#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 -0.20 -0.29 1.61 0.01 -1.26 -5.17 113.70 108.40 1um7 s SER 2 Ca 0.00 -0.34 -0.15 0.00 1.31 0.00 0.00 55.95 56.77 1um7 s SER 2 Cb 0.00 0.47 0.11 0.00 0.21 0.00 0.00 66.02 66.80 1um7 s SER 2 CO 0.00 -0.85 0.75 -0.55 0.41 0.00 0.00 173.24 173.00 1um7 s SER 3 N -2.88 -0.88 0.49 2.44 0.15 -1.26 -5.18 113.70 106.59 1um7 s SER 3 Ca 0.11 1.35 0.05 0.00 0.70 0.00 0.00 55.95 58.16 1um7 s SER 3 Cb -0.01 1.55 -0.01 0.00 -1.71 0.00 0.00 66.02 65.84 1um7 s SER 3 CO 0.00 -0.21 0.19 -0.83 1.20 0.00 0.00 173.24 173.60 1um7 s GLY 4 N 1.87 2.58 0.00 9.45 0.00 -1.26 -5.15 107.32 114.81 1um7 s GLY 4 Ca -0.09 -1.27 0.00 0.00 0.00 0.00 0.00 44.72 43.37 1um7 s GLY 4 CO -0.19 -2.02 0.00 -1.26 0.00 0.00 0.00 173.10 169.63 1um7 n SER 5 N -1.42 0.00 0.00 1.64 2.88 -1.26 -5.19 113.62 110.27 1um7 n SER 5 Ca -0.07 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.47 1um7 n SER 5 Cb 0.65 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 1um7 n SER 5 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1um7 n SER 6 N 0.00 0.00 0.00 -3.46 3.41 -1.26 -5.19 113.62 107.12 1um7 n SER 6 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1um7 n SER 6 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1um7 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1um7 n GLY 7 N -0.01 3.47 3.01 5.00 0.00 -1.26 -5.12 105.19 110.28 1um7 n GLY 7 Ca 0.00 -1.74 -0.22 0.00 0.00 0.00 0.00 46.02 44.06 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 -2.36 1.14 -0.97 1.61 0.52 -1.26 -5.03 118.95 112.60 1um7 s ARG 8 Ca 0.00 -0.34 -0.07 0.00 -0.52 0.00 0.00 55.73 54.81 1um7 s ARG 8 Cb 0.00 -1.04 -0.10 0.00 0.52 0.00 0.00 34.95 34.34 1um7 s ARG 8 CO 0.00 0.10 2.56 -0.35 0.02 0.00 0.00 175.30 177.63 1um7 n PRO 9 N 3.42 2.52 0.00 3.54 -0.04 -1.26 -4.90 135.00 138.28 1um7 n PRO 9 Ca -0.20 -1.57 0.00 0.00 -0.04 0.00 0.00 63.50 61.70 1um7 n PRO 9 Cb 0.53 -2.45 0.00 0.00 -0.04 0.00 0.00 33.50 31.54 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 3.47 1.87 1.97 0.55 0.00 -1.26 -4.46 105.19 107.33 1um7 n GLY 10 Ca 0.54 0.47 -0.11 0.00 0.00 0.00 0.00 46.02 46.91 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 0.00 -2.16 2.70 -0.02 0.00 -1.26 -4.98 105.19 99.47 1um7 n GLY 11 Ca 0.00 -0.70 -0.00 0.00 0.00 0.00 0.00 46.02 45.31 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 -1.83 0.75 -2.66 1.61 8.00 -1.26 -4.93 116.55 116.21 1um7 n ASP 12 Ca 0.05 -2.07 -0.04 0.00 0.71 0.00 0.00 54.79 53.44 1um7 n ASP 12 Cb 0.22 -0.17 0.09 0.00 -0.02 0.00 0.00 41.12 41.24 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 -0.77 -3.49 0.00 2.24 0.00 -1.26 -5.03 120.51 112.21 1um7 n ALA 13 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1um7 n ALA 13 Cb 0.84 -3.22 0.00 0.00 0.00 0.00 0.00 19.45 17.06 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 1.27 0.00 -1.01 0.00 3.00 -1.26 -4.77 116.66 113.89 1um7 n ARG 14 Ca -0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 57.85 57.54 1um7 n ARG 14 Cb 0.72 -0.28 0.22 0.00 0.00 0.00 0.00 32.46 33.11 1um7 n ARG 14 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 1um7 s GLU 15 N -1.65 -0.54 0.28 5.56 2.02 -1.26 -4.40 118.70 118.70 1um7 s GLU 15 Ca 0.00 0.33 -0.29 0.00 0.02 0.00 0.00 54.97 55.03 