#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 -0.59 -0.39 1.61 0.01 -1.26 -5.11 113.70 107.97 1um7 s SER 2 Ca 0.00 0.87 -0.03 0.00 1.31 0.00 0.00 55.95 58.10 1um7 s SER 2 Cb 0.00 0.79 0.21 0.00 0.21 0.00 0.00 66.02 67.23 1um7 s SER 2 CO 0.00 -0.39 1.01 -0.24 0.41 0.00 0.00 173.24 174.03 1um7 n SER 3 N 1.54 -1.99 -4.82 2.44 2.88 -1.26 -5.17 113.62 107.25 1um7 n SER 3 Ca -0.15 -1.51 -0.22 0.00 -1.33 0.00 0.00 58.87 55.66 1um7 n SER 3 Cb 0.56 1.01 0.08 0.00 -0.75 0.00 0.00 64.21 65.12 1um7 n SER 3 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1um7 s GLY 4 N 0.87 1.77 0.11 0.46 0.00 -1.26 -5.13 107.32 104.14 1um7 s GLY 4 Ca 0.25 -1.80 -0.24 0.00 0.00 0.00 0.00 44.72 42.94 1um7 s GLY 4 CO -0.09 -1.31 0.60 -0.45 0.00 0.00 0.00 173.10 171.85 1um7 s SER 5 N -4.67 -0.56 0.25 1.64 0.15 -1.26 -5.18 113.70 104.07 1um7 s SER 5 Ca 0.64 0.14 -0.22 0.00 0.70 0.00 0.00 55.95 57.20 1um7 s SER 5 Cb -0.06 0.57 0.03 0.00 -1.71 0.00 0.00 66.02 64.85 1um7 s SER 5 CO 0.42 -0.87 0.77 -0.94 1.20 0.00 0.00 173.24 173.82 1um7 s SER 6 N -2.38 -0.24 -0.04 5.45 1.04 -1.26 -5.17 113.70 111.09 1um7 s SER 6 Ca -0.02 -0.56 0.02 0.00 0.48 0.00 0.00 55.95 55.88 1um7 s SER 6 Cb -0.01 0.67 0.01 0.00 0.10 0.00 0.00 66.02 66.80 1um7 s SER 6 CO -0.08 -1.24 -0.08 -0.83 0.98 0.00 0.00 173.24 171.99 1um7 s GLY 7 N -2.92 0.57 -0.01 7.32 0.00 -1.26 -5.14 107.32 105.87 1um7 s GLY 7 Ca 0.11 -0.23 -0.07 0.00 0.00 0.00 0.00 44.72 44.53 1um7 s GLY 7 CO 0.06 0.19 0.15 0.50 0.00 0.00 0.00 173.10 173.99 1um7 s ARG 8 N 0.63 0.42 0.96 2.90 0.52 -1.26 -5.17 118.95 117.95 1um7 s ARG 8 Ca -0.10 -0.25 -0.14 0.00 -0.52 0.00 0.00 55.73 54.72 1um7 s ARG 8 Cb -0.13 0.18 0.17 0.00 0.52 0.00 0.00 34.95 35.68 1um7 s ARG 8 CO 0.01 -0.09 1.16 -1.25 0.02 0.00 0.00 175.30 175.15 1um7 s PRO 9 N -1.05 0.76 0.00 3.54 0.04 -1.26 -4.94 135.00 132.09 1um7 s PRO 9 Ca -0.11 0.15 0.00 0.00 0.04 0.00 0.00 61.00 61.07 1um7 s PRO 9 Cb -0.06 -1.81 0.00 0.00 0.04 0.00 0.00 34.50 32.67 1um7 s PRO 9 CO 0.01 -2.43 0.00 0.41 0.04 0.00 0.00 177.00 175.04 1um7 n GLY 10 N -2.26 -1.34 2.59 0.56 0.00 -1.26 -4.88 105.19 98.60 1um7 n GLY 10 Ca 0.09 -2.10 -0.29 0.00 0.00 0.00 0.00 46.02 43.72 1um7 n GLY 10 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1um7 s GLY 11 N 0.00 1.45 -1.07 -0.02 0.00 -1.26 -5.05 107.32 101.37 1um7 s GLY 11 Ca 0.00 -2.46 -0.23 0.00 0.00 0.00 0.00 44.72 42.03 1um7 s GLY 11 CO 0.00 1.77 1.80 0.99 0.00 0.00 0.00 173.10 177.67 1um7 s ASP 12 N 0.35 5.67 -0.55 1.64 1.11 -1.26 -4.80 116.67 118.84 1um7 s ASP 12 Ca 0.21 -1.39 0.05 0.00 0.18 0.00 0.00 52.55 51.60 1um7 s ASP 12 Cb -0.17 -2.57 0.18 0.00 1.07 0.00 0.00 42.92 41.43 1um7 s ASP 12 CO -0.05 -2.32 0.44 0.00 1.18 0.00 0.00 175.17 174.42 1um7 n ALA 13 N 12.12 3.14 -0.02 5.23 0.00 -1.26 -4.89 120.51 134.84 1um7 n ALA 13 Ca 0.41 -3.82 -0.06 0.00 0.00 0.00 0.00 53.44 49.98 1um7 n ALA 13 Cb 0.48 -0.88 -0.02 0.00 0.00 0.00 0.00 19.45 19.03 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 2.24 0.16 -0.43 0.00 3.00 -1.26 -4.73 116.66 115.64 1um7 n ARG 14 Ca 0.25 0.07 -0.29 0.00 -0.01 0.00 0.00 57.85 57.87 1um7 n ARG 14 Cb 0.43 -0.77 0.25 0.00 0.00 0.00 0.00 32.46 32.36 1um7 n ARG 14 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1um7 n GLU 15 N -3.55 -3.13 -2.48 5.56 1.02 -1.26 -4.11 120.64 112.70 1um7 n GLU 15 Ca -0.10 -0.91 -0.42 0.00 -0.02 0.00 0.00 57.16 55.72 1um7 n GLU 15 Cb 0.40 -1.95 -0.03 0.00 -0.02 0.00 0.00 31.44 29.83 1um7 n GLU 15 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1um7 s PRO 16 N -4.34 4.51 -0.01 3.49 0.04 -1.26 -4.36 135.00 133.06 1um7 s PRO 16 Ca 0.64 1.73 -0.02 0.00 