#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 -0.21 0.37 1.61 1.04 -1.26 -5.18 113.70 110.07 1um7 s SER 2 Ca 0.00 -0.02 0.08 0.00 0.48 0.00 0.00 55.95 56.49 1um7 s SER 2 Cb 0.00 0.24 -0.06 0.00 0.10 0.00 0.00 66.02 66.30 1um7 s SER 2 CO 0.00 -0.40 0.02 -0.44 0.98 0.00 0.00 173.24 173.40 1um7 s SER 3 N -2.36 4.06 0.00 7.02 0.01 -1.26 -5.15 113.70 116.02 1um7 s SER 3 Ca 0.08 -1.15 0.00 0.00 1.31 0.00 0.00 55.95 56.19 1um7 s SER 3 Cb -0.01 -0.45 0.00 0.00 0.21 0.00 0.00 66.02 65.77 1um7 s SER 3 CO -0.06 -0.35 0.00 0.61 0.41 0.00 0.00 173.24 173.85 1um7 n GLY 4 N -0.98 4.98 3.81 3.44 0.00 -1.26 -5.18 105.19 110.00 1um7 n GLY 4 Ca -0.04 -1.81 -0.05 0.00 0.00 0.00 0.00 46.02 44.12 1um7 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1um7 s SER 5 N 0.96 -0.19 -0.08 1.61 0.15 -1.26 -5.16 113.70 109.73 1um7 s SER 5 Ca 0.00 -0.58 0.03 0.00 0.70 0.00 0.00 55.95 56.11 1um7 s SER 5 Cb 0.00 0.63 0.00 0.00 -1.71 0.00 0.00 66.02 64.94 1um7 s SER 5 CO 0.00 -1.18 -0.18 -0.55 1.20 0.00 0.00 173.24 172.53 1um7 s SER 6 N -2.97 2.38 0.73 5.45 0.15 -1.26 -5.14 113.70 113.04 1um7 s SER 6 Ca 0.12 -0.42 -0.03 0.00 0.70 0.00 0.00 55.95 56.33 1um7 s SER 6 Cb -0.04 -1.02 0.12 0.00 -1.71 0.00 0.00 66.02 63.36 1um7 s SER 6 CO 0.05 0.11 0.76 0.61 1.20 0.00 0.00 173.24 175.97 1um7 n GLY 7 N 3.58 0.15 3.73 9.45 0.00 -1.26 -5.07 105.19 115.77 1um7 n GLY 7 Ca -0.21 -1.93 -0.36 0.00 0.00 0.00 0.00 46.02 43.52 1um7 n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1um7 s ARG 8 N -4.47 4.22 0.21 1.61 0.52 -1.26 -5.06 118.95 114.71 1um7 s ARG 8 Ca 0.48 0.05 -0.30 0.00 -0.52 0.00 0.00 55.73 55.44 1um7 s ARG 8 Cb -0.02 -3.41 -0.08 0.00 0.52 0.00 0.00 34.95 31.95 1um7 s ARG 8 CO 0.32 0.27 1.10 -1.25 0.02 0.00 0.00 175.30 175.77 1um7 s PRO 9 N 0.38 4.61 0.46 3.54 0.04 -1.26 -4.86 135.00 137.90 1um7 s PRO 9 Ca 0.15 1.75 0.00 0.00 0.04 0.00 0.00 61.00 62.95 1um7 s PRO 9 Cb -0.13 -3.25 0.00 0.00 0.04 0.00 0.00 34.50 31.17 1um7 s PRO 9 CO 0.03 0.11 0.00 0.41 0.04 0.00 0.00 177.00 177.60 1um7 n GLY 10 N 1.79 -0.40 0.00 0.56 0.00 -1.26 -4.94 105.19 100.93 1um7 n GLY 10 Ca 0.02 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.59 0.73 0.48 -0.02 0.00 -1.26 -4.96 105.19 99.57 1um7 n GLY 11 Ca 0.00 -0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 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 1.84 -2.46 1.61 9.92 -1.26 -5.01 116.55 121.20 1um7 n ASP 12 Ca 0.00 -3.64 -0.02 0.00 -0.53 0.00 0.00 54.79 50.61 1um7 n ASP 12 Cb 0.00 -0.50 0.00 0.00 -0.64 0.00 0.00 41.12 39.99 1um7 n ASP 12 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1um7 n ALA 13 N -1.15 -3.28 0.03 2.24 0.00 -1.26 -5.04 120.51 112.04 1um7 n ALA 13 Ca 0.18 0.52 -0.01 0.00 0.00 0.00 0.00 53.44 54.13 1um7 n ALA 13 Cb 0.69 -1.35 -0.00 0.00 0.00 0.00 0.00 19.45 18.79 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 0.30 0.07 -0.64 0.00 3.00 -1.26 -4.70 116.66 113.43 1um7 n ARG 14 Ca 0.02 0.03 -0.26 0.00 -0.01 0.00 0.00 57.85 57.63 1um7 n ARG 14 Cb 0.10 -0.58 0.15 0.00 0.00 0.00 0.00 32.46 32.12 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 -3.53 -1.78 -2.42 5.56 1.02 -1.26 -3.82 120.64 114.40 1um7 n GLU 15 Ca -0.02 -0.52 -0.43 0.00 -0.02 0.00 0.00 57.16 56.18 1um7 n GLU 15 Cb 0.07 -1.52 -0.02 0.00 -0.02 0.00 0.00 31.44 29.94 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 -3.31 4.27 0.66 3.49 0.04 -1.26 -4.22 135.00 134.66 1um7 s PRO 16 Ca 0.45 1.68 0.01 0.00 0.04 0.00 0.00 61.00 63.18 1um7 s PRO 16 Cb -0.07 -3.70 0.10 0.00 0.04 0.00 0.00 34.50 30.87 1um7 s PRO 16 