1um7 s GLU 15 Cb 0.00 -1.64 -0.09 0.00 0.10 0.00 0.00 34.13 32.49 1um7 s GLU 15 CO 0.00 -3.34 1.08 -1.25 0.02 0.00 0.00 175.26 171.77 1um7 s PRO 16 N -5.04 4.64 -0.04 0.39 0.04 -1.26 -4.34 135.00 129.38 1um7 s PRO 16 Ca 0.68 1.75 0.06 0.00 0.04 0.00 0.00 61.00 63.53 1um7 s PRO 16 Cb -0.16 -3.16 -0.01 0.00 0.04 0.00 0.00 34.50 31.20 1um7 s PRO 16 CO 0.58 0.23 -0.22 -0.98 0.04 0.00 0.00 177.00 176.65 1um7 s ARG 17 N -1.48 2.12 -0.33 4.56 1.70 0.42 -4.94 118.95 121.00 1um7 s ARG 17 Ca 0.45 -0.78 -0.29 0.00 -0.47 0.00 0.00 55.73 54.64 1um7 s ARG 17 Cb -0.31 -1.86 -0.00 0.00 -0.57 0.00 0.00 34.95 32.21 1um7 s ARG 17 CO 0.39 0.35 1.45 0.21 -1.08 0.00 0.00 175.30 176.62 1um7 s LYS 18 N -0.16 3.70 -0.28 3.89 2.20 -1.26 -2.50 119.74 125.33 1um7 s LYS 18 Ca -0.01 1.21 -0.02 0.00 -0.36 0.00 0.00 55.97 56.79 1um7 s LYS 18 Cb -0.12 -3.99 0.04 0.00 -1.51 0.00 0.00 37.83 32.24 1um7 s LYS 18 CO 0.02 -1.40 -0.02 0.42 -0.36 0.00 0.00 175.35 174.01 1um7 s ILE 19 N 5.17 2.98 -0.52 5.43 1.01 0.40 -4.98 121.20 130.68 1um7 s ILE 19 Ca 0.63 -1.20 -0.17 0.00 0.00 0.00 0.00 60.65 59.92 1um7 s ILE 19 Cb -0.17 -2.62 0.09 0.00 0.01 0.00 0.00 42.46 39.77 1um7 s ILE 19 CO 0.29 0.04 0.52 -0.63 0.00 0.00 0.00 174.94 175.15 1um7 s ILE 20 N 1.29 5.10 -0.06 2.92 1.01 -1.26 0.11 121.20 130.31 1um7 s ILE 20 Ca -0.03 -1.11 -0.14 0.00 0.00 0.00 0.00 60.65 59.38 1um7 s ILE 20 Cb -0.18 -4.28 -0.05 0.00 0.01 0.00 0.00 42.46 37.95 1um7 s ILE 20 CO -0.02 -0.80 0.36 -0.76 0.00 0.00 0.00 174.94 173.71 1um7 s LEU 21 N 1.96 4.40 -0.52 2.97 2.01 -0.63 -4.93 118.68 123.93 1um7 s LEU 21 Ca 0.07 0.79 -0.13 0.00 0.01 0.00 0.00 54.13 54.87 1um7 s LEU 21 Cb -0.25 -2.49 0.13 0.00 0.01 0.00 0.00 46.19 43.59 1um7 s LEU 21 CO 0.06 0.26 0.44 -1.00 1.01 0.00 0.00 176.35 177.12 1um7 s HIS 22 N -0.58 3.36 -0.46 0.29 3.76 -1.26 -2.52 115.29 117.88 1um7 s HIS 22 Ca 0.21 -1.61 -0.43 0.00 -0.15 0.00 0.00 55.06 53.08 1um7 s HIS 22 Cb -0.15 -3.66 -0.18 0.00 1.11 0.00 0.00 32.58 29.70 1um7 s HIS 22 CO 0.10 -1.00 2.03 1.63 -0.85 0.00 0.00 174.74 176.64 1um7 n LYS 23 N 5.01 0.24 0.03 1.40 5.02 -0.59 -4.60 118.16 124.67 1um7 n LYS 23 Ca -0.10 0.07 -0.22 0.00 -2.02 0.00 0.00 58.31 56.05 1um7 n LYS 23 Cb 0.41 -1.68 -0.14 0.00 -0.02 0.00 0.00 35.03 33.59 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 8.68 0.33 0.00 0.72 0.00 -1.86 -3.47 103.07 107.46 1um7 h GLY 24 Ca -0.21 -0.85 0.00 0.00 0.00 0.00 0.00 47.33 46.27 1um7 h GLY 24 CO 1.05 0.74 0.00 1.44 0.00 0.00 0.00 176.54 179.78 1um7 n SER 25 N -3.87 0.00 -0.42 0.19 7.64 -1.26 -4.94 113.62 110.96 1um7 n SER 25 Ca -0.24 0.00 0.38 0.00 1.01 0.00 0.00 58.87 60.03 1um7 n SER 25 Cb 0.94 0.00 0.74 0.00 -1.01 0.00 0.00 64.21 64.87 1um7 n SER 25 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1um7 h THR 26 N 0.00 0.30 0.00 0.44 1.35 -2.01 -3.46 112.91 109.53 1um7 h THR 26 Ca 0.00 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 1um7 h THR 26 Cb 0.00 0.25 0.00 0.00 -1.73 0.00 0.00 68.15 66.67 1um7 h THR 26 CO 0.00 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 175.89 1um7 n GLY 27 N -1.76 -0.52 0.07 5.82 0.00 -1.26 -4.91 105.19 102.64 1um7 n GLY 27 Ca 0.31 -0.43 0.11 0.00 0.00 0.00 0.00 46.02 46.02 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 0.84 0.00 0.99 4.77 -1.26 -2.66 117.00 119.68 1um7 n LEU 28 Ca 0.00 -0.