#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 1.90 0.26 1.61 1.04 -1.26 -5.04 113.70 112.22 1um7 s SER 2 Ca 0.00 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.60 1um7 s SER 2 Cb 0.00 -0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.07 1um7 s SER 2 CO 0.00 -0.18 0.00 -0.24 0.98 0.00 0.00 173.24 173.80 1um7 n SER 3 N 0.48 -1.94 0.00 7.02 2.88 -1.26 -5.10 113.62 115.70 1um7 n SER 3 Ca -0.15 0.50 0.00 0.00 -1.33 0.00 0.00 58.87 57.88 1um7 n SER 3 Cb 0.57 1.97 0.00 0.00 -0.75 0.00 0.00 64.21 66.01 1um7 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1um7 n GLY 4 N -0.63 2.16 1.39 0.46 0.00 -1.26 -5.10 105.19 102.22 1um7 n GLY 4 Ca 0.00 -0.62 0.17 0.00 0.00 0.00 0.00 46.02 45.57 1um7 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1um7 n SER 5 N 0.00 -7.55 -3.61 1.61 7.64 -1.26 -5.06 113.62 105.39 1um7 n SER 5 Ca 0.00 1.23 0.01 0.00 1.01 0.00 0.00 58.87 61.12 1um7 n SER 5 Cb 0.00 -4.68 -0.01 0.00 -1.01 0.00 0.00 64.21 58.51 1um7 n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1um7 s SER 6 N -7.06 -0.06 -0.13 6.43 0.01 -1.26 -5.19 113.70 106.44 1um7 s SER 6 Ca 0.00 -0.10 -0.30 0.00 1.31 0.00 0.00 55.95 56.86 1um7 s SER 6 Cb 0.00 0.14 0.11 0.00 0.21 0.00 0.00 66.02 66.48 1um7 s SER 6 CO 0.00 -0.25 0.91 -0.83 0.41 0.00 0.00 173.24 173.48 1um7 s GLY 7 N -2.81 -0.35 0.00 3.44 0.00 -1.26 -5.17 107.32 101.17 1um7 s GLY 7 Ca 0.13 1.83 0.05 0.00 0.00 0.00 0.00 44.72 46.73 1um7 s GLY 7 CO -0.04 1.00 -0.14 0.50 0.00 0.00 0.00 173.10 174.42 1um7 s ARG 8 N -1.15 1.09 0.32 2.90 0.52 -1.26 -5.15 118.95 116.21 1um7 s ARG 8 Ca -0.04 -0.59 -0.05 0.00 -0.52 0.00 0.00 55.73 54.53 1um7 s ARG 8 Cb -0.00 -1.07 0.08 0.00 0.52 0.00 0.00 34.95 34.47 1um7 s ARG 8 CO 0.04 0.29 0.35 -0.35 0.02 0.00 0.00 175.30 175.64 1um7 n PRO 9 N 2.48 -0.99 0.00 3.54 -0.04 -1.26 -5.11 135.00 133.62 1um7 n PRO 9 Ca -0.15 -0.55 0.00 0.00 -0.04 0.00 0.00 63.50 62.76 1um7 n PRO 9 Cb 0.55 -0.43 0.00 0.00 -0.04 0.00 0.00 33.50 33.58 1um7 n PRO 9 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1um7 n GLY 10 N 1.47 5.51 0.00 0.55 0.00 -1.26 -5.18 105.19 106.28 1um7 n GLY 10 Ca 0.05 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.02 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 1.29 3.34 1.84 -0.02 0.00 -1.26 -4.84 105.19 105.54 1um7 n GLY 11 Ca 0.00 -1.93 -0.06 0.00 0.00 0.00 0.00 46.02 44.03 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 4.39 -2.04 1.61 8.00 -1.26 -4.91 116.55 122.34 1um7 n ASP 12 Ca 0.00 -3.04 -0.02 0.00 0.71 0.00 0.00 54.79 52.44 1um7 n ASP 12 Cb 0.00 -0.72 0.00 0.00 -0.02 0.00 0.00 41.12 40.39 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 -0.11 -3.07 0.06 2.24 0.00 -1.26 -5.05 120.51 113.32 1um7 n ALA 13 Ca 0.36 0.40 0.00 0.00 0.00 0.00 0.00 53.44 54.19 1um7 n ALA 13 Cb 1.25 -1.20 0.00 0.00 0.00 0.00 0.00 19.45 19.51 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 -0.19 0.00 -0.70 0.00 3.00 -1.26 -4.80 116.66 112.71 1um7 n ARG 14 Ca 0.03 0.00 -0.26 0.00 -0.01 0.00 0.00 57.85 57.62 1um7 n ARG 14 Cb 0.13 -0.31 0.12 0.00 0.00 0.00 0.00 32.46 32.39 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 -3.25 -1.35 -2.38 5.56 1.02 -1.26 -4.28 120.64 114.70 1um7 n GLU 15 Ca 0.00 -0.39 -0.43 0.00 -0.02 0.00 0.00 57.16 56.32 1um7 n GLU 15 Cb 0.11 -1.40 -0.02 0.00 -0.02 0.00 0.00 31.44 30.11 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 -3.00 3.95 0.68 3.49 0.04 -1.26 -4.53 135.00 134.38 1um7 s PRO 16 Ca 0.39 1.37 -0.03 0.00 0.04 0.00 0.00 61.00 62.78 1um7 s PRO 16 Cb -0.03 -3.88 0.09 0.00 0.04 0.00 0.00 34.50 