.00 2.90 -0.04 -1.26 -4.72 135.00 134.24 1um7 n PRO 110 Ca 0.02 -1.61 0.00 0.00 -0.04 0.00 0.00 63.50 61.87 1um7 n PRO 110 Cb 0.53 -2.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.51 1um7 n PRO 110 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1um7 n SER 111 N 3.72 0.00 -4.24 3.54 3.41 -1.26 -5.16 113.62 113.63 1um7 n SER 111 Ca 0.55 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.86 1um7 n SER 111 Cb 0.26 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.05 1um7 n SER 111 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1um7 s SER 112 N 0.00 2.84 0.00 4.04 0.01 -1.26 -5.12 113.70 114.21 1um7 s SER 112 Ca 0.00 -0.47 0.04 0.00 1.31 0.00 0.00 55.95 56.84 1um7 s SER 112 Cb 0.00 -0.75 0.04 0.00 0.21 0.00 0.00 66.02 65.52 1um7 s SER 112 CO 0.00 0.23 0.64 0.61 0.41 0.00 0.00 173.24 175.13