CO 0.51 -0.63 0.91 -0.98 0.04 0.00 0.00 177.00 176.85 1um7 s ARG 17 N 3.10 1.98 -0.20 4.56 1.70 0.35 -4.81 118.95 125.63 1um7 s ARG 17 Ca 0.56 -1.12 -0.06 0.00 -0.47 0.00 0.00 55.73 54.63 1um7 s ARG 17 Cb -0.23 -2.42 -0.03 0.00 -0.57 0.00 0.00 34.95 31.70 1um7 s ARG 17 CO 0.17 -1.18 0.04 0.21 -1.08 0.00 0.00 175.30 173.46 1um7 s LYS 18 N -4.98 3.77 -0.08 3.89 2.20 -1.26 -2.12 119.74 121.17 1um7 s LYS 18 Ca 0.63 -0.44 0.00 0.00 -0.36 0.00 0.00 55.97 55.81 1um7 s LYS 18 Cb -0.07 -3.18 0.02 0.00 -1.51 0.00 0.00 37.83 33.10 1um7 s LYS 18 CO 0.42 0.08 -0.07 0.42 -0.36 0.00 0.00 175.35 175.84 1um7 s ILE 19 N 0.86 0.82 -0.40 5.43 1.01 0.17 -4.99 121.20 124.10 1um7 s ILE 19 Ca 0.02 -0.23 -0.06 0.00 0.00 0.00 0.00 60.65 60.39 1um7 s ILE 19 Cb -0.14 -0.84 0.09 0.00 0.01 0.00 0.00 42.46 41.58 1um7 s ILE 19 CO 0.02 0.31 0.21 -0.63 0.00 0.00 0.00 174.94 174.85 1um7 s ILE 20 N 1.28 3.66 -0.14 2.92 1.01 -1.26 0.16 121.20 128.83 1um7 s ILE 20 Ca -0.04 -1.69 -0.09 0.00 0.00 0.00 0.00 60.65 58.82 1um7 s ILE 20 Cb -0.14 -3.34 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 1um7 s ILE 20 CO -0.03 -0.54 0.18 -0.76 0.00 0.00 0.00 174.94 173.79 1um7 s LEU 21 N 1.28 4.33 -0.52 2.97 2.01 -0.78 -4.95 118.68 123.02 1um7 s LEU 21 Ca 0.04 0.45 -0.16 0.00 0.01 0.00 0.00 54.13 54.47 1um7 s LEU 21 Cb -0.23 -2.15 0.11 0.00 0.01 0.00 0.00 46.19 43.93 1um7 s LEU 21 CO -0.01 0.31 0.47 -1.00 1.01 0.00 0.00 176.35 177.13 1um7 s HIS 22 N -0.49 3.24 -0.50 0.29 3.76 -1.26 -2.75 115.29 117.59 1um7 s HIS 22 Ca 0.14 -1.16 -0.45 0.00 -0.15 0.00 0.00 55.06 53.44 1um7 s HIS 22 Cb -0.12 -3.60 -0.19 0.00 1.11 0.00 0.00 32.58 29.77 1um7 s HIS 22 CO 0.03 -0.96 1.94 1.63 -0.85 0.00 0.00 174.74 176.54 1um7 n LYS 23 N 5.27 0.01 0.00 1.40 5.02 -0.69 -4.69 118.16 124.48 1um7 n LYS 23 Ca -0.13 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 1um7 n LYS 23 Cb 0.41 -1.51 0.00 0.00 -0.02 0.00 0.00 35.03 33.92 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 6.22 -0.39 2.82 0.72 0.00 -0.85 -4.73 105.19 108.98 1um7 n GLY 24 Ca 0.46 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.10 1um7 n GLY 24 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1um7 n SER 25 N -2.16 5.81 -3.86 1.61 3.41 -1.26 -4.76 113.62 112.40 1um7 n SER 25 Ca 0.00 -3.46 -0.24 0.00 -0.26 0.00 0.00 58.87 54.90 1um7 n SER 25 Cb 0.00 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 62.87 1um7 n SER 25 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1um7 n THR 26 N 0.99 -3.52 0.00 6.66 -2.24 -1.26 -4.92 114.28 109.99 1um7 n THR 26 Ca 0.29 -0.46 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 1um7 n THR 26 Cb 0.35 -3.09 0.00 0.00 -2.10 0.00 0.00 70.33 65.49 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 -1.78 1.29 0.00 3.38 0.00 -1.26 -4.99 105.19 101.83 1um7 n GLY 27 Ca -0.28 -0.71 0.13 0.00 0.00 0.00 0.00 46.02 45.17 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 0.20 -0.66 0.99 7.99 -1.26 -2.01 117.00 122.24 1um7 n LEU 28 Ca 0.00 0.30 0.00 0.00 -0.01 0.00 0.00 56.01 56.30 1um7 n LEU 28 Cb 0.00 -0.40 0.00 0.00 -0.11 0.00 0.00 43.42 42.91 1um7 n LEU 28 CO 0.00 0.05 0.00 0.61 -1.51 0.00 0.00 177.39 176.54 1um7 n GLY 29 N 1.49 0.68 3.60 -0.72 0.00 -1.26 -1.27 105.19 107.72 1um7 n GLY 29 Ca 0.07 -0.49 -0.09 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.78 -0.38 0.54 1.61 -0.12 -1.26 -0.35 117.98 115.24 1um7 s PHE 30 Ca 0.00 0.77 0.05 0.00 -0.05 0.00 0.00 56.93 57.70 1um7 s PHE 30 Cb 0.00 0.42 0.05 0.00 -0.63 0.00 0.00 43.02 42.86 1um7 s PHE 30 CO 0.00 -0.28 0.75 1.21 -0.05 0.00 0.00 175.22 176.85 1um7 s ASN 31 N -0.59 5.22 0.02 1.98 3.84 0.17 -4.94 114.94 120.65 1um7 s ASN 31 Ca 0.01 -0.36 -0.00 0.00 0.21 0.00 0.00 52.86 52.72 1um7 s ASN 31 Cb -0.02 -0.45 -0.02 0.00 -0.55 0.00 0.00 41.25 40.21 1um7 s ASN 31 CO -0.02 -1.17 -0.03 0.27 -2.79 0.00 0.00 177.10 173.36 1um7 s ILE 32 N -2.67 0.14 0.34 -5.21 -4.36 -1.26 -2.47 121.20 105.70 1um7 s ILE 32 Ca 0.59 -1.02 0.07 0.00 -0.26 0.00 0.00 60.65 60.03 1um7 s ILE 32 Cb -0.09 -0.42 -0.03 0.00 1.25 0.00 0.00 42.46 43.18 1um7 s ILE 32 CO 0.38 -0.55 0.27 0.68 0.24 0.00 0.00 174.94 175.95 1um7 s VAL 33 N -1.74 0.03 0.46 8.37 -7.23 0.61 -4.61 120.40 116.29 1um7 s VAL 33 Ca -0.13 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.04 1um7 s VAL 33 Cb -0.08 -2.49 0.00 0.00 0.56 0.00 0.00 36.38 34.37 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 -0.64 -2.47 0.00 2.32 0.00 -1.26 -1.59 105.19 101.55 1um7 n GLY 34 Ca 0.07 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.21 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 -4.04 0.11 2.72 -0.02 0.00 -1.25 -4.14 105.19 98.56 1um7 n GLY 35 Ca -0.05 -0.41 -0.28 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 0.60 0.00 1.61 2.02 -1.26 0.19 118.70 121.86 1um7 s GLU 36 Ca 0.00 -0.49 0.00 0.00 0.02 0.00 0.00 54.97 54.50 1um7 s GLU 36 Cb 0.00 -2.03 0.00 0.00 0.10 0.00 0.00 34.13 32.20 1um7 s GLU 36 CO 0.00 -0.70 0.00 -0.25 0.02 0.00 0.00 175.26 174.33 1um7 n ASP 37 N 5.05 0.00 -0.70 -0.19 8.00 -1.26 -1.31 116.55 126.14 1um7 n ASP 37 Ca -0.08 0.00 -0.03 0.00 0.71 0.00 0.00 54.79 55.39 1um7 n ASP 37 Cb 0.46 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.53 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 0.16 0.00 0.44 0.00 -1.26 -4.34 105.19 100.19 1um7 n GLY 38 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1um7 n GLY 38 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1um7 n GLU 39 N 0.00 0.00 0.00 1.61 4.07 -0.43 -4.89 120.64 121.00 1um7 n GLU 39 Ca -0.13 0.07 0.00 0.00 -0.06 0.00 0.00 57.16 57.04 1um7 n GLU 39 Cb 0.47 -0.83 0.00 0.00 -0.06 0.00 0.00 31.44 31.02 1um7 n GLU 39 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1um7 n GLY 40 N -0.40 3.06 3.82 8.31 0.00 -1.26 -4.97 105.19 113.76 1um7 n GLY 40 Ca 0.00 0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 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 0.00 4.07 -0.12 -0.61 -1.09 -1.26 -3.94 121.20 118.24 1um7 s ILE 41 Ca 0.00 0.81 -0.30 0.00 -2.23 0.00 0.00 60.65 58.93 1um7 s ILE 41 Cb 0.00 -3.47 0.10 0.00 -1.58 0.00 0.00 42.46 37.51 1um7 s ILE 41 CO 0.00 -0.74 0.84 -0.36 -1.23 0.00 0.00 174.94 173.45 1um7 s PHE 42 N -2.80 -0.53 0.03 3.97 0.08 -0.62 -3.48 117.98 114.63 1um7 s PHE 42 Ca 0.60 0.95 -0.30 0.00 0.12 0.00 0.00 56.93 58.29 1um7 s PHE 42 Cb -0.14 0.42 -0.05 0.00 -0.57 0.00 0.00 43.02 42.68 1um7 s PHE 42 CO 0.46 -0.46 1.27 0.08 -0.10 0.00 0.00 175.22 176.47 1um7 s VAL 43 N -1.01 3.91 -0.45 -0.44 1.01 -0.88 0.22 120.40 122.77 1um7 s VAL 43 Ca -0.06 1.33 0.23 0.00 0.00 0.00 0.00 61.98 63.49 1um7 s VAL 43 Cb -0.01 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.50 1um7 s VAL 43 CO 0.05 0.06 1.12 -1.54 0.00 0.00 0.00 175.10 174.78 1um7 n SER 44 N 4.55 0.72 0.00 3.32 3.41 -1.03 -2.81 113.62 121.78 1um7 n SER 44 Ca 0.11 0.14 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 1um7 n SER 44 Cb 0.45 0.47 0.00 0.00 -0.26 0.00 0.00 64.21 64.87 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 -2.32 0.00 -3.82 7.33 7.35 -1.26 -4.90 117.46 119.84 1um7 n PHE 45 Ca 0.01 0.00 -0.29 0.00 -0.76 0.00 