30.71 1um7 s PRO 16 CO 0.49 -1.07 0.95 -0.98 0.04 0.00 0.00 177.00 176.42 1um7 s ARG 17 N 4.12 2.02 -0.21 4.56 1.70 -0.93 -4.88 118.95 125.32 1um7 s ARG 17 Ca 0.58 -0.75 -0.04 0.00 -0.47 0.00 0.00 55.73 55.05 1um7 s ARG 17 Cb -0.18 -2.31 -0.02 0.00 -0.57 0.00 0.00 34.95 31.87 1um7 s ARG 17 CO 0.22 -1.22 -0.03 0.21 -1.08 0.00 0.00 175.30 173.40 1um7 s LYS 18 N -5.09 3.47 -0.32 3.89 2.20 -1.26 -3.15 119.74 119.47 1um7 s LYS 18 Ca 0.62 -0.59 0.04 0.00 -0.36 0.00 0.00 55.97 55.68 1um7 s LYS 18 Cb -0.08 -3.01 0.09 0.00 -1.51 0.00 0.00 37.83 33.32 1um7 s LYS 18 CO 0.43 -0.09 0.01 0.42 -0.36 0.00 0.00 175.35 175.77 1um7 s ILE 19 N 1.22 2.20 -0.61 5.43 1.01 0.26 -4.96 121.20 125.75 1um7 s ILE 19 Ca 0.03 -2.15 -0.20 0.00 0.00 0.00 0.00 60.65 58.33 1um7 s ILE 19 Cb -0.14 -2.55 0.10 0.00 0.01 0.00 0.00 42.46 39.87 1um7 s ILE 19 CO -0.00 -0.47 0.77 -0.63 0.00 0.00 0.00 174.94 174.60 1um7 s ILE 20 N 0.97 4.70 -0.17 2.92 1.01 -1.26 0.50 121.20 129.87 1um7 s ILE 20 Ca 0.06 -0.84 -0.10 0.00 0.00 0.00 0.00 60.65 59.77 1um7 s ILE 20 Cb -0.19 -4.54 -0.05 0.00 0.01 0.00 0.00 42.46 37.69 1um7 s ILE 20 CO -0.08 -1.21 0.17 -0.76 0.00 0.00 0.00 174.94 173.06 1um7 s LEU 21 N 3.03 4.25 -0.49 2.97 1.43 -0.70 -4.92 118.68 124.25 1um7 s LEU 21 Ca 0.14 0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 53.40 1um7 s LEU 21 Cb -0.22 -2.15 0.06 0.00 0.03 0.00 0.00 46.19 43.90 1um7 s LEU 21 CO 0.07 0.21 0.56 -1.00 0.23 0.00 0.00 176.35 176.41 1um7 s HIS 22 N 0.12 3.10 -0.47 0.29 3.76 -1.26 -2.56 115.29 118.28 1um7 s HIS 22 Ca 0.11 -0.62 -0.42 0.00 -0.15 0.00 0.00 55.06 53.98 1um7 s HIS 22 Cb -0.12 -3.40 -0.17 0.00 1.11 0.00 0.00 32.58 30.00 1um7 s HIS 22 CO 0.00 -0.95 2.14 1.63 -0.85 0.00 0.00 174.74 176.71 1um7 n LYS 23 N 5.90 0.23 0.12 1.40 5.02 -0.65 -4.77 118.16 125.40 1um7 n LYS 23 Ca -0.08 0.06 -0.06 0.00 -2.02 0.00 0.00 58.31 56.21 1um7 n LYS 23 Cb 0.45 -1.70 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 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 9.58 -0.39 0.00 0.72 0.00 -1.88 -3.48 103.07 107.62 1um7 h GLY 24 Ca -0.14 0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1um7 h GLY 24 CO 1.07 -0.14 0.00 -1.26 0.00 0.00 0.00 176.54 176.21 1um7 n SER 25 N -4.63 -3.05 0.01 0.19 2.88 -1.26 -4.97 113.62 102.79 1um7 n SER 25 Ca -0.05 0.66 -0.13 0.00 -1.33 0.00 0.00 58.87 58.03 1um7 n SER 25 Cb 0.15 2.96 -0.10 0.00 -0.75 0.00 0.00 64.21 66.48 1um7 n SER 25 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1um7 h THR 26 N 0.00 1.24 0.00 2.46 1.35 -2.00 -3.50 112.91 112.47 1um7 h THR 26 Ca 0.00 -1.21 0.00 0.00 -0.55 0.00 0.00 66.41 64.65 1um7 h THR 26 Cb 0.00 2.01 0.00 0.00 -1.73 0.00 0.00 68.15 68.43 1um7 h THR 26 CO 0.00 0.29 0.00 0.61 -0.25 0.00 0.00 175.52 176.17 1um7 n GLY 27 N 0.41 1.14 0.00 5.82 0.00 -1.26 -4.97 105.19 106.33 1um7 n GLY 27 Ca -0.09 0.14 0.11 0.00 0.00 0.00 0.00 46.02 46.19 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 0.68 -0.97 0.99 7.99 -1.26 -2.76 117.00 121.67 1um7 n LEU 28 Ca 0.00 -0.18 -0.01 0.00 -0.01 0.00 0.00 56.01 55.81 1um7 n LEU 28 Cb 0.00 -0.16 0.01 0.00 -0.11 0.00 0.00 43.42 43.16 1um7 n LEU 28 CO 0.00 0.17 0.01 0.61 -1.51 0.00 0.00 177.39 176.67 1um7 n GLY 29 N 1.49 0.59 3.59 -0.72 0.00 -1.26 -0.88 105.19 108.01 1um7 n GLY 29 Ca 0.05 -0.52 -0.10 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.02 -0.37 0.50 1.61 -0.12 -1.26 0.69 117.98 116.01 1um7 s PHE 30 Ca 0.02 0.71 0.09 0.00 -0.05 0.00 0.00 56.93 57.70 1um7 s PHE 30 Cb -0.01 0.43 0.05 0.00 -0.63 0.00 0.00 43.02 42.86 1um7 s PHE 30 CO 0.05 -0.30 0.64 