0.04 0.00 0.00 61.00 63.38 1um7 s PRO 16 Cb -0.18 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 31.00 1um7 s PRO 16 CO 0.61 -0.09 0.16 -0.98 0.04 0.00 0.00 177.00 176.74 1um7 s ARG 17 N 0.36 3.37 -0.43 4.56 1.70 0.17 -4.82 118.95 123.86 1um7 s ARG 17 Ca 0.54 -0.34 -0.29 0.00 -0.47 0.00 0.00 55.73 55.17 1um7 s ARG 17 Cb -0.29 -3.06 0.02 0.00 -0.57 0.00 0.00 34.95 31.06 1um7 s ARG 17 CO 0.32 0.68 1.16 0.21 -1.08 0.00 0.00 175.30 176.58 1um7 s LYS 18 N -1.86 3.79 -0.12 3.89 2.47 -1.26 -2.36 119.74 124.29 1um7 s LYS 18 Ca 0.26 0.74 0.01 0.00 -1.56 0.00 0.00 55.97 55.42 1um7 s LYS 18 Cb -0.12 -3.88 -0.02 0.00 -1.46 0.00 0.00 37.83 32.35 1um7 s LYS 18 CO 0.17 -1.28 -0.14 0.42 0.16 0.00 0.00 175.35 174.68 1um7 s ILE 19 N 4.37 3.02 -0.34 5.43 1.01 0.35 -4.98 121.20 130.05 1um7 s ILE 19 Ca 0.49 -0.68 0.01 0.00 0.00 0.00 0.00 60.65 60.47 1um7 s ILE 19 Cb -0.09 -2.25 0.09 0.00 0.01 0.00 0.00 42.46 40.22 1um7 s ILE 19 CO 0.28 0.54 0.05 -0.63 0.00 0.00 0.00 174.94 175.18 1um7 s ILE 20 N 0.20 2.60 -0.12 2.92 1.01 -1.26 0.18 121.20 126.73 1um7 s ILE 20 Ca -0.08 -2.02 -0.09 0.00 0.00 0.00 0.00 60.65 58.46 1um7 s ILE 20 Cb -0.15 -2.76 -0.04 0.00 0.01 0.00 0.00 42.46 39.51 1um7 s ILE 20 CO 0.05 -0.45 0.18 -0.76 0.00 0.00 0.00 174.94 173.96 1um7 s LEU 21 N 1.04 4.36 -0.46 2.97 2.01 -0.79 -4.94 118.68 122.87 1um7 s LEU 21 Ca 0.05 0.50 -0.13 0.00 0.01 0.00 0.00 54.13 54.55 1um7 s LEU 21 Cb -0.20 -2.16 0.08 0.00 0.01 0.00 0.00 46.19 43.92 1um7 s LEU 21 CO -0.06 0.34 0.36 -1.00 1.01 0.00 0.00 176.35 177.00 1um7 s HIS 22 N -0.70 3.29 -0.46 0.29 3.76 -1.26 -2.61 115.29 117.61 1um7 s HIS 22 Ca 0.15 -1.23 -0.43 0.00 -0.15 0.00 0.00 55.06 53.40 1um7 s HIS 22 Cb -0.13 -3.20 -0.18 0.00 1.11 0.00 0.00 32.58 30.19 1um7 s HIS 22 CO 0.04 -0.85 2.04 1.63 -0.85 0.00 0.00 174.74 176.75 1um7 n LYS 23 N 5.09 0.26 -0.09 1.40 5.02 -0.69 -4.77 118.16 124.37 1um7 n LYS 23 Ca -0.12 0.08 -0.11 0.00 -2.02 0.00 0.00 58.31 56.14 1um7 n LYS 23 Cb 0.43 -1.70 -0.04 0.00 -0.02 0.00 0.00 35.03 33.69 1um7 n LYS 23 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1um7 n GLY 24 N 6.57 -0.78 2.09 0.72 0.00 -1.20 -4.94 105.19 107.65 1um7 n GLY 24 Ca 0.47 -0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.33 1um7 n GLY 24 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1um7 n SER 25 N -4.51 -2.24 -3.15 1.61 2.88 -1.26 -4.96 113.62 101.99 1um7 n SER 25 Ca -0.18 0.48 -0.35 0.00 -1.33 0.00 0.00 58.87 57.49 1um7 n SER 25 Cb 0.46 2.31 -0.03 0.00 -0.75 0.00 0.00 64.21 66.20 1um7 n SER 25 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1um7 n THR 26 N -3.00 4.59 -3.00 2.46 -2.24 -1.26 -4.97 114.28 106.86 1um7 n THR 26 Ca 0.00 -3.74 0.00 0.00 -2.27 0.00 0.00 64.05 58.04 1um7 n THR 26 Cb 0.00 -1.99 0.00 0.00 -2.10 0.00 0.00 70.33 66.24 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 1.67 2.17 0.05 3.38 0.00 -1.26 -2.38 105.19 108.82 1um7 n GLY 27 Ca 0.59 -0.48 0.12 0.00 0.00 0.00 0.00 46.02 46.25 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 0.70 -0.67 0.99 7.99 -1.26 -3.22 117.00 121.53 1um7 n LEU 28 Ca 0.00 -0.14 0.00 0.00 -0.01 0.00 0.00 56.01 55.86 1um7 n LEU 28 Cb 0.00 -0.18 0.00 0.00 -0.11 0.00 0.00 43.42 43.13 1um7 n LEU 28 CO 0.00 0.16 0.00 0.61 -1.51 0.00 0.00 177.39 176.65 1um7 n GLY 29 N 1.47 0.71 3.62 -0.72 0.00 -1.00 -1.44 105.19 107.84 1um7 n GLY 29 Ca 0.06 -0.53 -0.09 0.00 0.00 0.00 0.00 46.02 45.47 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 -2.85 -0.39 0.60 1.61 -0.12 -1.26 -1.49 117.98 114.07 1um7 s PHE 30 Ca 0.00 0.87 0.03 0.00 -0.05 0.00 0.00 56.93 57.78 1um7 s PHE 30 Cb 0.00 0.40 0.08 0.00 -0.63 