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1um7 n LEU 28 Cb 0.00 -0.14 0.00 0.00 -2.33 0.00 0.00 43.42 40.95 1um7 n LEU 28 CO 0.00 0.19 0.00 0.61 -1.33 0.00 0.00 177.39 176.86 1um7 n GLY 29 N 1.47 0.87 3.61 -0.72 0.00 -1.26 -1.65 105.19 107.51 1um7 n GLY 29 Ca 0.06 -0.61 -0.11 0.00 0.00 0.00 0.00 46.02 45.36 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 -2.00 -0.47 0.63 1.61 -0.12 -1.26 0.74 117.98 117.11 1um7 s PHE 30 Ca 0.00 1.01 0.04 0.00 -0.05 0.00 0.00 56.93 57.92 1um7 s PHE 30 Cb 0.00 0.39 0.09 0.00 -0.63 0.00 0.00 43.02 42.87 1um7 s PHE 30 CO 0.00 -0.31 0.86 1.21 -0.05 0.00 0.00 175.22 176.94 1um7 s ASN 31 N -0.36 4.82 0.06 1.98 3.84 0.11 -4.94 114.94 120.45 1um7 s ASN 31 Ca 0.00 -0.48 0.01 0.00 0.21 0.00 0.00 52.86 52.61 1um7 s ASN 31 Cb -0.03 -0.09 -0.03 0.00 -0.55 0.00 0.00 41.25 40.55 1um7 s ASN 31 CO -0.02 -1.51 -0.06 0.27 -2.79 0.00 0.00 177.10 173.00 1um7 s ILE 32 N -2.87 0.46 0.21 -5.21 -4.36 -1.26 -2.46 121.20 105.71 1um7 s ILE 32 Ca 0.63 -1.48 -0.04 0.00 -0.26 0.00 0.00 60.65 59.50 1um7 s ILE 32 Cb -0.06 -1.09 -0.03 0.00 1.25 0.00 0.00 42.46 42.52 1um7 s ILE 32 CO 0.41 -0.69 0.21 0.68 0.24 0.00 0.00 174.94 175.80 1um7 s VAL 33 N -2.64 0.01 0.00 8.37 -7.23 0.51 -4.54 120.40 114.87 1um7 s VAL 33 Ca -0.00 -1.84 0.00 0.00 -1.81 0.00 0.00 61.98 58.33 1um7 s VAL 33 Cb -0.01 -2.40 0.00 0.00 0.56 0.00 0.00 36.38 34.53 1um7 s VAL 33 CO -0.04 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.34 1um7 n GLY 34 N -0.29 0.09 0.00 2.32 0.00 -1.26 -0.67 105.19 105.37 1um7 n GLY 34 Ca 0.01 -1.94 0.00 0.00 0.00 0.00 0.00 46.02 44.09 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 1.50 3.09 -0.02 0.00 -1.11 -2.52 105.19 106.13 1um7 n GLY 35 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 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 -0.13 2.27 -1.73 1.61 2.02 -1.26 -4.04 118.70 117.44 1um7 s GLU 36 Ca 0.00 -1.34 0.00 0.00 0.02 0.00 0.00 54.97 53.65 1um7 s GLU 36 Cb 0.00 -2.95 0.00 0.00 0.10 0.00 0.00 34.13 31.28 1um7 s GLU 36 CO 0.00 -0.58 0.00 -3.47 0.02 0.00 0.00 175.26 171.23 1um7 n ASP 37 N 4.46 -5.40 -2.64 -0.19 2.03 -1.26 -2.78 116.55 110.77 1um7 n ASP 37 Ca -0.14 0.40 -0.03 0.00 0.52 0.00 0.00 54.79 55.54 1um7 n ASP 37 Cb 0.42 -4.33 0.02 0.00 -0.72 0.00 0.00 41.12 36.50 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 -0.39 -0.83 0.03 0.27 0.00 -1.26 -4.97 105.19 98.04 1um7 n GLY 38 Ca -0.16 0.29 0.05 0.00 0.00 0.00 0.00 46.02 46.20 1um7 n GLY 38 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1um7 n GLU 39 N -1.92 0.69 0.00 1.61 0.28 -1.12 -4.83 120.64 115.35 1um7 n GLU 39 Ca -0.02 -0.14 0.00 0.00 -0.16 0.00 0.00 57.16 56.85 1um7 n GLU 39 Cb 0.53 -1.49 0.00 0.00 1.43 0.00 0.00 31.44 31.90 1um7 n GLU 39 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1um7 n GLY 40 N 1.46 2.55 3.41 -1.84 0.00 -1.24 -5.01 105.19 104.53 1um7 n GLY 40 Ca -0.12 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.61 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 2.44 -0.14 -0.61 -1.09 -1.25 -2.76 121.20 115.94 1um7 s ILE 41 Ca 0.00 -1.55 -0.16 0.00 -2.23 0.00 0.00 60.65 56.71 1um7 s ILE 41 Cb 0.00 -2.06 0.04 0.00 -1.58 0.00 0.00 42.46 38.86 1um7 s ILE 41 CO 0.00 