1.21 -0.05 0.00 0.00 175.22 176.78 1um7 s ASN 31 N -0.80 5.27 0.07 1.98 3.84 0.81 -4.94 114.94 121.16 1um7 s ASN 31 Ca -0.00 -0.71 0.00 0.00 0.21 0.00 0.00 52.86 52.36 1um7 s ASN 31 Cb -0.02 -0.12 -0.04 0.00 -0.55 0.00 0.00 41.25 40.52 1um7 s ASN 31 CO -0.01 -1.05 -0.05 0.27 -2.79 0.00 0.00 177.10 173.48 1um7 s ILE 32 N -2.54 0.41 0.31 -5.21 -4.36 -1.26 -2.56 121.20 105.99 1um7 s ILE 32 Ca 0.56 -1.74 0.02 0.00 -0.26 0.00 0.00 60.65 59.23 1um7 s ILE 32 Cb -0.07 -1.43 -0.02 0.00 1.25 0.00 0.00 42.46 42.20 1um7 s ILE 32 CO 0.34 -0.87 0.32 0.68 0.24 0.00 0.00 174.94 175.65 1um7 s VAL 33 N -3.45 0.00 0.00 8.37 -7.23 0.53 -4.56 120.40 114.06 1um7 s VAL 33 Ca 0.06 -1.84 0.00 0.00 -1.81 0.00 0.00 61.98 58.39 1um7 s VAL 33 Cb 0.04 -2.53 0.00 0.00 0.56 0.00 0.00 36.38 34.46 1um7 s VAL 33 CO -0.07 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.33 1um7 n GLY 34 N -0.53 -1.41 0.19 2.32 0.00 -1.26 -1.57 105.19 102.93 1um7 n GLY 34 Ca 0.04 -2.07 0.00 0.00 0.00 0.00 0.00 46.02 43.99 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 1.84 3.10 -0.02 0.00 -1.25 -4.06 105.19 104.80 1um7 n GLY 35 Ca 0.00 -0.08 -0.30 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.27 2.48 -0.45 1.61 2.02 -1.26 -4.52 118.70 117.31 1um7 s GLU 36 Ca 0.00 -0.66 -0.04 0.00 0.02 0.00 0.00 54.97 54.29 1um7 s GLU 36 Cb 0.00 -2.04 0.03 0.00 0.10 0.00 0.00 34.13 32.22 1um7 s GLU 36 CO 0.00 -0.02 0.11 -0.25 0.02 0.00 0.00 175.26 175.11 1um7 n ASP 37 N 4.08 -1.63 -3.79 -0.19 8.00 -1.26 0.20 116.55 121.97 1um7 n ASP 37 Ca -0.19 0.19 -0.30 0.00 0.71 0.00 0.00 54.79 55.19 1um7 n ASP 37 Cb 0.51 -1.49 0.02 0.00 -0.02 0.00 0.00 41.12 40.15 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 -0.65 -0.70 0.11 0.44 0.00 -1.26 -4.89 105.19 98.24 1um7 n GLY 38 Ca -0.00 0.33 -0.16 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.91 0.25 0.00 1.61 4.11 -0.56 -3.44 114.58 114.64 1um7 h GLU 39 Ca -0.65 -0.43 0.00 0.00 0.07 0.00 0.00 59.36 58.35 1um7 h GLU 39 Cb 1.37 0.16 0.00 0.00 0.50 0.00 0.00 28.75 30.78 1um7 h GLU 39 CO 0.53 1.13 0.00 0.41 0.07 0.00 0.00 179.01 181.15 1um7 n GLY 40 N 1.63 4.12 3.89 1.06 0.00 -1.25 -4.96 105.19 109.67 1um7 n GLY 40 Ca -0.14 -1.60 -0.33 0.00 0.00 0.00 0.00 46.02 43.95 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 -2.15 5.33 0.10 -0.61 -1.09 -1.22 -3.91 121.20 117.66 1um7 s ILE 41 Ca 0.00 -0.20 -0.05 0.00 -2.23 0.00 0.00 60.65 58.18 1um7 s ILE 41 Cb 0.00 -3.49 -0.02 0.00 -1.58 0.00 0.00 42.46 37.37 1um7 s ILE 41 CO 0.00 0.33 0.11 -0.36 -1.23 0.00 0.00 174.94 173.79 1um7 s PHE 42 N -1.31 0.48 0.07 3.97 0.40 -0.61 0.28 117.98 121.27 1um7 s PHE 42 Ca 0.27 -0.92 -0.30 0.00 -0.60 0.00 0.00 56.93 55.38 1um7 s PHE 42 Cb -0.13 -0.26 -0.05 0.00 0.51 0.00 0.00 43.02 43.10 1um7 s PHE 42 CO 0.18 -0.52 0.95 0.08 0.70 0.00 0.00 175.22 176.61 1um7 s VAL 43 N -3.94 4.62 -0.11 -0.44 1.01 -0.34 0.20 120.40 121.39 1um7 s VAL 43 Ca 0.13 2.03 0.20 0.00 0.00 0.00 0.00 61.98 64.34 1um7 s VAL 43 Cb 0.06 -4.31 -0.24 0.00 0.00 0.00 0.00 36.38 31.90 1um7 s VAL 43 CO -0.05 0.28 0.53 -1.54 0.00 0.00 0.00 175.10 174.32 1um7 n SER 44 N 3.10 0.27 -3.59 3.32 3.41 -1.06 -3.56 113.62 115.50 1um7 n SER 44 Ca 0.03 0.11 0.01 0.00 -0.26 0.00 0.00 58.87 58.76 1um7 n SER 44 Cb 0.50 1.26 -0.01 0.00 -0.26 0.00 0.00 64.21 65.70 1um7 n SER 44 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 1um7 s PHE 45 N -3.18 -0.03 -0.08 7.33 5.36 -1.26 -4.92 117.98 121.20 1um7 s PHE 45 Ca -0.06 -0.01 -0.01 0.00 -0.96 0.00 0.00 56.93 55.88 1um7 s PHE 45 Cb 0.11 0.52 0.03 0.00 -0.34 0.00 0.00 43.02 43.33 