0.00 0.00 43.02 42.87 1um7 s PHE 30 CO 0.00 -0.24 0.83 1.21 -0.05 0.00 0.00 175.22 176.98 1um7 s ASN 31 N -0.24 4.94 0.03 1.98 3.84 0.20 -4.95 114.94 120.74 1um7 s ASN 31 Ca 0.02 -0.37 -0.06 0.00 0.21 0.00 0.00 52.86 52.67 1um7 s ASN 31 Cb -0.03 -0.28 -0.01 0.00 -0.55 0.00 0.00 41.25 40.38 1um7 s ASN 31 CO -0.05 -1.41 0.10 0.27 -2.79 0.00 0.00 177.10 173.23 1um7 s ILE 32 N -2.83 0.11 0.24 -5.21 -4.36 -1.26 -2.55 121.20 105.34 1um7 s ILE 32 Ca 0.61 -0.95 -0.01 0.00 -0.26 0.00 0.00 60.65 60.05 1um7 s ILE 32 Cb -0.07 -0.69 -0.03 0.00 1.25 0.00 0.00 42.46 42.91 1um7 s ILE 32 CO 0.40 -0.52 0.22 0.68 0.24 0.00 0.00 174.94 175.95 1um7 s VAL 33 N -2.12 0.00 0.00 8.37 -7.23 0.53 -4.61 120.40 115.34 1um7 s VAL 33 Ca -0.09 -1.91 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 1um7 s VAL 33 Cb -0.04 -2.47 0.00 0.00 0.56 0.00 0.00 36.38 34.43 1um7 s VAL 33 CO -0.02 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.38 1um7 n GLY 34 N -0.36 -0.81 1.82 2.32 0.00 -1.26 -1.19 105.19 105.71 1um7 n GLY 34 Ca 0.03 -1.92 0.00 0.00 0.00 0.00 0.00 46.02 44.12 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 0.00 0.79 3.48 -0.02 0.00 -1.17 -3.79 105.19 104.49 1um7 n GLY 35 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 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 -0.34 3.17 0.00 1.61 0.41 -1.26 -3.97 118.70 118.32 1um7 s GLU 36 Ca 0.00 -0.61 0.00 0.00 -0.41 0.00 0.00 54.97 53.95 1um7 s GLU 36 Cb 0.00 -4.19 0.00 0.00 -1.78 0.00 0.00 34.13 28.16 1um7 s GLU 36 CO 0.00 -1.81 0.00 -0.25 -0.49 0.00 0.00 175.26 172.71 1um7 n ASP 37 N 7.97 0.00 0.00 -0.19 8.00 -1.26 -3.48 116.55 127.58 1um7 n ASP 37 Ca -0.02 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.48 1um7 n ASP 37 Cb 0.46 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.56 1um7 n ASP 37 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1um7 n GLY 38 N 0.00 0.30 0.17 0.44 0.00 -1.26 -4.95 105.19 99.90 1um7 n GLY 38 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 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 0.00 0.00 0.00 1.61 4.11 -1.81 -3.43 114.58 115.06 1um7 h GLU 39 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1um7 h GLU 39 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1um7 h GLU 39 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 179.01 179.49 1um7 n GLY 40 N 1.16 2.48 3.53 1.06 0.00 -1.24 -5.03 105.19 107.15 1um7 n GLY 40 Ca 0.04 -2.06 -0.30 0.00 0.00 0.00 0.00 46.02 43.70 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 -1.85 3.09 -0.03 -0.61 -1.09 -1.26 -3.02 121.20 116.43 1um7 s ILE 41 Ca 0.00 -1.34 -0.16 0.00 -2.23 0.00 0.00 60.65 56.92 1um7 s ILE 41 Cb 0.00 -2.41 0.03 0.00 -1.58 0.00 0.00 42.46 38.49 1um7 s ILE 41 CO 0.00 0.14 0.34 -0.36 -1.23 0.00 0.00 174.94 173.83 1um7 s PHE 42 N -1.14 -0.23 0.29 3.97 0.40 -0.33 -1.60 117.98 119.33 1um7 s PHE 42 Ca 0.19 0.39 -0.29 0.00 -0.60 0.00 0.00 56.93 56.62 1um7 s PHE 42 Cb -0.11 0.12 -0.10 0.00 0.51 0.00 0.00 43.02 43.45 1um7 s PHE 42 CO 0.11 -0.39 1.31 0.08 0.70 0.00 0.00 175.22 177.04 1um7 s VAL 43 N -1.17 2.86 -0.28 -0.44 1.01 0.14 0.20 120.40 122.71 1um7 s VAL 43 Ca -0.12 0.81 0.22 0.00 0.00 0.00 0.00 61.98 62.89 1um7 s VAL 43 Cb -0.05 -3.52 -0.31 0.00 0.00 0.00 0.00 36.38 32.51 1um7 s VAL 43 CO 0.04 0.17 0.60 -1.54 0.00 0.00 0.00 175.10 174.37 1um7 n SER 44 N 1.42 0.27 0.00 3.32 3.41 -1.06 -3.12 113.62 117.86 1um7 n SER 44 Ca 0.02 -0.25 0.00 0.00 -0.26 0.00 0.00 58.87 58.38 1um7 n SER 44 Cb 0.42 1.72 0.00 0.00 -0.26 0.00 0.00 64.21 66.09 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 -2.07 0.00 -3.80 7.33 7.35 -1.26 -4.90 117.46 