0.18 0.43 -0.36 -1.23 0.00 0.00 174.94 173.96 1um7 s PHE 42 N -1.01 -0.45 0.43 3.97 0.40 0.15 -0.94 117.98 120.54 1um7 s PHE 42 Ca 0.15 1.05 -0.26 0.00 -0.60 0.00 0.00 56.93 57.27 1um7 s PHE 42 Cb -0.10 0.17 -0.09 0.00 0.51 0.00 0.00 43.02 43.50 1um7 s PHE 42 CO 0.06 -0.27 1.46 0.28 0.70 0.00 0.00 175.22 177.45 1um7 n VAL 43 N 2.56 2.57 -0.10 -0.44 0.31 0.68 0.19 118.33 124.10 1um7 n VAL 43 Ca -0.15 -0.50 -0.11 0.00 -0.01 0.00 0.00 64.34 63.57 1um7 n VAL 43 Cb 0.57 -1.89 -0.14 0.00 -0.91 0.00 0.00 33.84 31.46 1um7 n VAL 43 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1um7 n SER 44 N -0.01 0.76 -3.69 4.52 3.41 -1.03 -3.58 113.62 113.99 1um7 n SER 44 Ca 0.04 -0.03 -0.06 0.00 -0.26 0.00 0.00 58.87 58.55 1um7 n SER 44 Cb 0.41 0.63 -0.02 0.00 -0.26 0.00 0.00 64.21 64.97 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 -2.47 -0.24 -0.06 7.33 5.36 -1.26 -4.84 117.98 121.79 1um7 s PHE 45 Ca -0.15 -0.06 -0.00 0.00 -0.96 0.00 0.00 56.93 55.75 1um7 s PHE 45 Cb 0.06 0.63 0.02 0.00 -0.34 0.00 0.00 43.02 43.40 1um7 s PHE 45 CO 0.73 -0.88 -0.03 0.42 -1.46 0.00 0.00 175.22 173.99 1um7 s ILE 46 N -3.48 0.52 0.63 3.12 -1.09 -1.26 0.07 121.20 119.71 1um7 s ILE 46 Ca 0.09 -0.04 -0.17 0.00 -2.23 0.00 0.00 60.65 58.30 1um7 s ILE 46 Cb -0.02 -0.60 -0.02 0.00 -1.58 0.00 0.00 42.46 40.24 1um7 s ILE 46 CO -0.01 0.26 1.16 -0.22 -1.23 0.00 0.00 174.94 174.90 1um7 s LEU 47 N 1.44 3.54 -0.41 2.97 2.96 0.23 -4.92 118.68 124.48 1um7 s LEU 47 Ca -0.03 2.23 -0.18 0.00 -0.22 0.00 0.00 54.13 55.93 1um7 s LEU 47 Cb -0.13 -4.58 0.02 0.00 0.50 0.00 0.00 46.19 41.99 1um7 s LEU 47 CO -0.03 -1.66 0.50 0.00 -1.32 0.00 0.00 176.35 173.84 1um7 s ALA 48 N -1.92 3.42 0.00 5.97 0.00 -1.26 -3.77 121.76 124.20 1um7 s ALA 48 Ca 0.73 -1.33 0.00 0.00 0.00 0.00 0.00 51.96 51.36 1um7 s ALA 48 Cb -0.26 -3.10 0.00 0.00 0.00 0.00 0.00 23.12 19.76 1um7 s ALA 48 CO 0.36 -1.55 0.00 0.41 0.00 0.00 0.00 175.76 174.99 1um7 n GLY 49 N 5.03 1.27 2.70 0.00 0.00 -1.26 -5.06 105.19 107.86 1um7 n GLY 49 Ca -0.05 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 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 -1.28 -2.82 0.13 -0.02 0.00 -1.25 -4.59 105.19 95.37 1um7 n GLY 50 Ca 0.00 -1.46 -0.00 0.00 0.00 0.00 0.00 46.02 44.55 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 -0.27 1.61 0.13 -1.81 0.34 132.00 132.00 1um7 h PRO 51 Ca -0.32 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.63 1um7 h PRO 51 Cb 0.98 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.11 1um7 h PRO 51 CO 0.21 0.63 -0.52 0.00 -0.23 0.00 0.00 178.00 178.09 1um7 h ALA 52 N 1.37 0.43 0.06 -0.56 0.00 -1.52 -0.54 119.26 118.50 1um7 h ALA 52 Ca -0.01 -0.51 -0.00 0.00 0.00 0.00 0.00 54.91 54.40 1um7 h ALA 52 Cb 1.24 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1um7 h ALA 52 CO 0.08 0.63 -0.03 0.22 0.00 0.00 0.00 179.25 180.15 1um7 h ASP 53 N 0.60 -0.06 -0.53 0.00 3.58 -1.70 -3.20 116.42 115.11 1um7 h ASP 53 Ca 0.01 -0.16 0.10 0.00 0.42 0.00 0.00 57.03 57.40 1um7 h ASP 53 Cb 1.13 0.02 -0.11 0.00 1.72 0.00 0.00 39.33 42.09 1um7 h ASP 53 CO 0.12 0.50 -0.29 -0.07 -2.88 0.00 0.00 179.24 176.62 1um7 h LEU 54 N -1.01 -1.01 -0.98 2.28 3.38 -0.42 0.44 115.31 117.99 1um7 h LEU 54 Ca -0.01 0.21 0.40 0.00 0.09 0.00 0.00 57.88 58.57 