1um7 s PHE 45 CO 0.86 -0.13 -0.02 0.42 -1.46 0.00 0.00 175.22 174.89 1um7 s ILE 46 N -2.21 0.57 0.31 3.12 -1.09 -1.26 -0.14 121.20 120.50 1um7 s ILE 46 Ca 0.14 -0.00 -0.29 0.00 -2.23 0.00 0.00 60.65 58.26 1um7 s ILE 46 Cb 0.05 -0.68 -0.13 0.00 -1.58 0.00 0.00 42.46 40.12 1um7 s ILE 46 CO -0.05 0.29 1.33 -0.11 -1.23 0.00 0.00 174.94 175.17 1um7 n LEU 47 N 5.04 3.39 -4.65 2.97 -0.00 0.22 -4.89 117.00 119.08 1um7 n LEU 47 Ca -0.09 1.19 -0.43 0.00 -0.00 0.00 0.00 56.01 56.67 1um7 n LEU 47 Cb 0.50 -1.47 -0.02 0.00 -0.00 0.00 0.00 43.42 42.43 1um7 n LEU 47 CO 0.13 -0.49 1.00 0.00 -0.00 0.00 0.00 177.39 178.02 1um7 s ALA 48 N -0.75 3.59 0.00 1.96 0.00 -1.26 -2.60 121.76 122.69 1um7 s ALA 48 Ca 0.59 0.17 0.00 0.00 0.00 0.00 0.00 51.96 52.73 1um7 s ALA 48 Cb -0.59 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 18.89 1um7 s ALA 48 CO 0.58 -1.30 0.00 0.41 0.00 0.00 0.00 175.76 175.45 1um7 n GLY 49 N 3.68 1.27 3.09 0.00 0.00 -1.26 -5.05 105.19 106.92 1um7 n GLY 49 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 -3.48 0.12 -0.02 0.00 -1.07 -4.54 105.19 94.20 1um7 n GLY 50 Ca 0.00 -1.37 -0.02 0.00 0.00 0.00 0.00 46.02 44.63 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 0.00 -0.07 1.61 0.13 -1.85 0.28 132.00 132.10 1um7 h PRO 51 Ca -0.38 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.61 1um7 h PRO 51 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1um7 h PRO 51 CO 0.23 0.70 -0.59 0.00 -0.23 0.00 0.00 178.00 178.12 1um7 h ALA 52 N 1.30 0.88 0.00 -0.56 0.00 -1.20 -1.10 119.26 118.58 1um7 h ALA 52 Ca -0.01 -0.53 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 1um7 h ALA 52 Cb 1.29 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 1um7 h ALA 52 CO 0.09 0.72 -0.26 0.22 0.00 0.00 0.00 179.25 180.03 1um7 h ASP 53 N 0.16 0.00 -0.66 0.00 3.58 -1.70 -3.18 116.42 114.62 1um7 h ASP 53 Ca -0.00 -0.13 0.13 0.00 0.42 0.00 0.00 57.03 57.44 1um7 h ASP 53 Cb 1.08 0.00 -0.13 0.00 1.72 0.00 0.00 39.33 42.01 1um7 h ASP 53 CO 0.09 0.70 -0.18 -0.07 -2.88 0.00 0.00 179.24 176.90 1um7 h LEU 54 N -1.00 -0.67 -0.79 2.28 3.38 -0.53 0.47 115.31 118.45 1um7 h LEU 54 Ca -0.02 0.20 0.18 0.00 0.09 0.00 0.00 57.88 58.33 1um7 h LEU 54 Cb 0.36 0.43 -0.11 0.00 0.09 0.00 0.00 40.66 41.42 1um7 h LEU 54 CO -0.01 -0.23 0.25 0.77 0.09 0.00 0.00 178.44 179.31 1um7 h SER 55 N -0.02 0.13 0.00 -0.43 4.64 -1.35 -3.45 113.55 113.07 1um7 h SER 55 Ca 0.32 0.15 0.00 0.00 -0.47 0.00 0.00 61.79 61.78 1um7 h SER 55 Cb 0.50 0.17 0.00 0.00 -0.31 0.00 0.00 62.40 62.76 1um7 h SER 55 CO -0.69 -0.02 0.00 0.61 -0.87 0.00 0.00 176.83 175.86 1um7 n GLY 56 N -1.35 3.02 0.11 -0.77 0.00 0.17 -4.85 105.19 101.52 1um7 n GLY 56 Ca 0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.07 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 1.92 -0.15 -6.18 1.61 4.39 -1.82 -3.43 114.58 110.92 1um7 h GLU 57 Ca 0.00 0.01 -0.57 0.00 0.34 0.00 0.00 59.36 59.14 1um7 h GLU 57 Cb 0.00 0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.64 1um7 h GLU 57 CO 0.00 0.34 0.71 -1.17 -1.16 0.00 0.00 179.01 177.72 1um7 s LEU 58 N -8.99 4.18 0.00 1.33 2.96 -1.20 -5.02 118.68 111.95 1um7 s LEU 58 Ca -0.14 1.51 -0.04 0.00 -0.22 0.00 0.00 54.13 55.24 1um7 s LEU 58 Cb 0.00 -3.55 -0.00 0.00 0.50 0.00 0.00 46.19 43.14 1um7 s LEU 58 CO 0.54 -0.58 0.08 -0.13 -1.32 0.00 0.00 176.35 174.93 1um7 s ARG 59 N 2.65 0.37 0.04 1.98 0.52 -1.26 -4.27 118.95 118.98 1um7 s ARG 59 Ca 0.48 -0.39 -0.35 0.00 -0.52 0.00 0.00 55.73 54.95 1um7 s ARG 59 Cb -0.18 0.15 -0.13 0.00 0.52 0.00 0.00 34.95 35.31 1um7 s ARG 59 CO 0.13 -0.08 