120.10 1um7 n PHE 45 Ca -0.02 0.00 -0.26 0.00 -0.76 0.00 0.00 57.45 56.41 1um7 n PHE 45 Cb 0.51 0.00 -0.17 0.00 0.35 0.00 0.00 39.48 40.17 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 0.69 0.71 -2.13 1.01 -1.26 0.61 121.20 118.83 1um7 s ILE 46 Ca 0.00 -0.35 -0.16 0.00 0.00 0.00 0.00 60.65 60.14 1um7 s ILE 46 Cb 0.00 -0.95 -0.06 0.00 0.01 0.00 0.00 42.46 41.45 1um7 s ILE 46 CO 0.00 0.08 0.33 -0.11 0.00 0.00 0.00 174.94 175.24 1um7 n LEU 47 N 5.02 -0.33 -4.53 2.97 7.94 -0.56 -4.89 117.00 122.61 1um7 n LEU 47 Ca -0.09 0.57 -0.42 0.00 -1.11 0.00 0.00 56.01 54.95 1um7 n LEU 47 Cb 0.48 -1.13 -0.07 0.00 0.53 0.00 0.00 43.42 43.23 1um7 n LEU 47 CO 0.14 -3.58 0.32 0.00 -1.11 0.00 0.00 177.39 173.16 1um7 s ALA 48 N -1.93 3.40 0.00 1.96 0.00 -1.26 -3.64 121.76 120.28 1um7 s ALA 48 Ca 0.62 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 51.44 1um7 s ALA 48 Cb -0.36 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.57 1um7 s ALA 48 CO 0.61 -1.58 0.00 0.41 0.00 0.00 0.00 175.76 175.20 1um7 n GLY 49 N 4.94 0.53 3.45 0.00 0.00 -1.26 -5.08 105.19 107.76 1um7 n GLY 49 Ca -0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.69 1um7 n GLY 49 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1um7 s GLY 50 N -2.08 1.50 0.18 -0.02 0.00 -1.24 -4.56 107.32 101.11 1um7 s GLY 50 Ca 0.00 -0.92 0.03 0.00 0.00 0.00 0.00 44.72 43.83 1um7 s GLY 50 CO 0.00 0.04 1.43 -0.56 0.00 0.00 0.00 173.10 174.01 1um7 h PRO 51 N -3.04 0.20 0.00 2.90 0.13 -1.86 0.69 132.00 131.03 1um7 h PRO 51 Ca -0.43 -0.19 0.00 0.00 -0.87 0.00 0.00 66.00 64.50 1um7 h PRO 51 Cb 1.31 0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.49 1um7 h PRO 51 CO 0.30 0.90 0.00 0.00 -0.23 0.00 0.00 178.00 178.96 1um7 h ALA 52 N 1.04 1.00 0.00 -0.56 0.00 -1.43 -1.14 119.26 118.17 1um7 h ALA 52 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 54.91 54.48 1um7 h ALA 52 Cb 1.40 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.13 1um7 h ALA 52 CO 0.12 0.00 -2.32 -3.47 0.00 0.00 0.00 179.25 173.58 1um7 n ASP 53 N -2.33 1.81 -0.05 0.00 -0.08 -1.08 -3.51 116.55 111.32 1um7 n ASP 53 Ca 0.03 0.31 -0.08 0.00 -1.51 0.00 0.00 54.79 53.55 1um7 n ASP 53 Cb 0.32 -0.75 -0.02 0.00 2.34 0.00 0.00 41.12 43.00 1um7 n ASP 53 CO 0.00 0.00 0.00 -0.07 0.12 0.00 0.00 177.20 177.25 1um7 h LEU 54 N -0.92 -0.27 -0.98 -2.67 3.38 0.36 -1.66 115.31 112.53 1um7 h LEU 54 Ca -0.60 0.08 0.21 0.00 0.09 0.00 0.00 57.88 57.65 1um7 h LEU 54 Cb 1.52 0.17 -0.19 0.00 0.09 0.00 0.00 40.66 42.25 1um7 h LEU 54 CO -0.37 -0.10 -0.19 0.28 0.09 0.00 0.00 178.44 178.15 1um7 h SER 55 N -0.03 -0.83 0.00 -0.43 0.02 -1.40 -3.44 113.55 107.43 1um7 h SER 55 Ca 0.11 0.29 0.00 0.00 -0.84 0.00 0.00 61.79 61.36 1um7 h SER 55 Cb 0.21 0.59 0.00 0.00 0.14 0.00 0.00 62.40 63.33 1um7 h SER 55 CO -0.25 -0.33 0.00 0.61 -1.14 0.00 0.00 176.83 175.72 1um7 n GLY 56 N -1.60 0.69 0.07 -3.77 0.00 -0.63 -4.91 105.19 95.04 1um7 n GLY 56 Ca 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.14 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 3.74 0.00 -6.54 1.61 5.08 -1.83 -3.46 114.58 113.18 1um7 h GLU 57 Ca 0.00 0.00 -0.53 0.00 -1.00 0.00 0.00 59.36 57.83 1um7 h GLU 57 Cb 0.00 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.28 1um7 h GLU 57 CO 0.00 0.04 0.81 -1.17 -1.00 0.00 0.00 179.01 177.69 1um7 s LEU 58 N -8.22 4.37 0.08 1.33 2.96 -1.23 -5.00 118.68 112.96 1um7 s LEU 58 Ca -0.15 2.42 0.01 0.00 -0.22 0.00 0.00 54.13 56.19 1um7 s LEU 58 Cb 0.02 -3.58 -0.04 0.00 0.50 0.00 0.00 46.19 43.09 1um7 s LEU 58 CO 0.23 -0.74 -0.05 0.00 -1.32 0.00 0.00 176.35 174.46 1um7 s ARG 59 N 1.39 0.73 -0.55 1.98 