1um7 h LEU 54 Cb 0.22 0.51 -0.18 0.00 0.09 0.00 0.00 40.66 41.30 1um7 h LEU 54 CO 0.01 -0.29 0.48 -1.54 0.09 0.00 0.00 178.44 177.19 1um7 n SER 55 N -5.43 0.30 0.00 -0.43 3.41 -0.21 -4.72 113.62 106.54 1um7 n SER 55 Ca 0.04 1.63 0.00 0.00 -0.26 0.00 0.00 58.87 60.28 1um7 n SER 55 Cb 0.34 -0.78 0.00 0.00 -0.26 0.00 0.00 64.21 63.52 1um7 n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1um7 n GLY 56 N -1.28 2.23 0.08 5.00 0.00 0.16 -4.83 105.19 106.55 1um7 n GLY 56 Ca 0.36 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.26 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 2.43 0.00 -7.00 1.61 4.39 -1.80 -3.47 114.58 110.74 1um7 h GLU 57 Ca 0.00 0.00 -0.52 0.00 0.34 0.00 0.00 59.36 59.18 1um7 h GLU 57 Cb 0.00 0.00 0.08 0.00 -0.10 0.00 0.00 28.75 28.73 1um7 h GLU 57 CO 0.00 0.48 0.53 -1.17 -1.16 0.00 0.00 179.01 177.68 1um7 s LEU 58 N -8.09 4.02 0.06 1.33 0.20 -1.21 -5.02 118.68 109.97 1um7 s LEU 58 Ca -0.20 2.45 -0.12 0.00 0.69 0.00 0.00 54.13 56.94 1um7 s LEU 58 Cb 0.03 -4.19 0.02 0.00 -0.43 0.00 0.00 46.19 41.62 1um7 s LEU 58 CO 0.39 -1.02 0.28 -0.13 -0.29 0.00 0.00 176.35 175.58 1um7 s ARG 59 N -2.65 0.84 -0.28 1.98 0.52 -1.26 -4.61 118.95 113.49 1um7 s ARG 59 Ca 0.64 -0.64 -0.29 0.00 -0.52 0.00 0.00 55.73 54.92 1um7 s ARG 59 Cb -0.32 0.36 -0.02 0.00 0.52 0.00 0.00 34.95 35.48 1um7 s ARG 59 CO 0.39 -0.28 1.66 0.50 0.02 0.00 0.00 175.30 177.60 1um7 s ARG 60 N -3.00 3.62 0.00 3.54 3.52 -1.26 -2.21 118.95 123.16 1um7 s ARG 60 Ca -0.02 1.51 0.00 0.00 -0.13 0.00 0.00 55.73 57.09 1um7 s ARG 60 Cb 0.01 -4.09 0.00 0.00 -1.56 0.00 0.00 34.95 29.31 1um7 s ARG 60 CO -0.06 -1.51 0.00 0.41 -0.81 0.00 0.00 175.30 173.32 1um7 n GLY 61 N 4.97 1.46 3.38 8.12 0.00 -1.24 -4.98 105.19 116.91 1um7 n GLY 61 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 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 -2.13 -4.24 1.61 9.92 -0.94 -3.98 116.55 116.80 1um7 n ASP 62 Ca 0.00 0.55 -0.39 0.00 -0.53 0.00 0.00 54.79 54.42 1um7 n ASP 62 Cb 0.00 -1.11 -0.11 0.00 -0.64 0.00 0.00 41.12 39.26 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 -2.42 2.49 0.24 -1.24 3.52 -0.17 -0.23 118.95 121.14 1um7 s ARG 63 Ca 0.61 -1.46 -0.31 0.00 -0.13 0.00 0.00 55.73 54.44 1um7 s ARG 63 Cb -0.35 -3.65 -0.12 0.00 -1.56 0.00 0.00 34.95 29.27 1um7 s ARG 63 CO 0.62 -0.90 1.68 -0.89 -0.81 0.00 0.00 175.30 175.00 1um7 n ILE 64 N 4.82 0.41 -0.05 4.11 2.08 -0.12 -2.04 119.36 128.58 1um7 n ILE 64 Ca -0.09 -0.10 -0.11 0.00 0.56 0.00 0.00 62.75 63.01 1um7 n ILE 64 Cb 0.43 -1.98 -0.04 0.00 -0.75 0.00 0.00 39.64 37.30 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 3.24 0.94 -3.83 1.39 4.77 -0.05 -3.88 117.00 119.59 1um7 n LEU 65 Ca 0.13 0.16 -0.11 0.00 -0.03 0.00 0.00 56.01 56.16 1um7 n LEU 65 Cb 0.36 -0.37 -0.08 0.00 -2.33 0.00 0.00 43.42 40.99 1um7 n LEU 65 CO 0.64 0.08 -0.07 -0.94 -1.33 0.00 0.00 177.39 175.76 1um7 s SER 66 N -6.02 -0.01 -0.06 -1.43 1.04 -1.10 -2.86 113.70 103.25 1um7 s SER 66 Ca -0.15 -0.29 0.03 0.00 0.48 0.00 0.00 55.95 56.02 1um7 s SER 66 Cb 0.05 0.29 0.01 0.00 0.10 0.00 0.00 66.02 66.48 1um7 s SER 66 CO 0.20 -0.54 -0.13 -0.69 0.98 0.00 0.00 173.24 173.05 1um7 s VAL 67 N -2.35 1.21 -0.98 5.02 1.01 -1.13 -0.91 120.40 122.28 1um7 s VAL 67 Ca -0.07 -0.54 0.00 0.00 