1.68 -2.13 0.02 0.00 0.00 175.30 174.93 1um7 n ARG 60 N 1.74 2.03 0.00 3.54 0.63 -1.26 -1.98 116.66 121.35 1um7 n ARG 60 Ca -0.22 0.74 0.00 0.00 -0.92 0.00 0.00 57.85 57.45 1um7 n ARG 60 Cb 0.56 -2.52 0.00 0.00 0.45 0.00 0.00 32.46 30.95 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 3.76 1.58 3.62 5.14 0.00 -1.23 -4.91 105.19 113.14 1um7 n GLY 61 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 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 0.00 -0.17 -4.04 1.61 9.92 -0.84 -3.67 116.55 119.37 1um7 n ASP 62 Ca 0.00 0.34 -0.33 0.00 -0.53 0.00 0.00 54.79 54.27 1um7 n ASP 62 Cb 0.00 -1.42 -0.13 0.00 -0.64 0.00 0.00 41.12 38.93 1um7 n ASP 62 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1um7 s ARG 63 N -4.50 1.92 0.06 -1.24 3.52 -0.97 -1.20 118.95 116.54 1um7 s ARG 63 Ca 0.66 -2.17 -0.35 0.00 -0.13 0.00 0.00 55.73 53.73 1um7 s ARG 63 Cb -0.23 -3.42 -0.14 0.00 -1.56 0.00 0.00 34.95 29.60 1um7 s ARG 63 CO 0.60 -1.06 1.58 -0.89 -0.81 0.00 0.00 175.30 174.72 1um7 n ILE 64 N 3.90 0.13 -0.05 4.11 2.08 0.14 -2.30 119.36 127.38 1um7 n ILE 64 Ca 0.03 -0.02 -0.10 0.00 0.56 0.00 0.00 62.75 63.23 1um7 n ILE 64 Cb 0.39 -1.36 -0.04 0.00 -0.75 0.00 0.00 39.64 37.88 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 3.89 1.25 -3.79 1.39 4.77 0.18 -3.40 117.00 121.29 1um7 n LEU 65 Ca 0.19 0.08 -0.12 0.00 -0.03 0.00 0.00 56.01 56.13 1um7 n LEU 65 Cb 0.25 -0.30 -0.09 0.00 -2.33 0.00 0.00 43.42 40.95 1um7 n LEU 65 CO 0.66 0.32 -0.03 -0.94 -1.33 0.00 0.00 177.39 176.07 1um7 s SER 66 N -5.65 -0.12 -0.19 -1.43 1.04 -1.00 -1.51 113.70 104.84 1um7 s SER 66 Ca -0.14 -0.04 0.01 0.00 0.48 0.00 0.00 55.95 56.26 1um7 s SER 66 Cb 0.05 0.29 0.04 0.00 0.10 0.00 0.00 66.02 66.50 1um7 s SER 66 CO 0.18 -0.45 -0.09 -0.69 0.98 0.00 0.00 173.24 173.17 1um7 s VAL 67 N -1.52 1.56 -1.12 5.02 1.01 -1.00 -0.99 120.40 123.37 1um7 s VAL 67 Ca -0.13 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 60.85 1um7 s VAL 67 Cb -0.05 -1.66 0.00 0.00 0.00 0.00 0.00 36.38 34.67 1um7 s VAL 67 CO 0.03 0.16 0.96 -3.20 0.00 0.00 0.00 175.10 173.05 1um7 n ASN 68 N 4.71 -4.21 -3.04 3.32 2.85 0.53 -2.65 115.26 116.77 1um7 n ASN 68 Ca -0.14 -0.50 -0.16 0.00 -0.11 0.00 0.00 54.58 53.66 1um7 n ASN 68 Cb 0.47 -4.48 0.07 0.00 1.24 0.00 0.00 39.78 37.07 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 -1.52 -0.25 2.98 8.20 0.00 -1.25 -4.89 105.19 108.45 1um7 n GLY 69 Ca -0.10 0.04 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 1um7 n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1um7 s VAL 70 N -3.29 1.42 -0.16 1.61 1.01 -1.09 -5.09 120.40 114.82 1um7 s VAL 70 Ca 0.19 -0.63 -0.29 0.00 0.00 0.00 0.00 61.98 61.25 1um7 s VAL 70 Cb -0.08 -1.41 -0.05 0.00 0.00 0.00 0.00 36.38 34.84 1um7 s VAL 70 CO 0.61 0.35 1.82 0.21 0.00 0.00 0.00 175.10 178.09 1um7 s ASN 71 N 1.53 6.21 -0.02 3.32 3.84 -1.26 -2.37 114.94 126.20 1um7 s ASN 71 Ca 0.03 1.93 0.02 0.00 0.21 0.00 0.00 52.86 55.06 1um7 s ASN 71 Cb -0.14 -2.53 0.03 0.00 -0.55 0.00 0.00 41.25 38.07 1um7 s ASN 71 CO -0.09 -1.35 0.96 0.18 -2.79 0.00 0.00 177.10 174.00 1um7 n LEU 72 N 8.89 0.31 -0.01 3.21 4.77 -0.57 -4.91 117.00 128.69 1um7 n LEU 72 Ca 0.21 -1.14 -0.00 0.00 -0.03 0.00 0.00 56.01 55.05 1um7 n LEU 72 Cb 0.44 -0.05 -0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1um7 n LEU 72 CO 0.66 0.28 0.50 0.03 -1.33 0.00 0.00 177.39 177.52 1um7 h ARG 73 N 0.00 -0.00 -2.00 3.23 3.08 -1.66 -1.59 114.38 115.43 1um7 h ARG 73 Ca 0.00 0.00 -0.74 0.00 0.07 0.00 0.00 59.98 59.31 1um7 h ARG 73 Cb 1.29 0.00 -0.30 0.00 0.08 0.00 0.00 