0.00 57.45 56.42 1um7 n PHE 45 Cb 0.49 0.00 -0.16 0.00 0.35 0.00 0.00 39.48 40.16 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 0.93 0.73 -2.13 1.01 -1.26 0.45 121.20 118.93 1um7 s ILE 46 Ca 0.00 -0.82 -0.17 0.00 0.00 0.00 0.00 60.65 59.66 1um7 s ILE 46 Cb 0.00 -1.34 -0.15 0.00 0.01 0.00 0.00 42.46 40.99 1um7 s ILE 46 CO 0.00 -0.16 -0.40 -0.11 0.00 0.00 0.00 174.94 174.27 1um7 n LEU 47 N 4.90 -4.55 -4.58 2.97 7.94 0.53 -4.86 117.00 119.34 1um7 n LEU 47 Ca -0.10 0.45 -0.41 0.00 -1.11 0.00 0.00 56.01 54.84 1um7 n LEU 47 Cb 0.46 -0.82 -0.08 0.00 0.53 0.00 0.00 43.42 43.51 1um7 n LEU 47 CO 0.15 -5.28 0.25 0.00 -1.11 0.00 0.00 177.39 171.39 1um7 s ALA 48 N -2.00 3.52 0.00 1.96 0.00 -1.26 -3.71 121.76 120.27 1um7 s ALA 48 Ca 0.50 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1um7 s ALA 48 Cb -0.35 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1um7 s ALA 48 CO 0.73 -1.03 0.00 0.41 0.00 0.00 0.00 175.76 175.87 1um7 n GLY 49 N 4.63 1.02 3.44 0.00 0.00 -1.26 -5.05 105.19 107.96 1um7 n GLY 49 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.87 1.50 0.16 -0.02 0.00 -1.24 -4.56 107.32 101.28 1um7 s GLY 50 Ca 0.00 -0.99 -0.00 0.00 0.00 0.00 0.00 44.72 43.73 1um7 s GLY 50 CO 0.00 0.00 1.39 -0.56 0.00 0.00 0.00 173.10 173.93 1um7 h PRO 51 N -3.10 0.31 0.00 2.90 0.13 -1.83 0.53 132.00 130.94 1um7 h PRO 51 Ca -0.42 -0.30 -0.09 0.00 -0.87 0.00 0.00 66.00 64.32 1um7 h PRO 51 Cb 1.31 0.08 -0.01 0.00 0.13 0.00 0.00 31.00 32.51 1um7 h PRO 51 CO 0.27 0.98 -0.41 0.00 -0.23 0.00 0.00 178.00 178.62 1um7 h ALA 52 N 0.92 1.20 0.00 -0.56 0.00 -1.37 -0.40 119.26 119.04 1um7 h ALA 52 Ca -0.05 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.46 1um7 h ALA 52 Cb 1.43 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 1um7 h ALA 52 CO 0.14 0.51 -0.51 0.22 0.00 0.00 0.00 179.25 179.60 1um7 h ASP 53 N 0.00 0.00 -0.65 0.00 3.58 -1.72 -3.28 116.42 114.34 1um7 h ASP 53 Ca -0.00 -0.11 0.13 0.00 0.42 0.00 0.00 57.03 57.47 1um7 h ASP 53 Cb 0.78 0.00 -0.12 0.00 1.72 0.00 0.00 39.33 41.71 1um7 h ASP 53 CO 0.05 0.83 -0.17 -0.07 -2.88 0.00 0.00 179.24 177.00 1um7 h LEU 54 N -1.00 -0.63 -0.86 2.28 3.38 0.01 0.38 115.31 118.87 1um7 h LEU 54 Ca -0.05 0.20 0.22 0.00 0.09 0.00 0.00 57.88 58.34 1um7 h LEU 54 Cb 0.55 0.41 -0.14 0.00 0.09 0.00 0.00 40.66 41.57 1um7 h LEU 54 CO -0.03 -0.22 0.15 0.77 0.09 0.00 0.00 178.44 179.19 1um7 h SER 55 N -0.01 -0.15 0.00 -0.43 4.64 -1.25 -3.45 113.55 112.91 1um7 h SER 55 Ca 0.31 0.21 0.00 0.00 -0.47 0.00 0.00 61.79 61.84 1um7 h SER 55 Cb 0.48 0.31 0.00 0.00 -0.31 0.00 0.00 62.40 62.89 1um7 h SER 55 CO -0.68 -0.19 0.00 0.61 -0.87 0.00 0.00 176.83 175.71 1um7 n GLY 56 N -1.40 2.87 0.26 -0.77 0.00 0.13 -4.83 105.19 101.45 1um7 n GLY 56 Ca 0.19 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.08 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 0.47 -0.58 -6.35 1.61 5.08 -1.83 -3.42 114.58 109.58 1um7 h GLU 57 Ca 0.00 0.04 -0.54 0.00 -1.00 0.00 0.00 59.36 57.86 1um7 h GLU 57 Cb 0.00 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1um7 h GLU 57 CO 0.00 -0.27 0.97 -1.17 -1.00 0.00 0.00 179.01 177.54 1um7 s LEU 58 N -9.53 4.33 0.00 1.33 2.96 -1.24 -4.99 118.68 111.55 1um7 s LEU 58 Ca -0.14 2.24 0.00 0.00 -0.22 0.00 0.00 54.13 56.01 1um7 s LEU 58 Cb 0.02 -3.55 -0.00 0.00 0.50 0.00 0.00 46.19 43.15 1um7 s LEU 58 CO 0.50 -0.84 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.55 1um7 s ARG 59 N 3.08 0.08 0.07 1.98 0.52 -1.26 -4.51 118.95 118.90 1um7 s ARG 59 Ca 0.70 -0.14 -0.37 0.00 -0.52 0.00 0.00 55.73 