1.04 -1.26 -4.38 118.95 117.90 1um7 s ARG 59 Ca 0.67 -1.24 -0.27 0.00 -1.04 0.00 0.00 55.73 53.85 1um7 s ARG 59 Cb -0.39 -0.08 -0.01 0.00 -2.04 0.00 0.00 34.95 32.43 1um7 s ARG 59 CO 0.30 -0.04 1.78 0.50 -0.04 0.00 0.00 175.30 177.80 1um7 s ARG 60 N -3.64 2.86 0.00 3.89 3.52 -1.26 -2.00 118.95 122.32 1um7 s ARG 60 Ca 0.08 0.73 0.00 0.00 -0.13 0.00 0.00 55.73 56.41 1um7 s ARG 60 Cb 0.05 -4.31 0.00 0.00 -1.56 0.00 0.00 34.95 29.12 1um7 s ARG 60 CO -0.06 -2.45 0.00 0.41 -0.81 0.00 0.00 175.30 172.39 1um7 n GLY 61 N 5.58 0.77 3.77 8.12 0.00 -1.18 -4.93 105.19 117.31 1um7 n GLY 61 Ca 0.19 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.85 1um7 n GLY 61 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1um7 s ASP 62 N -0.50 5.73 -0.40 1.61 1.11 -0.85 -3.98 116.67 119.39 1um7 s ASP 62 Ca 0.00 2.31 -0.16 0.00 0.18 0.00 0.00 52.55 54.88 1um7 s ASP 62 Cb 0.00 -2.60 0.01 0.00 1.07 0.00 0.00 42.92 41.41 1um7 s ASP 62 CO 0.00 -1.22 0.37 -0.60 1.18 0.00 0.00 175.17 174.90 1um7 s ARG 63 N -3.06 3.16 -0.63 8.23 3.52 -0.21 0.23 118.95 130.20 1um7 s ARG 63 Ca 0.70 -0.77 -0.26 0.00 -0.13 0.00 0.00 55.73 55.27 1um7 s ARG 63 Cb -0.28 -3.93 -0.03 0.00 -1.56 0.00 0.00 34.95 29.14 1um7 s ARG 63 CO 0.32 -0.74 1.94 0.42 -0.81 0.00 0.00 175.30 176.43 1um7 s ILE 64 N 1.96 3.32 -0.04 4.11 -1.09 -0.63 -0.98 121.20 127.84 1um7 s ILE 64 Ca 0.10 0.12 -0.20 0.00 -2.23 0.00 0.00 60.65 58.44 1um7 s ILE 64 Cb -0.18 -3.83 -0.14 0.00 -1.58 0.00 0.00 42.46 36.74 1um7 s ILE 64 CO 0.12 -0.80 0.82 -0.07 -1.23 0.00 0.00 174.94 173.78 1um7 h LEU 65 N 17.02 -0.26 -7.86 2.97 -0.00 -1.19 -3.38 115.31 122.60 1um7 h LEU 65 Ca -0.22 -0.24 -0.10 0.00 -0.00 0.00 0.00 57.88 57.32 1um7 h LEU 65 Cb 1.16 0.07 -0.16 0.00 -0.00 0.00 0.00 40.66 41.73 1um7 h LEU 65 CO 1.21 0.24 -0.44 -0.94 -0.00 0.00 0.00 178.44 178.51 1um7 s SER 66 N -5.31 0.15 -0.02 -0.43 1.04 -0.67 -3.29 113.70 105.18 1um7 s SER 66 Ca -0.11 -0.60 0.04 0.00 0.48 0.00 0.00 55.95 55.76 1um7 s SER 66 Cb 0.01 0.29 -0.01 0.00 0.10 0.00 0.00 66.02 66.41 1um7 s SER 66 CO 0.41 -0.63 -0.15 -0.69 0.98 0.00 0.00 173.24 173.16 1um7 s VAL 67 N -3.31 1.25 0.00 5.02 1.01 -1.10 -0.62 120.40 122.65 1um7 s VAL 67 Ca 0.01 -0.65 0.00 0.00 0.00 0.00 0.00 61.98 61.34 1um7 s VAL 67 Cb 0.03 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.35 1um7 s VAL 67 CO -0.08 0.36 0.00 0.59 0.00 0.00 0.00 175.10 175.97 1um7 n ASN 68 N 2.93 -0.88 -1.52 3.32 4.13 0.33 0.76 115.26 124.33 1um7 n ASN 68 Ca -0.16 0.44 -0.01 0.00 1.68 0.00 0.00 54.58 56.53 1um7 n ASN 68 Cb 0.54 -0.94 0.01 0.00 -1.54 0.00 0.00 39.78 37.85 1um7 n ASN 68 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1um7 n GLY 69 N -0.44 0.62 3.05 7.41 0.00 -1.26 -4.92 105.19 109.65 1um7 n GLY 69 Ca 0.00 -0.27 -0.18 0.00 0.00 0.00 0.00 46.02 45.57 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 -3.03 0.74 -0.45 1.61 0.11 0.23 -5.11 120.40 114.50 1um7 s VAL 70 Ca 0.03 -0.63 -0.23 0.00 -2.93 0.00 0.00 61.98 58.22 1um7 s VAL 70 Cb -0.00 -0.67 0.03 0.00 -1.53 0.00 0.00 36.38 34.21 1um7 s VAL 70 CO 0.07 0.05 0.78 0.21 -3.33 0.00 0.00 175.10 172.87 1um7 s ASN 71 N -0.65 6.40 0.00 3.54 2.47 -1.26 -2.71 114.94 122.74 1um7 s ASN 71 Ca 0.01 -0.13 0.00 0.00 0.42 0.00 0.00 52.86 53.16 1um7 s ASN 71 Cb -0.05 -2.38 0.00 0.00 -1.45 0.00 0.00 41.25 37.36 1um7 s ASN 71 CO 0.00 -0.91 0.32 0.18 -3.72 0.00 0.00 177.10 172.97 1um7 n LEU 72 N 6.70 0.63 -0.42 3.21 4.77 -1.21 -4.72 117.00 125.96 1um7 n LEU 72 Ca 0.02 -0.79 0.36 0.00 -0.03 0.00 0.00 56.01 55.57 1um7 n LEU 72 Cb 0.48 0.00 0.59 0.00 -2.33 0.00 0.00 43.42 42.16 1um7 n LEU 72 CO 0.59 0.16 1.07 0.54 -1.33 