29.97 31.04 1um7 h ARG 73 CO 0.00 -0.00 0.71 0.09 -1.07 0.00 0.00 179.97 179.70 1um7 n ASN 74 N -3.02 6.93 -4.79 7.04 4.13 -1.26 -3.91 115.26 120.37 1um7 n ASN 74 Ca 0.00 -3.78 -0.32 0.00 1.68 0.00 0.00 54.58 52.16 1um7 n ASN 74 Cb 0.01 -0.98 -0.07 0.00 -1.54 0.00 0.00 39.78 37.21 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 -4.03 3.61 0.87 5.41 0.00 -0.60 -4.74 121.76 122.29 1um7 s ALA 75 Ca 0.48 -0.93 -0.10 0.00 0.00 0.00 0.00 51.96 51.41 1um7 s ALA 75 Cb 0.37 -1.54 0.12 0.00 0.00 0.00 0.00 23.12 22.07 1um7 s ALA 75 CO -0.31 0.73 1.12 0.95 0.00 0.00 0.00 175.76 178.25 1um7 s THR 76 N -1.30 2.57 0.37 0.00 -4.23 -1.26 -4.24 115.64 107.56 1um7 s THR 76 Ca 0.26 0.19 0.15 0.00 -1.18 0.00 0.00 61.69 61.11 1um7 s THR 76 Cb -0.12 -2.42 0.36 0.00 1.34 0.00 0.00 72.50 71.66 1um7 s THR 76 CO 0.18 -0.24 1.77 -0.74 -0.54 0.00 0.00 174.62 175.05 1um7 h HIS 77 N -1.62 0.78 0.16 3.99 2.76 -1.79 0.10 115.15 119.53 1um7 h HIS 77 Ca -0.45 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 57.74 1um7 h HIS 77 Cb 1.26 -0.23 0.00 0.00 1.55 0.00 0.00 27.41 29.99 1um7 h HIS 77 CO 0.51 0.10 -0.08 1.49 -1.30 0.00 0.00 177.93 178.65 1um7 h GLU 78 N 0.49 -0.20 -1.06 5.26 4.81 -1.92 -2.11 114.58 119.85 1um7 h GLU 78 Ca 0.59 0.01 0.28 0.00 -0.13 0.00 0.00 59.36 60.11 1um7 h GLU 78 Cb 1.33 0.05 -0.09 0.00 0.63 0.00 0.00 28.75 30.67 1um7 h GLU 78 CO -0.33 0.23 0.68 1.96 -0.73 0.00 0.00 179.01 180.83 1um7 h GLN 79 N -0.79 0.35 0.00 1.92 4.20 -1.45 1.83 115.11 121.17 1um7 h GLN 79 Ca -0.02 -0.02 -0.14 0.00 0.06 0.00 0.00 58.65 58.53 1um7 h GLN 79 Cb 0.53 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 28.21 1um7 h GLN 79 CO 0.04 0.23 -0.67 0.00 -0.67 0.00 0.00 178.83 177.75 1um7 h ALA 80 N 1.61 0.80 0.12 3.87 0.00 -0.83 -3.09 119.26 121.74 1um7 h ALA 80 Ca 0.60 -0.61 -0.27 0.00 0.00 0.00 0.00 54.91 54.62 1um7 h ALA 80 Cb 1.59 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 19.27 1um7 h ALA 80 CO -0.29 0.84 -1.26 0.00 0.00 0.00 0.00 179.25 178.55 1um7 h ALA 81 N 1.33 0.14 -0.05 0.00 0.00 0.28 -3.15 119.26 117.81 1um7 h ALA 81 Ca -0.01 -0.92 0.01 0.00 0.00 0.00 0.00 54.91 54.00 1um7 h ALA 81 Cb 1.26 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 19.08 1um7 h ALA 81 CO 0.09 1.02 0.33 0.00 0.00 0.00 0.00 179.25 180.69 1um7 h ALA 82 N 0.61 1.42 0.04 0.00 0.00 0.21 0.19 119.26 121.72 1um7 h ALA 82 Ca -0.14 -0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 1um7 h ALA 82 Cb 1.96 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.75 1um7 h ALA 82 CO 0.19 -0.35 -0.57 0.00 0.00 0.00 0.00 179.25 178.51 1um7 h ALA 83 N 1.39 0.06 0.00 0.00 0.00 -1.59 -3.03 119.26 116.09 1um7 h ALA 83 Ca 0.02 -0.75 0.00 0.00 0.00 0.00 0.00 54.91 54.18 1um7 h ALA 83 Cb 0.68 0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1um7 h ALA 83 CO -0.00 0.31 0.10 -0.07 0.00 0.00 0.00 179.25 179.60 1um7 h LEU 84 N -0.81 0.00 0.11 0.00 -0.00 -0.74 1.40 115.31 115.27 1um7 h LEU 84 Ca -0.13 0.00 -0.19 0.00 -0.00 0.00 0.00 57.88 57.55 1um7 h LEU 84 Cb 1.26 0.00 0.01 0.00 -0.00 0.00 0.00 40.66 41.93 1um7 h LEU 84 CO -0.01 0.00 -0.91 0.11 -0.00 0.00 0.00 178.44 177.63 1um7 h LYS 85 N 0.00 0.23 -0.00 1.13 6.56 -1.25 -3.29 116.57 119.95 1um7 h LYS 85 Ca 0.00 -0.40 0.00 0.00 -1.06 0.00 0.00 60.65 59.19 1um7 h LYS 85 Cb 0.21 0.15 0.00 0.00 -0.57 0.00 0.00 32.23 32.02 1um7 h LYS 85 CO 0.00 1.19 -0.18 2.89 -2.06 0.00 0.00 179.45 181.29 1um7 n ARG 86 N -4.14 0.37 -1.98 3.15 1.85 0.19 -4.80 116.66 111.30 1um7 n ARG 86 Ca -0.17 -0.14 -0.43 0.00 -1.00 0.00 0.00 57.85 56.11 1um7 n ARG 86 Cb 0.80 -1.50 -0.03 0.00 -1.05 0.00 0.00 32.46 30.68 1um7 n ARG 86 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1um7 s ALA 87 N -2.72 2.98 1.00 2.89 0.00 0.46 -4.97 121.76 121.39 1um7 s ALA 87 Ca 0.21 0.39 0.00 0.00 0.00 0.00 0.00 51.96 52.56 1um7 s ALA 87 Cb 0.19 -3.97 0.00 0.00 0.00 0.00 0.00 23.12 19.34 1um7 s ALA 87 CO 0.54 -2.44 0.00 0.41 0.00 0.00 0.00 175.76 174.27 1um7 n GLY 88 N 5.25 -1.76 0.20 0.00 0.00 -1.26 -4.93 105.19 102.69 1um7 n GLY 88 Ca 0.22 -1.48 -0.10 0.00 0.00 0.00 0.00 46.02 44.66 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 -0.22 -4.63 1.61 4.20 -1.92 -3.34 115.11 110.81 1um7 h GLN 89 Ca 0.00 0.01 -0.71 0.00 0.06 0.00 0.00 58.65 58.01 1um7 h GLN 89 Cb 0.00 0.05 -0.20 0.00 0.30 0.00 0.00 27.48 27.63 1um7 h GLN 89 CO 0.00 -0.15 0.19 -1.54 -0.67 0.00 0.00 178.83 176.66 1um7 s SER 90 N -5.02 6.29 -0.14 1.46 1.04 -1.26 -1.63 113.70 114.44 1um7 s SER 90 Ca -0.14 -1.63 -0.05 0.00 0.48 0.00 0.00 55.95 54.61 1um7 s SER 90 Cb 0.09 -2.30 -0.04 0.00 0.10 0.00 0.00 66.02 63.87 1um7 s SER 90 CO 0.67 -1.06 0.03 -0.69 0.98 0.00 0.00 173.24 173.18 1um7 s VAL 91 N 2.43 4.56 -0.50 5.02 1.01 -1.06 -5.00 120.40 126.86 1um7 s VAL 91 Ca 0.14 -0.13 -0.14 0.00 0.00 0.00 0.00 61.98 61.85 1um7 s VAL 91 Cb -0.21 -2.99 0.11 0.00 0.00 0.00 0.00 36.38 33.29 1um7 s VAL 91 CO 0.03 0.53 0.42 -0.89 0.00 0.00 0.00 175.10 175.20 1um7 s THR 92 N -0.21 4.97 -0.31 3.92 2.01 -1.26 -1.71 115.64 123.05 1um7 s THR 92 Ca 0.07 -1.41 -0.16 0.00 0.31 0.00 0.00 61.69 60.49 1um7 s THR 92 Cb -0.12 -4.12 -0.02 0.00 0.01 0.00 0.00 72.50 68.25 1um7 s THR 92 CO 0.02 -0.74 0.43 -0.63 -0.69 0.00 0.00 174.62 173.01 1um7 s ILE 93 N 1.56 5.12 -0.41 1.82 1.09 0.18 0.20 121.20 130.75 1um7 s ILE 93 Ca 0.04 0.43 -0.05 0.00 -1.10 0.00 0.00 60.65 59.96 1um7 s ILE 93 Cb -0.27 -3.81 0.10 0.00 -1.06 0.00 0.00 42.46 37.41 1um7 s ILE 93 CO 0.03 -0.01 0.22 -0.69 -0.10 0.00 0.00 174.94 174.39 1um7 s VAL 94 N 2.18 3.60 0.13 2.92 1.01 -0.16 0.91 120.40 131.00 1um7 s VAL 94 Ca 0.16 -1.81 0.05 0.00 0.00 0.00 0.00 61.98 60.39 1um7 s VAL 94 Cb -0.16 -3.35 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 1um7 s VAL 94 CO 0.11 -0.61 -0.13 0.00 0.00 0.00 0.00 175.10 174.48 1um7 s ALA 95 N 1.25 1.49 -0.39 5.51 0.00 -1.19 -0.64 121.76 127.79 1um7 s ALA 95 Ca 0.05 -1.37 -0.11 0.00 0.00 0.00 0.00 51.96 50.53 1um7 s ALA 95 Cb -0.23 -0.03 0.04 0.00 0.00 0.00 0.00 23.12 22.90 1um7 s ALA 95 CO -0.02 0.03 0.23 -0.65 0.00 0.00 0.00 175.76 175.34 1um7 s GLN 96 N -3.08 2.77 -0.85 0.00 -0.21 -0.97 -2.19 119.66 115.14 1um7 s GLN 96 Ca 0.12 -1.19 -0.21 0.00 0.02 0.00 0.00 55.36 54.10 1um7 s GLN 96 Cb -0.02 -3.76 -0.20 0.00 1.00 0.00 0.00 33.01 30.02 1um7 s GLN 96 CO 0.02 -0.78 2.34 0.98 -2.12 0.00 0.00 175.29 175.74 1um7 n TYR 97 N 4.99 0.77 -3.65 0.91 4.19 -1.26 -2.30 117.16 120.81 1um7 n TYR 97 Ca -0.11 0.01 -0.29 0.00 3.31 0.00 0.00 57.90 60.82 1um7 n TYR 97 Cb 0.45 -1.91 -0.13 0.00 0.49 0.00 0.00 39.34 38.24 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 8.25 1.14 0.38 2.98 1.81 -1.24 -4.84 118.95 127.43 1um7 s ARG 98 Ca 1.08 -1.89 0.27 0.00 -1.72 0.00 0.00 55.73 53.47 1um7 s ARG 98 Cb -0.42 -2.12 0.88 0.00 -0.45 0.00 0.00 34.95 32.84 1um7 s ARG 98 CO 0.27 -1.18 1.78 -1.00 -0.68 0.00 0.00 175.30 174.49 1um7 h PRO 99 N 6.73 0.00 -0.39 3.54 0.13 -1.88 -3.03 132.00 137.11 1um7 h PRO 99 Ca 0.02 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.03 1um7 h PRO 99 Cb 0.93 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.05 1um7 h PRO 99 CO 0.44 0.00 -0.21 0.93 -0.23 0.00 0.00 178.00 178.93 1um7 h