55.40 1um7 s ARG 59 Cb -0.34 0.02 -0.16 0.00 0.52 0.00 0.00 34.95 34.99 1um7 s ARG 59 CO 0.29 -0.01 1.41 -2.13 0.02 0.00 0.00 175.30 174.88 1um7 n ARG 60 N 2.73 1.30 0.00 3.54 0.63 -1.26 -1.59 116.66 122.01 1um7 n ARG 60 Ca -0.15 0.47 0.00 0.00 -0.92 0.00 0.00 57.85 57.25 1um7 n ARG 60 Cb 0.59 -2.13 0.00 0.00 0.45 0.00 0.00 32.46 31.36 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 2.80 1.57 3.70 5.14 0.00 -1.12 -4.89 105.19 112.39 1um7 n GLY 61 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1um7 n GLY 61 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1um7 s ASP 62 N -1.00 6.67 -0.05 1.61 -1.08 -0.62 -3.71 116.67 118.47 1um7 s ASP 62 Ca 0.00 2.43 -0.28 0.00 -0.52 0.00 0.00 52.55 54.18 1um7 s ASP 62 Cb 0.00 -2.57 -0.03 0.00 -1.46 0.00 0.00 42.92 38.86 1um7 s ASP 62 CO 0.00 -0.82 0.92 -0.60 0.52 0.00 0.00 175.17 175.19 1um7 s ARG 63 N 2.15 4.48 -1.00 4.34 3.52 -1.09 -2.07 118.95 129.27 1um7 s ARG 63 Ca 0.70 1.27 -0.23 0.00 -0.13 0.00 0.00 55.73 57.34 1um7 s ARG 63 Cb -0.39 -3.49 -0.02 0.00 -1.56 0.00 0.00 34.95 29.50 1um7 s ARG 63 CO 0.31 -0.11 1.80 0.42 -0.81 0.00 0.00 175.30 176.91 1um7 s ILE 64 N 1.30 3.63 0.04 4.11 -1.09 -1.23 -1.88 121.20 126.08 1um7 s ILE 64 Ca 0.47 -0.65 -0.28 0.00 -2.23 0.00 0.00 60.65 57.96 1um7 s ILE 64 Cb -0.19 -4.44 -0.17 0.00 -1.58 0.00 0.00 42.46 36.08 1um7 s ILE 64 CO 0.22 -1.28 1.41 -0.07 -1.23 0.00 0.00 174.94 173.99 1um7 h LEU 65 N 16.19 -0.53 -7.79 2.97 -0.00 -1.46 -3.44 115.31 121.26 1um7 h LEU 65 Ca 0.16 -0.06 -0.14 0.00 -0.00 0.00 0.00 57.88 57.84 1um7 h LEU 65 Cb 0.99 0.14 -0.19 0.00 -0.00 0.00 0.00 40.66 41.59 1um7 h LEU 65 CO 1.29 -0.24 -0.50 -0.94 -0.00 0.00 0.00 178.44 178.05 1um7 s SER 66 N -4.77 0.07 0.00 -0.43 1.04 -0.34 -2.65 113.70 106.63 1um7 s SER 66 Ca -0.15 -0.32 0.05 0.00 0.48 0.00 0.00 55.95 56.00 1um7 s SER 66 Cb 0.03 0.22 -0.01 0.00 0.10 0.00 0.00 66.02 66.35 1um7 s SER 66 CO 0.57 -0.43 -0.16 -0.69 0.98 0.00 0.00 173.24 173.51 1um7 s VAL 67 N -1.84 1.25 0.00 5.02 1.01 -1.11 0.27 120.40 125.00 1um7 s VAL 67 Ca -0.11 -0.76 0.00 0.00 0.00 0.00 0.00 61.98 61.11 1um7 s VAL 67 Cb -0.05 -1.06 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1um7 s VAL 67 CO -0.01 0.28 0.00 -3.20 0.00 0.00 0.00 175.10 172.18 1um7 n ASN 68 N 2.50 -0.90 -1.56 3.32 2.85 0.19 0.13 115.26 121.80 1um7 n ASN 68 Ca -0.15 0.45 -0.03 0.00 -0.11 0.00 0.00 54.58 54.74 1um7 n ASN 68 Cb 0.55 -0.94 0.01 0.00 1.24 0.00 0.00 39.78 40.64 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 -0.45 0.40 3.17 8.20 0.00 -1.25 -4.90 105.19 110.35 1um7 n GLY 69 Ca 0.00 -0.29 -0.21 0.00 0.00 0.00 0.00 46.02 45.53 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 -3.06 1.22 -0.42 1.61 0.11 0.35 -5.11 120.40 115.10 1um7 s VAL 70 Ca 0.03 -1.10 -0.23 0.00 -2.93 0.00 0.00 61.98 57.75 1um7 s VAL 70 Cb -0.00 -1.11 0.02 0.00 -1.53 0.00 0.00 36.38 33.76 1um7 s VAL 70 CO 0.13 -0.01 0.76 0.21 -3.33 0.00 0.00 175.10 172.85 1um7 s ASN 71 N -1.28 6.44 0.00 3.54 3.84 -1.26 -2.75 114.94 123.46 1um7 s ASN 71 Ca 0.02 0.01 0.00 0.00 0.21 0.00 0.00 52.86 53.10 1um7 s ASN 71 Cb -0.08 -2.38 0.00 0.00 -0.55 0.00 0.00 41.25 38.24 1um7 s ASN 71 CO 0.02 -0.82 0.59 0.18 -2.79 0.00 0.00 177.10 174.27 1um7 n LEU 72 N 6.53 1.11 -0.35 3.21 4.77 -1.08 -4.75 117.00 126.43 1um7 n LEU 72 Ca 0.02 -1.11 -0.09 0.00 -0.03 0.00 0.00 56.01 54.79 1um7 n LEU 72 Cb 0.48 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.49 1um7 n LEU 72 CO 0.56 0.28 0.45 0.54 -1.33 0.00 0.00 177.39 177.89 1um7 n ARG 73 N -0.15 -0.37 -1.69 3.23 1.74 -1.17 -0.01 116.66 118.24 1um7 n ARG 73 Ca 0.00 1.36 -0.31 0.00 -0.77 0.00 0.00 57.85 58.13 1um7 n ARG 73 Cb 0.14 -2.01 0.05 0.00 -1.02 0.00 0.00 32.46 29.62 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 -4.95 6.57 -4.99 0.55 4.13 -1.26 -4.71 115.26 110.60 1um7 n ASN 74 Ca 0.02 -3.78 -0.19 0.00 1.68 0.00 0.00 54.58 52.31 1um7 n ASN 74 Cb 0.22 -0.74 0.00 0.00 -1.54 0.00 0.00 39.78 37.72 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 -3.76 4.23 0.82 5.41 0.00 0.98 -4.51 121.76 124.94 1um7 s ALA 75 Ca 0.58 -1.45 0.00 0.00 0.00 0.00 0.00 51.96 51.09 1um7 s ALA 75 Cb 0.46 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.84 1um7 s ALA 75 CO -0.04 -0.16 0.00 0.25 0.00 0.00 0.00 175.76 175.81 1um7 n THR 76 N -1.77 0.00 0.01 0.00 -2.24 -1.26 -4.01 114.28 105.00 1um7 n THR 76 Ca 0.02 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.61 1um7 n THR 76 Cb 0.58 -1.82 -0.14 0.00 -2.10 0.00 0.00 70.33 66.85 1um7 n THR 76 CO 0.00 0.00 0.00 -0.74 -0.57 0.00 0.00 175.07 173.76 1um7 h HIS 77 N -0.37 0.37 -0.49 4.78 2.76 0.18 -3.10 115.15 119.29 1um7 h HIS 77 Ca 0.00 -0.27 -0.10 0.00 -2.20 0.00 0.00 60.37 57.80 1um7 h HIS 77 Cb 0.00 -0.01 -0.02 0.00 1.55 0.00 0.00 27.41 28.93 1um7 h HIS 77 CO 0.00 1.31 -0.10 1.49 -1.30 0.00 0.00 177.93 179.34 1um7 h GLU 78 N -0.53 0.89 -0.84 5.26 4.81 -1.90 -2.12 114.58 120.15 1um7 h GLU 78 Ca -0.16 -0.31 0.03 0.00 -0.13 0.00 0.00 59.36 58.79 1um7 h GLU 78 Cb 1.51 -0.07 -0.05 0.00 0.63 0.00 0.00 28.75 30.78 1um7 h GLU 78 CO 0.07 0.95 0.54 1.96 -0.73 0.00 0.00 179.01 181.80 1um7 h GLN 79 N 0.80 1.04 -0.00 1.92 4.20 -1.94 1.53 115.11 122.66 1um7 h GLN 79 Ca 0.13 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 58.70 1um7 h GLN 79 Cb 0.61 -0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 1um7 h GLN 79 CO 0.04 0.69 -0.40 0.00 -0.67 0.00 0.00 178.83 178.48 1um7 h ALA 80 N 1.34 1.33 0.09 3.87 0.00 -1.41 -2.32 119.26 122.15 1um7 h ALA 80 Ca 0.33 -0.37 -0.15 0.00 0.00 0.00 0.00 54.91 54.72 1um7 h ALA 80 Cb -0.03 -0.07 0.02 0.00 0.00 0.00 0.00 17.79 17.71 1um7 h ALA 80 CO -0.10 0.51 -0.63 0.00 0.00 0.00 0.00 179.25 179.03 1um7 h ALA 81 N 1.59 -0.05 0.00 0.00 0.00 -0.41 -3.14 119.26 117.25 1um7 h ALA 81 Ca -0.00 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.27 1um7 h ALA 81 Cb 0.72 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1um7 h ALA 81 CO 0.05 0.30 0.11 0.00 0.00 0.00 0.00 179.25 179.71 1um7 h ALA 82 N 0.11 1.10 0.00 0.00 0.00 0.23 1.28 119.26 121.97 1um7 h ALA 82 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.80 1um7 h ALA 82 Cb 1.47 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.26 1um7 h ALA 82 CO 0.12 -0.10 -0.28 0.00 0.00 0.00 0.00 179.25 178.99 1um7 h ALA 83 N 1.74 0.83 0.00 0.00 0.00 -1.37 -2.66 119.26 117.80 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 0.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1um7 h ALA 83 CO 0.00 0.00 -1.38 1.28 0.00 0.00 0.00 179.25 179.15 1um7 n LEU 84 N -2.38 0.47 0.05 0.00 7.99 0.43 -3.45 117.00 120.12 1um7 n LEU 84 Ca 0.04 -0.03 0.11 0.00 -0.01 0.00 0.00 56.01 56.13 1um7 n LEU 84 Cb 0.46 -0.04 0.04 0.00 -0.11 0.00 0.00 43.42 43.77 1um7 n LEU 84 CO 0.34 0.02 0.05 0.29 -1.51 0.00 0.00 177.39 176.58 1um7 n LYS 85 N -2.11 0.40 0.03 3.23 4.01 -0.63 -3.76 118.16 119.33 1um7 n LYS 85 Ca -0.00 0.04 0.11 0.00 -0.51 0.00 0.00 58.31 57.95 1um7 n LYS 85 Cb 0.49 -1.68 0.01 0.00 -0.51 0.00 0.00 35.03 33.34 1um7 n LYS 85 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 1um7 n ARG 86 N -2.22 0.32 0.00 1.97 -4.01 -1.01 -4.89 