0.00 0.00 0.00 61.98 61.37 1um7 s VAL 67 Cb -0.02 -1.09 0.00 0.00 0.00 0.00 0.00 36.38 35.27 1um7 s VAL 67 CO -0.03 0.37 0.00 0.59 0.00 0.00 0.00 175.10 176.03 1um7 n ASN 68 N 3.64 -2.66 -0.84 3.32 3.02 0.19 -0.32 115.26 121.60 1um7 n ASN 68 Ca -0.21 0.24 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 1um7 n ASN 68 Cb 0.52 -2.55 0.00 0.00 -0.61 0.00 0.00 39.78 37.14 1um7 n ASN 68 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1um7 n GLY 69 N -0.29 0.52 3.21 7.41 0.00 -1.26 -4.90 105.19 109.88 1um7 n GLY 69 Ca -0.10 -0.38 -0.23 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.60 1.42 -0.45 1.61 0.11 0.57 -5.10 120.40 115.95 1um7 s VAL 70 Ca 0.00 -1.19 -0.23 0.00 -2.93 0.00 0.00 61.98 57.63 1um7 s VAL 70 Cb 0.00 -1.27 0.03 0.00 -1.53 0.00 0.00 36.38 33.61 1um7 s VAL 70 CO 0.00 0.05 0.78 0.21 -3.33 0.00 0.00 175.10 172.81 1um7 s ASN 71 N -1.33 6.40 0.00 3.54 3.84 -1.26 -2.84 114.94 123.29 1um7 s ASN 71 Ca 0.04 -0.16 0.01 0.00 0.21 0.00 0.00 52.86 52.97 1um7 s ASN 71 Cb -0.09 -2.38 0.01 0.00 -0.55 0.00 0.00 41.25 38.24 1um7 s ASN 71 CO 0.02 -0.92 0.49 0.18 -2.79 0.00 0.00 177.10 174.09 1um7 n LEU 72 N 6.70 1.01 -0.28 3.21 4.77 -1.14 -4.71 117.00 126.55 1um7 n LEU 72 Ca 0.02 -0.96 0.26 0.00 -0.03 0.00 0.00 56.01 55.30 1um7 n LEU 72 Cb 0.48 0.00 0.48 0.00 -2.33 0.00 0.00 43.42 42.05 1um7 n LEU 72 CO 0.59 0.24 0.89 0.54 -1.33 0.00 0.00 177.39 178.32 1um7 n ARG 73 N -0.03 -0.05 -2.63 3.23 1.74 -1.20 0.50 116.66 118.22 1um7 n ARG 73 Ca 0.01 1.21 -0.20 0.00 -0.77 0.00 0.00 57.85 58.10 1um7 n ARG 73 Cb 0.03 -2.14 0.01 0.00 -1.02 0.00 0.00 32.46 29.33 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 -5.00 3.26 -4.54 0.55 5.03 -1.26 -3.68 115.26 109.61 1um7 n ASN 74 Ca 0.31 -3.31 -0.28 0.00 0.87 0.00 0.00 54.58 52.18 1um7 n ASN 74 Cb 1.06 -0.50 -0.10 0.00 -1.02 0.00 0.00 39.78 39.22 1um7 n ASN 74 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1um7 s ALA 75 N -3.31 2.86 0.81 5.41 0.00 0.18 -4.77 121.76 122.94 1um7 s ALA 75 Ca 0.40 -1.43 -0.12 0.00 0.00 0.00 0.00 51.96 50.82 1um7 s ALA 75 Cb 0.41 -0.71 0.08 0.00 0.00 0.00 0.00 23.12 22.89 1um7 s ALA 75 CO -0.10 0.52 1.12 0.95 0.00 0.00 0.00 175.76 178.25 1um7 s THR 76 N -1.51 2.76 0.29 0.00 -4.23 -1.26 -4.03 115.64 107.66 1um7 s THR 76 Ca 0.23 0.25 0.03 0.00 -1.18 0.00 0.00 61.69 61.01 1um7 s THR 76 Cb -0.09 -3.07 0.28 0.00 1.34 0.00 0.00 72.50 70.96 1um7 s THR 76 CO 0.13 -0.32 1.80 -0.74 -0.54 0.00 0.00 174.62 174.95 1um7 h HIS 77 N -1.10 1.05 0.67 3.99 2.76 -1.63 0.14 115.15 121.03 1um7 h HIS 77 Ca -0.47 0.03 -0.03 0.00 -2.20 0.00 0.00 60.37 57.70 1um7 h HIS 77 Cb 1.29 -0.32 0.01 0.00 1.55 0.00 0.00 27.41 29.93 1um7 h HIS 77 CO 0.41 0.31 -0.32 1.49 -1.30 0.00 0.00 177.93 178.52 1um7 h GLU 78 N 0.83 -0.87 -0.85 5.26 4.81 -1.92 -1.38 114.58 120.47 1um7 h GLU 78 Ca 0.53 0.06 0.21 0.00 -0.13 0.00 0.00 59.36 60.03 1um7 h GLU 78 Cb 0.69 0.20 -0.13 0.00 0.63 0.00 0.00 28.75 30.14 1um7 h GLU 78 CO -0.33 -0.55 0.28 1.96 -0.73 0.00 0.00 179.01 179.64 1um7 h GLN 79 N -1.17 0.29 -0.17 1.92 4.20 -1.76 1.75 115.11 120.17 1um7 h GLN 79 Ca -0.09 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.56 1um7 h GLN 79 Cb 0.72 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.42 1um7 h GLN 79 CO 0.15 0.19 -0.07 