GLU 100 N 0.00 0.75 0.25 0.86 5.08 -1.92 -2.93 114.58 116.68 1um7 h GLU 100 Ca 0.00 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.05 1um7 h GLU 100 Cb 0.67 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.88 1um7 h GLU 100 CO 0.00 0.90 -0.12 0.93 -1.00 0.00 0.00 179.01 179.72 1um7 h GLU 101 N 0.66 -0.32 -1.51 2.33 4.39 -1.86 -3.22 114.58 115.04 1um7 h GLU 101 Ca 0.09 0.02 0.44 0.00 0.34 0.00 0.00 59.36 60.26 1um7 h GLU 101 Cb 0.71 0.07 -0.06 0.00 -0.10 0.00 0.00 28.75 29.37 1um7 h GLU 101 CO 0.05 -0.22 1.30 0.98 -1.16 0.00 0.00 179.01 179.97 1um7 n TYR 102 N -4.64 0.00 -0.31 4.33 9.36 -1.17 -0.28 117.16 124.45 1um7 n TYR 102 Ca -0.04 0.00 0.19 0.00 3.32 0.00 0.00 57.90 61.37 1um7 n TYR 102 Cb 0.13 -0.38 0.37 0.00 -0.63 0.00 0.00 39.34 38.83 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 -3.55 0.05 -0.04 2.98 2.88 -1.11 0.13 113.62 114.96 1um7 n SER 103 Ca 0.34 1.53 -0.09 0.00 -1.33 0.00 0.00 58.87 59.32 1um7 n SER 103 Cb 1.75 -0.63 -0.02 0.00 -0.75 0.00 0.00 64.21 64.56 1um7 n SER 103 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1um7 h ARG 104 N 0.00 -0.28 -0.39 -1.46 3.08 -0.88 -0.30 114.38 114.15 1um7 h ARG 104 Ca 0.63 0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.63 1um7 h ARG 104 Cb 1.48 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 31.58 1um7 h ARG 104 CO -0.80 -0.19 -0.08 0.74 -1.07 0.00 0.00 179.97 178.57 1um7 h PHE 105 N -0.29 0.71 0.02 3.04 0.04 0.84 -2.54 116.94 118.76 1um7 h PHE 105 Ca 0.13 -0.11 0.03 0.00 2.80 0.00 0.00 57.97 60.82 1um7 h PHE 105 Cb 0.50 -0.19 -0.05 0.00 2.20 0.00 0.00 35.95 38.41 1um7 h PHE 105 CO -0.42 0.73 -0.30 0.93 -0.60 0.00 0.00 178.31 178.65 1um7 h GLU 106 N 0.61 -0.44 0.63 1.51 4.39 0.67 -2.45 114.58 119.50 1um7 h GLU 106 Ca 0.11 0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.82 1um7 h GLU 106 Cb 0.51 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.25 1um7 h GLU 106 CO 0.03 -0.29 -0.38 1.03 -1.16 0.00 0.00 179.01 178.24 1um7 h SER 107 N -0.46 -0.95 -3.23 1.42 0.87 -1.02 -3.42 113.55 106.77 1um7 h SER 107 Ca 0.06 0.05 -0.43 0.00 -1.23 0.00 0.00 61.79 60.24 1um7 h SER 107 Cb 0.53 0.27 -0.39 0.00 -0.44 0.00 0.00 62.40 62.37 1um7 h SER 107 CO -0.24 -0.58 -0.75 -0.44 -0.53 0.00 0.00 176.83 174.28 1um7 s SER 108 N -3.63 1.75 0.00 6.23 0.01 -0.97 -4.99 113.70 112.10 1um7 s SER 108 Ca -0.15 -0.23 0.00 0.00 1.31 0.00 0.00 55.95 56.88 1um7 s SER 108 Cb 0.02 -0.30 0.00 0.00 0.21 0.00 0.00 66.02 65.95 1um7 s SER 108 CO 0.45 -0.26 0.00 0.61 0.41 0.00 0.00 173.24 174.45 1um7 n GLY 109 N 5.22 4.87 2.95 3.44 0.00 -0.94 -4.20 105.19 116.54 1um7 n GLY 109 Ca -0.06 -1.13 -0.43 0.00 0.00 0.00 0.00 46.02 44.41 1um7 n GLY 109 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1um7 n PRO 110 N 0.00 2.15 0.11 1.61 -0.04 -1.26 -3.33 135.00 134.23 1um7 n PRO 110 Ca 0.00 -2.22 0.00 0.00 -0.04 0.00 0.00 63.50 61.24 1um7 n PRO 110 Cb 0.00 -3.11 0.00 0.00 -0.04 0.00 0.00 33.50 30.35 1um7 n PRO 110 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1um7 n SER 111 N 6.98 -1.98 -1.30 3.54 7.64 -1.26 -5.17 113.62 122.07 1um7 n SER 111 Ca 0.51 0.46 0.03 0.00 1.01 0.00 0.00 58.87 60.88 1um7 n SER 111 Cb 0.40 2.07 -0.02 0.00 -1.01 0.00 0.00 64.21 65.65 1um7 n SER 111 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1um7 n SER 112 N -2.94 -7.03 0.00 6.43 7.64 -1.21 -5.24 113.62 111.27 1um7 n SER 112 Ca 0.00 1.52 0.00 0.00 1.01 0.00 0.00 58.87 61.40 1um7 n SER 112 Cb 0.00 -4.13 0.00 0.00 -1.01 0.00 0.00 64.21 59.07 1um7 n SER 112 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64