116.66 106.83 1um7 n ARG 86 Ca 0.01 -0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.82 1um7 n ARG 86 Cb 0.48 -1.60 0.00 0.00 -3.04 0.00 0.00 32.46 28.29 1um7 n ARG 86 CO 0.00 0.00 0.00 0.00 -3.04 0.00 0.00 177.63 174.59 1um7 n ALA 87 N -1.87 0.00 -2.87 2.89 0.00 -1.22 -5.09 120.51 112.34 1um7 n ALA 87 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1um7 n ALA 87 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.90 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 3.07 1.58 0.15 0.00 0.00 -1.26 -5.02 105.19 103.70 1um7 n GLY 88 Ca 0.00 -0.13 -0.12 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.23 -4.39 1.61 4.20 -1.93 -3.38 115.11 111.00 1um7 h GLN 89 Ca 0.00 0.02 -0.73 0.00 0.06 0.00 0.00 58.65 58.00 1um7 h GLN 89 Cb 0.00 0.05 -0.23 0.00 0.30 0.00 0.00 27.48 27.60 1um7 h GLN 89 CO 0.00 -0.15 -0.38 -1.54 -0.67 0.00 0.00 178.83 176.08 1um7 s SER 90 N -4.99 6.03 -0.13 1.46 1.04 -1.26 -1.71 113.70 114.15 1um7 s SER 90 Ca -0.14 -1.24 0.03 0.00 0.48 0.00 0.00 55.95 55.07 1um7 s SER 90 Cb 0.07 -2.14 0.01 0.00 0.10 0.00 0.00 66.02 64.06 1um7 s SER 90 CO 0.66 -0.57 -0.21 -0.69 0.98 0.00 0.00 173.24 173.41 1um7 s VAL 91 N 1.61 1.95 -0.59 5.02 1.01 -1.11 -5.02 120.40 123.28 1um7 s VAL 91 Ca 0.04 -0.92 -0.19 0.00 0.00 0.00 0.00 61.98 60.91 1um7 s VAL 91 Cb -0.23 -1.73 0.10 0.00 0.00 0.00 0.00 36.38 34.53 1um7 s VAL 91 CO 0.07 0.53 0.70 -0.89 0.00 0.00 0.00 175.10 175.51 1um7 s THR 92 N 0.76 4.83 -0.36 3.92 2.01 -1.26 -1.87 115.64 123.66 1um7 s THR 92 Ca -0.09 -0.99 -0.17 0.00 0.31 0.00 0.00 61.69 60.75 1um7 s THR 92 Cb -0.16 -4.48 -0.00 0.00 0.01 0.00 0.00 72.50 67.87 1um7 s THR 92 CO -0.00 -1.11 0.45 -0.63 -0.69 0.00 0.00 174.62 172.64 1um7 s ILE 93 N 2.67 5.08 -0.49 1.82 1.09 0.42 0.57 121.20 132.34 1um7 s ILE 93 Ca 0.11 0.09 -0.13 0.00 -1.10 0.00 0.00 60.65 59.62 1um7 s ILE 93 Cb -0.24 -3.94 0.11 0.00 -1.06 0.00 0.00 42.46 37.33 1um7 s ILE 93 CO 0.06 -0.23 0.41 -0.69 -0.10 0.00 0.00 174.94 174.39 1um7 s VAL 94 N 2.23 4.76 0.27 2.92 1.01 0.14 -0.65 120.40 131.07 1um7 s VAL 94 Ca 0.15 -1.53 0.09 0.00 0.00 0.00 0.00 61.98 60.69 1um7 s VAL 94 Cb -0.16 -4.03 -0.05 0.00 0.00 0.00 0.00 36.38 32.13 1um7 s VAL 94 CO 0.13 -0.76 -0.14 0.00 0.00 0.00 0.00 175.10 174.33 1um7 s ALA 95 N 1.50 2.50 -0.24 5.51 0.00 -0.90 -1.08 121.76 129.05 1um7 s ALA 95 Ca 0.04 -1.85 0.01 0.00 0.00 0.00 0.00 51.96 50.16 1um7 s ALA 95 Cb -0.27 -0.10 0.04 0.00 0.00 0.00 0.00 23.12 22.79 1um7 s ALA 95 CO 0.02 0.13 -0.11 1.14 0.00 0.00 0.00 175.76 176.94 1um7 s GLN 96 N -3.60 2.54 -0.75 0.00 -2.07 -0.79 0.13 119.66 115.12 1um7 s GLN 96 Ca 0.28 -1.16 -0.26 0.00 -1.82 0.00 0.00 55.36 52.41 1um7 s GLN 96 Cb -0.01 -2.87 -0.16 0.00 -1.09 0.00 0.00 33.01 28.89 1um7 s GLN 96 CO 0.12 -0.46 2.47 0.98 -1.32 0.00 0.00 175.29 177.08 1um7 n TYR 97 N 4.54 0.97 -3.49 9.60 4.19 -1.25 -2.68 117.16 129.04 1um7 n TYR 97 Ca -0.16 0.16 -0.28 0.00 3.31 0.00 0.00 57.90 60.93 1um7 n TYR 97 Cb 0.45 -2.33 -0.11 0.00 0.49 0.00 0.00 39.34 37.83 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 0.86 0.17 2.98 3.52 -1.24 -4.72 118.95 128.99 1um7 s ARG 98 Ca 1.12 -1.80 0.01 0.00 -0.13 0.00 0.00 55.73 54.93 1um7 s ARG 98 Cb -0.56 -1.57 0.02 0.00 -1.56 0.00 0.00 34.95 31.28 1um7 s ARG 98 CO 0.33 -1.27 1.40 -1.00 -0.81 0.00 0.00 175.30 173.95 1um7 h PRO 99 N 6.39 0.28 -1.00 5.12 0.13 -1.88 -3.06 132.00 137.98 1um7 h PRO 99 Ca 0.13 -0.27 0.26 0.00 -0.87 0.00 0.00 66.00 65.25 1um7 h PRO 99 Cb 0.93 0.07 -0.07 0.00 0.13 0.00 0.00 31.00 32.06 1um7 h PRO 99 CO 0.35 0.96 0.67 0.93 -0.23 