0.00 -0.67 0.00 0.00 178.83 178.43 1um7 h ALA 80 N 1.71 1.57 0.02 3.87 0.00 -0.67 -1.26 119.26 124.51 1um7 h ALA 80 Ca 0.52 -0.17 -0.23 0.00 0.00 0.00 0.00 54.91 55.03 1um7 h ALA 80 Cb 0.99 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.67 1um7 h ALA 80 CO -0.57 0.31 -1.11 0.00 0.00 0.00 0.00 179.25 177.87 1um7 h ALA 81 N 1.69 0.34 0.00 0.00 0.00 0.28 -3.15 119.26 118.42 1um7 h ALA 81 Ca 0.05 -0.96 -0.03 0.00 0.00 0.00 0.00 54.91 53.97 1um7 h ALA 81 Cb 0.29 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.01 1um7 h ALA 81 CO 0.01 1.23 -0.16 0.00 0.00 0.00 0.00 179.25 180.33 1um7 h ALA 82 N 0.92 1.24 0.00 0.00 0.00 0.30 0.29 119.26 122.00 1um7 h ALA 82 Ca -0.06 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1um7 h ALA 82 Cb 1.83 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.59 1um7 h ALA 82 CO 0.14 0.21 0.00 0.00 0.00 0.00 0.00 179.25 179.59 1um7 h ALA 83 N 1.84 1.00 0.00 0.00 0.00 -1.23 -0.58 119.26 120.29 1um7 h ALA 83 Ca -0.00 0.00 -0.32 0.00 0.00 0.00 0.00 54.91 54.59 1um7 h ALA 83 Cb 0.45 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.18 1um7 h ALA 83 CO 0.02 0.00 -2.14 1.28 0.00 0.00 0.00 179.25 178.41 1um7 n LEU 84 N -2.56 0.27 0.13 0.00 7.99 -0.09 -3.30 117.00 119.44 1um7 n LEU 84 Ca 0.03 0.13 0.01 0.00 -0.01 0.00 0.00 56.01 56.17 1um7 n LEU 84 Cb 0.36 0.37 0.07 0.00 -0.11 0.00 0.00 43.42 44.11 1um7 n LEU 84 CO 0.27 0.42 0.45 0.50 -1.51 0.00 0.00 177.39 177.53 1um7 h LYS 85 N 0.00 0.00 0.00 3.23 3.11 -0.89 -3.01 116.57 119.01 1um7 h LYS 85 Ca -0.43 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.41 1um7 h LYS 85 Cb 2.09 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 33.32 1um7 h LYS 85 CO 0.04 0.57 -0.53 2.89 -2.81 0.00 0.00 179.45 179.61 1um7 n ARG 86 N -3.33 0.11 0.00 1.90 -4.01 -0.24 -4.84 116.66 106.26 1um7 n ARG 86 Ca 0.01 0.03 0.00 0.00 -1.04 0.00 0.00 57.85 56.85 1um7 n ARG 86 Cb 0.72 -1.57 0.00 0.00 -3.04 0.00 0.00 32.46 28.57 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 -1.63 0.00 -2.00 2.89 0.00 -1.14 -5.07 120.51 113.57 1um7 n ALA 87 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1um7 n ALA 87 Cb 0.38 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.83 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 2.64 2.31 0.10 0.00 0.00 -1.26 -5.06 105.19 103.92 1um7 n GLY 88 Ca 0.00 0.18 -0.20 0.00 0.00 0.00 0.00 46.02 46.00 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 0.00 -4.02 1.61 1.08 -1.92 -3.42 115.11 108.44 1um7 h GLN 89 Ca 0.00 0.00 -0.77 0.00 -1.45 0.00 0.00 58.65 56.43 1um7 h GLN 89 Cb 0.00 0.00 -0.25 0.00 -0.05 0.00 0.00 27.48 27.18 1um7 h GLN 89 CO 0.00 0.91 0.01 -1.12 -0.95 0.00 0.00 178.83 177.68 1um7 s SER 90 N -6.73 6.52 -0.09 1.46 0.01 -1.26 -1.54 113.70 112.06 1um7 s SER 90 Ca -0.27 -2.27 -0.02 0.00 1.31 0.00 0.00 55.95 54.70 1um7 s SER 90 Cb 0.05 -2.22 -0.03 0.00 0.21 0.00 0.00 66.02 64.03 1um7 s SER 90 CO 0.56 -0.73 -0.01 -0.69 0.41 0.00 0.00 173.24 172.78 1um7 s VAL 91 N 0.93 4.18 -0.51 3.43 1.01 -1.05 -5.01 120.40 123.38 1um7 s VAL 91 Ca 0.13 -0.29 -0.14 0.00 0.00 0.00 0.00 61.98 61.67 1um7 s VAL 91 Cb -0.18 -2.76 0.12 0.00 0.00 0.00 0.00 36.38 33.56 1um7 s VAL 91 CO -0.04 0.59 0.45 -0.89 0.00 0.00 0.00 175.10 175.21 1um7 s THR 92 N -0.75 4.96 -0.40 3.92 