0.00 0.00 177.39 178.41 1um7 n ARG 73 N -0.31 -0.03 -2.60 3.23 1.74 -1.21 0.10 116.66 117.59 1um7 n ARG 73 Ca 0.00 1.06 -0.15 0.00 -0.77 0.00 0.00 57.85 57.99 1um7 n ARG 73 Cb 0.01 -2.12 0.02 0.00 -1.02 0.00 0.00 32.46 29.35 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 -4.34 2.55 -4.46 0.55 4.13 -1.26 -3.62 115.26 108.80 1um7 n ASN 74 Ca 0.35 -3.03 -0.30 0.00 1.68 0.00 0.00 54.58 53.28 1um7 n ASN 74 Cb 1.38 -0.50 -0.12 0.00 -1.54 0.00 0.00 39.78 39.00 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 2.60 1.35 5.41 0.00 0.28 -4.85 121.76 123.26 1um7 s ALA 75 Ca 0.34 -1.25 -0.22 0.00 0.00 0.00 0.00 51.96 50.83 1um7 s ALA 75 Cb 0.43 -0.69 0.34 0.00 0.00 0.00 0.00 23.12 23.20 1um7 s ALA 75 CO -0.04 0.58 1.00 0.95 0.00 0.00 0.00 175.76 178.25 1um7 s THR 76 N -0.99 1.33 0.03 0.00 -4.23 -1.26 -3.90 115.64 106.63 1um7 s THR 76 Ca 0.15 0.00 -0.26 0.00 -1.18 0.00 0.00 61.69 60.40 1um7 s THR 76 Cb -0.10 -2.23 -0.17 0.00 1.34 0.00 0.00 72.50 71.34 1um7 s THR 76 CO 0.07 0.00 1.39 -0.74 -0.54 0.00 0.00 174.62 174.79 1um7 h HIS 77 N -3.14 -0.41 -0.92 3.99 2.76 -1.69 0.14 115.15 115.88 1um7 h HIS 77 Ca -0.44 -0.01 0.06 0.00 -2.20 0.00 0.00 60.37 57.78 1um7 h HIS 77 Cb 1.32 0.14 -0.06 0.00 1.55 0.00 0.00 27.41 30.35 1um7 h HIS 77 CO -2.95 -0.12 0.59 1.49 -1.30 0.00 0.00 177.93 175.64 1um7 h GLU 78 N -0.67 1.05 -0.37 5.26 4.81 -1.92 0.21 114.58 122.95 1um7 h GLU 78 Ca -0.05 -0.06 -0.05 0.00 -0.13 0.00 0.00 59.36 59.08 1um7 h GLU 78 Cb 0.47 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 1um7 h GLU 78 CO 0.07 0.70 0.03 1.96 -0.73 0.00 0.00 179.01 181.04 1um7 h GLN 79 N 1.09 0.56 0.00 1.92 4.20 -1.87 1.49 115.11 122.49 1um7 h GLN 79 Ca 0.39 -0.11 -0.07 0.00 0.06 0.00 0.00 58.65 58.93 1um7 h GLN 79 Cb 0.14 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 1um7 h GLN 79 CO -0.16 0.56 -0.31 0.00 -0.67 0.00 0.00 178.83 178.24 1um7 h ALA 80 N 1.50 0.85 0.12 3.87 0.00 0.72 -3.00 119.26 123.32 1um7 h ALA 80 Ca 0.12 -0.29 -0.30 0.00 0.00 0.00 0.00 54.91 54.45 1um7 h ALA 80 Cb 0.30 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 1um7 h ALA 80 CO 0.01 0.39 -1.54 0.00 0.00 0.00 0.00 179.25 178.11 1um7 h ALA 81 N 1.69 0.21 0.00 0.00 0.00 0.62 -3.29 119.26 118.49 1um7 h ALA 81 Ca -0.00 -1.14 0.00 0.00 0.00 0.00 0.00 54.91 53.76 1um7 h ALA 81 Cb 1.09 0.52 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1um7 h ALA 81 CO 0.04 0.92 0.13 0.00 0.00 0.00 0.00 179.25 180.34 1um7 h ALA 82 N -0.03 1.13 0.00 0.00 0.00 0.20 1.10 119.26 121.65 1um7 h ALA 82 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1um7 h ALA 82 Cb 1.83 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.62 1um7 h ALA 82 CO 0.07 -0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.19 1um7 h ALA 83 N 1.73 1.00 0.00 0.00 0.00 -1.59 -2.52 119.26 117.87 1um7 h ALA 83 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1um7 h ALA 83 Cb 0.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1um7 h ALA 83 CO 0.00 0.00 -1.16 1.28 0.00 0.00 0.00 179.25 179.37 1um7 n LEU 84 N -2.67 0.60 0.07 0.00 7.99 0.37 -3.39 117.00 119.98 1um7 n LEU 84 Ca 0.04 -0.12 0.04 0.00 -0.01 0.00 0.00 56.01 55.96 1um7 n LEU 84 Cb 0.45 -0.06 -0.03 0.00 -0.11 0.00 0.00 43.42 43.66 1um7 n LEU 84 CO 0.31 0.08 -0.07 0.11 -1.51 0.00 0.00 177.39 176.32 1um7 h LYS 85 N 0.00 0.00 0.00 3.23 6.56 -1.16 -3.29 116.57 121.91 1um7 h LYS 85 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1um7 h LYS 85 Cb 0.72 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.38 1um7 h LYS 85 CO 0.00 0.21 -0.77 2.89 -2.06 0.00 0.00 179.45 179.72 1um7 n ARG 86 N -2.87 0.28 0.00 3.15 1.85 -0.97 -4.85 116.66 113.25 1um7 n ARG 86 Ca -0.05 0.05 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1um7 n ARG 86 Cb 0.72 -1.64 0.00 0.00 -1.05 0.00 0.00 32.46 30.49 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 -1.81 0.00 -2.98 2.89 0.00 -1.22 -5.09 120.51 112.30 1um7 n ALA 87 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1um7 n ALA 87 Cb 0.43 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.88 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 0.88 1.32 0.10 0.00 0.00 -1.26 -5.02 105.19 101.21 1um7 n GLY 88 Ca 0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.15 -4.21 1.61 4.20 -1.93 -3.38 115.11 111.24 1um7 h GLN 89 Ca 0.00 0.01 -0.74 0.00 0.06 0.00 0.00 58.65 57.98 1um7 h GLN 89 Cb 0.00 0.04 -0.26 0.00 0.30 0.00 0.00 27.48 27.55 1um7 h GLN 89 CO 0.00 0.06 -0.31 -1.54 -0.67 0.00 0.00 178.83 176.37 1um7 s SER 90 N -5.22 5.97 -0.05 1.46 1.04 -1.26 -1.71 113.70 113.93 1um7 s SER 90 Ca -0.14 -1.76 0.02 0.00 0.48 0.00 0.00 55.95 54.54 1um7 s SER 90 Cb 0.04 -2.12 -0.03 0.00 0.10 0.00 0.00 66.02 64.01 1um7 s SER 90 CO 0.64 -0.75 -0.08 -0.69 0.98 0.00 0.00 173.24 173.34 1um7 s VAL 91 N 1.51 3.60 -0.46 5.02 1.01 -1.07 -5.02 120.40 124.98 1um7 s VAL 91 Ca 0.04 -0.58 -0.09 0.00 0.00 0.00 0.00 61.98 61.35 1um7 s VAL 91 Cb -0.28 -2.48 0.11 0.00 0.00 0.00 0.00 36.38 33.73 1um7 s VAL 91 CO 0.02 0.55 0.32 -0.89 0.00 0.00 0.00 175.10 175.10 1um7 s THR 92 N -0.84 4.18 -0.37 3.92 2.01 -1.26 -1.88 115.64 121.40 1um7 s THR 92 Ca 0.13 -1.71 -0.15 0.00 0.31 0.00 0.00 61.69 60.27 1um7 s THR 92 Cb -0.11 -3.71 -0.00 0.00 0.01 0.00 0.00 72.50 68.69 1um7 s THR 92 CO 0.03 -0.71 0.34 -0.63 -0.69 0.00 0.00 174.62 172.95 1um7 s ILE 93 N 1.37 5.20 -0.50 1.82 1.09 0.49 0.12 121.20 130.78 1um7 s ILE 93 Ca 0.05 -0.20 -0.13 0.00 -1.10 0.00 0.00 60.65 59.26 1um7 s ILE 93 Cb -0.25 -3.85 0.12 0.00 -1.06 0.00 0.00 42.46 37.41 1um7 s ILE 93 CO -0.00 -0.17 0.42 -0.69 -0.10 0.00 0.00 174.94 174.40 1um7 s VAL 94 N 1.91 4.84 0.16 2.92 1.01 0.21 -0.50 120.40 130.96 1um7 s VAL 94 Ca 0.09 -1.53 0.08 0.00 0.00 0.00 0.00 61.98 60.63 1um7 s VAL 94 Cb -0.17 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.08 1um7 s VAL 94 CO 0.11 -0.78 -0.18 0.00 0.00 0.00 0.00 175.10 174.26 1um7 s ALA 95 N 1.52 1.96 -0.12 5.51 0.00 -1.00 -0.70 121.76 128.94 1um7 s ALA 95 Ca 0.04 -1.48 0.03 0.00 0.00 0.00 0.00 51.96 50.54 1um7 s ALA 95 Cb -0.28 -0.17 0.00 0.00 0.00 0.00 0.00 23.12 22.68 1um7 s ALA 95 CO 0.02 0.21 -0.22 1.14 0.00 0.00 0.00 175.76 176.92 1um7 s GLN 96 N -2.84 3.08 -0.67 0.00 -2.07 -0.15 0.46 119.66 117.47 1um7 s GLN 96 Ca 0.16 -0.85 -0.26 0.00 -1.82 0.00 0.00 55.36 52.59 1um7 s GLN 96 Cb -0.05 -2.39 -0.11 0.00 -1.09 0.00 0.00 33.01 29.36 1um7 s GLN 96 CO 0.06 0.11 2.42 0.98 -1.32 0.00 0.00 175.29 177.54 1um7 n TYR 97 N 3.73 1.28 -3.73 9.60 4.19 -1.26 -1.05 117.16 129.92 1um7 n TYR 97 Ca -0.19 0.04 -0.29 0.00 3.31 0.00 0.00 57.90 60.76 1um7 n TYR 97 Cb 0.52 -2.63 -0.13 0.00 0.49 0.00 0.00 39.34 37.59 1um7 n TYR 97 CO 0.00 0.00 0.00 1.03 0.91 0.00 0.00 176.86 178.80 1um7 s ARG 98 N 8.67 1.43 0.43 2.98 1.81 -1.26 -4.84 118.95 128.18 1um7 s ARG 98 Ca 0.95 -2.19 0.28 0.00 -1.72 0.00 0.00 55.73 53.05 1um7 s ARG 98 Cb -0.15 -2.47 0.88 0.00 -0.45 0.00 0.00 34.95 32.76 1um7 s ARG 98 CO 0.16 -1.18 1.79 -1.00 -0.68 0.00 0.00 175.30 174.38 1um7 h PRO 99 N 6.52 0.00 -0.59 3.54 0.13 -1.89 -3.17 132.00 136.54 1um7 h PRO 99 Ca 0.02 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 65.19 1um7 h PRO 99 Cb 0.91 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.99 1um7 h PRO 99 CO 0.52 0.00 0.32 1.49 -0.23 0.00 0.00 178.00 