0.00 0.00 178.00 180.68 1um7 h GLU 100 N 0.17 0.27 0.00 0.86 5.08 -1.92 1.52 114.58 120.56 1um7 h GLU 100 Ca -0.04 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1um7 h GLU 100 Cb 1.43 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1um7 h GLU 100 CO 0.13 0.18 -0.01 0.93 -1.00 0.00 0.00 179.01 179.24 1um7 h GLU 101 N 0.28 0.00 0.00 2.33 4.39 -1.91 -3.30 114.58 116.37 1um7 h GLU 101 Ca 0.53 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.23 1um7 h GLU 101 Cb 1.56 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.21 1um7 h GLU 101 CO -0.18 0.00 0.09 -0.92 -1.16 0.00 0.00 179.01 176.85 1um7 h TYR 102 N -0.92 0.00 -0.97 4.33 3.20 -1.32 -2.67 116.97 118.62 1um7 h TYR 102 Ca 0.00 0.00 0.29 0.00 3.14 0.00 0.00 58.73 62.16 1um7 h TYR 102 Cb 0.01 0.00 -0.18 0.00 1.54 0.00 0.00 36.73 38.11 1um7 h TYR 102 CO -0.01 0.00 0.13 1.03 -1.64 0.00 0.00 178.16 177.67 1um7 h SER 103 N 0.00 -0.31 -0.54 -2.11 0.87 0.21 1.32 113.55 112.99 1um7 h SER 103 Ca 0.00 0.27 0.07 0.00 -1.23 0.00 0.00 61.79 60.90 1um7 h SER 103 Cb 0.19 0.43 -0.06 0.00 -0.44 0.00 0.00 62.40 62.52 1um7 h SER 103 CO 0.00 -0.34 0.22 0.08 -0.53 0.00 0.00 176.83 176.26 1um7 h ARG 104 N 0.03 0.41 -0.02 2.24 0.11 -1.71 -0.40 114.38 115.04 1um7 h ARG 104 Ca 0.63 -0.02 -0.09 0.00 0.10 0.00 0.00 59.98 60.59 1um7 h ARG 104 Cb 1.35 -0.09 -0.01 0.00 1.11 0.00 0.00 29.97 32.33 1um7 h ARG 104 CO -0.86 0.27 -0.42 0.74 0.10 0.00 0.00 179.97 179.80 1um7 h PHE 105 N 0.42 0.06 0.66 4.08 0.04 0.13 -3.02 116.94 119.32 1um7 h PHE 105 Ca 0.26 -0.02 -0.03 0.00 2.80 0.00 0.00 57.97 60.99 1um7 h PHE 105 Cb 0.26 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 38.40 1um7 h PHE 105 CO -0.14 0.47 -0.40 0.93 -0.60 0.00 0.00 178.31 178.56 1um7 h GLU 106 N 0.04 -0.96 -0.43 1.51 4.39 0.11 0.37 114.58 119.61 1um7 h GLU 106 Ca 0.00 0.07 0.08 0.00 0.34 0.00 0.00 59.36 59.85 1um7 h GLU 106 Cb 0.77 0.22 -0.09 0.00 -0.10 0.00 0.00 28.75 29.54 1um7 h GLU 106 CO 0.06 -0.64 -0.35 0.77 -1.16 0.00 0.00 179.01 177.69 1um7 h SER 107 N -0.99 -1.15 0.10 1.42 0.02 -1.40 -1.61 113.55 109.92 1um7 h SER 107 Ca -0.09 0.20 0.02 0.00 -0.84 0.00 0.00 61.79 61.08 1um7 h SER 107 Cb 0.80 0.54 -0.05 0.00 0.14 0.00 0.00 62.40 63.83 1um7 h SER 107 CO 0.09 -0.33 -0.42 0.28 -1.14 0.00 0.00 176.83 175.32 1um7 h SER 108 N -0.25 -1.25 -3.50 3.07 0.02 -1.41 -3.43 113.55 106.81 1um7 h SER 108 Ca 0.17 0.14 -0.57 0.00 -0.84 0.00 0.00 61.79 60.69 1um7 h SER 108 Cb 0.55 0.47 0.17 0.00 0.14 0.00 0.00 62.40 63.73 1um7 h SER 108 CO -0.56 -0.48 0.03 0.61 -1.14 0.00 0.00 176.83 175.28 1um7 n GLY 109 N -1.46 -0.55 3.68 -3.77 0.00 0.13 -4.90 105.19 98.32 1um7 n GLY 109 Ca -0.07 -0.17 -0.42 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.71 4.32 -0.64 1.61 0.04 -1.26 -4.88 135.00 131.48 1um7 s PRO 110 Ca 0.75 1.70 -0.28 0.00 0.04 0.00 0.00 61.00 63.21 1um7 s PRO 110 Cb -0.41 -3.60 0.03 0.00 0.04 0.00 0.00 34.50 30.56 1um7 s PRO 110 CO 0.48 -0.50 1.25 -1.12 0.04 0.00 0.00 177.00 177.14 1um7 s SER 111 N 1.60 6.31 0.25 6.66 0.01 -1.26 -4.94 113.70 122.33 1um7 s SER 111 Ca 0.56 -0.09 -0.17 0.00 1.31 0.00 0.00 55.95 57.56 1um7 s SER 111 Cb -0.25 -2.56 0.01 0.00 0.21 0.00 0.00 66.02 63.44 1um7 s SER 111 CO 0.21 -1.64 0.58 -0.94 0.41 0.00 0.00 173.24 171.86 1um7 s SER 112 N 3.39 -0.18 0.00 2.44 1.04 -1.26 -5.27 113.70 113.86 1um7 s SER 112 Ca 0.41 -0.74 0.00 0.00 0.48 0.00 0.00 55.95 56.10 1um7 s SER 112 Cb -0.08 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.68 1um7 s SER 112 CO 0.21 -1.21 0.00 0.61 0.98 0.00 0.00 173.24 173.83