180.09 1um7 h GLU 100 N 0.00 0.59 0.23 0.86 4.81 -1.92 -1.25 114.58 117.90 1um7 h GLU 100 Ca 0.00 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.18 1um7 h GLU 100 Cb 0.70 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.95 1um7 h GLU 100 CO 0.00 0.39 -0.11 0.93 -0.73 0.00 0.00 179.01 179.49 1um7 h GLU 101 N 0.60 -0.30 -1.21 1.92 4.39 -1.93 -3.26 114.58 114.80 1um7 h GLU 101 Ca 0.26 0.02 0.42 0.00 0.34 0.00 0.00 59.36 60.40 1um7 h GLU 101 Cb 0.15 0.07 -0.12 0.00 -0.10 0.00 0.00 28.75 28.74 1um7 h GLU 101 CO -0.16 -0.20 0.78 0.98 -1.16 0.00 0.00 179.01 179.24 1um7 n TYR 102 N -4.32 0.61 -0.31 4.33 9.36 -1.20 0.85 117.16 126.48 1um7 n TYR 102 Ca -0.04 0.62 0.26 0.00 3.32 0.00 0.00 57.90 62.05 1um7 n TYR 102 Cb 0.12 -1.04 0.48 0.00 -0.63 0.00 0.00 39.34 38.27 1um7 n TYR 102 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1um7 n SER 103 N -4.44 0.21 -0.06 2.98 2.88 -0.47 0.15 113.62 114.86 1um7 n SER 103 Ca 0.35 1.57 -0.07 0.00 -1.33 0.00 0.00 58.87 59.39 1um7 n SER 103 Cb 1.37 -0.71 -0.01 0.00 -0.75 0.00 0.00 64.21 64.11 1um7 n SER 103 CO 0.00 0.00 0.00 -0.09 -1.23 0.00 0.00 175.04 173.72 1um7 h ARG 104 N 0.00 -0.16 -0.07 -1.46 2.43 0.25 -1.06 114.38 114.31 1um7 h ARG 104 Ca 0.73 0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.86 1um7 h ARG 104 Cb 1.85 0.04 0.00 0.00 -0.42 0.00 0.00 29.97 31.44 1um7 h ARG 104 CO -0.77 -0.11 -0.17 0.74 -1.51 0.00 0.00 179.97 178.15 1um7 h PHE 105 N -0.17 0.30 -0.93 2.20 0.04 0.12 -3.03 116.94 115.47 1um7 h PHE 105 Ca 0.14 -0.12 0.19 0.00 2.80 0.00 0.00 57.97 60.98 1um7 h PHE 105 Cb 0.39 -0.05 -0.18 0.00 2.20 0.00 0.00 35.95 38.31 1um7 h PHE 105 CO -0.36 0.78 -0.24 0.93 -0.60 0.00 0.00 178.31 178.83 1um7 h GLU 106 N -0.26 -0.00 0.93 1.51 4.39 -0.04 0.42 114.58 121.52 1um7 h GLU 106 Ca -0.00 0.00 -0.05 0.00 0.34 0.00 0.00 59.36 59.65 1um7 h GLU 106 Cb 0.78 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 29.44 1um7 h GLU 106 CO 0.04 -0.00 -0.44 1.03 -1.16 0.00 0.00 179.01 178.47 1um7 h SER 107 N -0.00 -1.05 -1.00 1.42 0.87 -1.24 -3.33 113.55 109.22 1um7 h SER 107 Ca 0.44 0.04 -0.60 0.00 -1.23 0.00 0.00 61.79 60.44 1um7 h SER 107 Cb 0.68 0.27 -0.09 0.00 -0.44 0.00 0.00 62.40 62.82 1um7 h SER 107 CO -0.96 -0.75 1.65 -0.44 -0.53 0.00 0.00 176.83 175.80 1um7 s SER 108 N -4.11 6.49 0.00 6.23 0.01 0.14 -4.94 113.70 117.52 1um7 s SER 108 Ca -0.19 -1.69 0.00 0.00 1.31 0.00 0.00 55.95 55.37 1um7 s SER 108 Cb 0.02 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.68 1um7 s SER 108 CO 0.60 -1.52 0.00 0.61 0.41 0.00 0.00 173.24 173.34 1um7 n GLY 109 N 6.44 2.19 3.55 3.44 0.00 -1.23 -4.76 105.19 114.83 1um7 n GLY 109 Ca 0.38 -2.07 -0.39 0.00 0.00 0.00 0.00 46.02 43.94 1um7 n GLY 109 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1um7 s PRO 110 N 1.32 2.92 0.23 1.61 0.04 -1.26 -4.87 135.00 134.99 1um7 s PRO 110 Ca 0.00 0.11 -0.15 0.00 0.04 0.00 0.00 61.00 61.00 1um7 s PRO 110 Cb 0.00 -4.35 0.27 0.00 0.04 0.00 0.00 34.50 30.46 1um7 s PRO 110 CO 0.00 -2.46 1.57 1.03 0.04 0.00 0.00 177.00 177.18 1um7 h SER 111 N 12.31 -1.10 0.00 6.66 0.87 -1.98 -3.42 113.55 126.88 1um7 h SER 111 Ca -0.24 0.27 0.00 0.00 -1.23 0.00 0.00 61.79 60.59 1um7 h SER 111 Cb 1.10 0.62 0.00 0.00 -0.44 0.00 0.00 62.40 63.68 1um7 h SER 111 CO 1.26 -0.29 0.00 -1.20 -0.53 0.00 0.00 176.83 176.06 1um7 n SER 112 N -5.50 0.00 0.00 6.23 7.64 -1.26 -5.30 113.62 115.43 1um7 n SER 112 Ca 0.10 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.98 1um7 n SER 112 Cb 0.41 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.61 1um7 n SER 112 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64