2.01 -1.26 -1.61 115.64 122.51 1um7 s THR 92 Ca 0.12 -1.52 -0.16 0.00 0.31 0.00 0.00 61.69 60.43 1um7 s THR 92 Cb -0.11 -4.17 0.01 0.00 0.01 0.00 0.00 72.50 68.24 1um7 s THR 92 CO 0.02 -0.81 0.38 -0.63 -0.69 0.00 0.00 174.62 172.89 1um7 s ILE 93 N 1.55 5.15 -0.56 1.82 1.09 0.29 0.53 121.20 131.06 1um7 s ILE 93 Ca 0.04 -0.37 -0.18 0.00 -1.10 0.00 0.00 60.65 59.04 1um7 s ILE 93 Cb -0.28 -3.97 0.10 0.00 -1.06 0.00 0.00 42.46 37.25 1um7 s ILE 93 CO 0.02 -0.33 0.63 -0.69 -0.10 0.00 0.00 174.94 174.47 1um7 s VAL 94 N 1.98 4.95 0.21 2.92 1.01 -0.08 -0.46 120.40 130.93 1um7 s VAL 94 Ca 0.10 -1.07 0.09 0.00 0.00 0.00 0.00 61.98 61.10 1um7 s VAL 94 Cb -0.17 -4.41 -0.05 0.00 0.00 0.00 0.00 36.38 31.75 1um7 s VAL 94 CO 0.12 -1.00 -0.18 0.00 0.00 0.00 0.00 175.10 174.05 1um7 s ALA 95 N 2.35 2.24 -0.11 5.51 0.00 -1.04 -0.87 121.76 129.83 1um7 s ALA 95 Ca 0.09 -1.66 0.01 0.00 0.00 0.00 0.00 51.96 50.40 1um7 s ALA 95 Cb -0.25 -0.18 0.02 0.00 0.00 0.00 0.00 23.12 22.71 1um7 s ALA 95 CO 0.06 0.20 -0.13 1.14 0.00 0.00 0.00 175.76 177.03 1um7 s GLN 96 N -3.29 2.01 -0.79 0.00 -2.07 -0.86 -0.44 119.66 114.22 1um7 s GLN 96 Ca 0.22 -0.47 -0.24 0.00 -1.82 0.00 0.00 55.36 53.05 1um7 s GLN 96 Cb -0.04 -1.81 -0.18 0.00 -1.09 0.00 0.00 33.01 29.89 1um7 s GLN 96 CO 0.09 -0.14 2.43 0.98 -1.32 0.00 0.00 175.29 177.33 1um7 n TYR 97 N 4.47 0.88 -3.59 9.60 4.19 -1.26 -1.00 117.16 130.45 1um7 n TYR 97 Ca -0.17 0.12 -0.28 0.00 3.31 0.00 0.00 57.90 60.87 1um7 n TYR 97 Cb 0.51 -2.16 -0.11 0.00 0.49 0.00 0.00 39.34 38.07 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 8.37 1.29 0.12 2.98 1.81 -1.26 -4.66 118.95 127.61 1um7 s ARG 98 Ca 1.12 -2.26 -0.08 0.00 -1.72 0.00 0.00 55.73 52.79 1um7 s ARG 98 Cb -0.54 -2.06 -0.12 0.00 -0.45 0.00 0.00 34.95 31.77 1um7 s ARG 98 CO 0.33 -1.29 1.30 -1.00 -0.68 0.00 0.00 175.30 173.95 1um7 h PRO 99 N 6.03 0.57 -0.91 3.54 0.13 -1.88 -3.07 132.00 136.41 1um7 h PRO 99 Ca 0.15 -0.55 0.15 0.00 -0.87 0.00 0.00 66.00 64.88 1um7 h PRO 99 Cb 0.89 0.14 -0.15 0.00 0.13 0.00 0.00 31.00 32.01 1um7 h PRO 99 CO 0.46 1.18 -0.35 1.49 -0.23 0.00 0.00 178.00 180.55 1um7 h GLU 100 N 0.35 -0.03 0.45 0.86 4.81 -1.92 0.97 114.58 120.07 1um7 h GLU 100 Ca -0.08 0.00 -0.02 0.00 -0.13 0.00 0.00 59.36 59.13 1um7 h GLU 100 Cb 1.53 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.92 1um7 h GLU 100 CO 0.17 -0.02 -0.22 0.93 -0.73 0.00 0.00 179.01 179.14 1um7 h GLU 101 N -0.03 -0.58 -1.37 1.92 5.08 -1.94 -3.11 114.58 114.54 1um7 h GLU 101 Ca 0.35 0.04 0.46 0.00 -1.00 0.00 0.00 59.36 59.20 1um7 h GLU 101 Cb 0.61 0.13 -0.13 0.00 0.50 0.00 0.00 28.75 29.86 1um7 h GLU 101 CO -0.92 -0.39 0.89 -0.92 -1.00 0.00 0.00 179.01 176.67 1um7 h TYR 102 N -0.87 0.49 -1.11 4.33 3.20 -1.26 1.54 116.97 123.29 1um7 h TYR 102 Ca -0.06 0.02 0.32 0.00 3.14 0.00 0.00 58.73 62.15 1um7 h TYR 102 Cb 0.46 -0.12 -0.04 0.00 1.54 0.00 0.00 36.73 38.57 1um7 h TYR 102 CO 0.04 -0.22 0.81 1.03 -1.64 0.00 0.00 178.16 178.18 1um7 h SER 103 N 0.05 0.00 0.11 -2.11 0.87 0.10 1.39 113.55 113.97 1um7 h SER 103 Ca 0.85 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 61.38 1um7 h SER 103 Cb 2.72 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 64.67 1um7 h SER 103 CO -0.41 0.00 -0.11 0.08 -0.53 0.00 0.00 176.83 175.86 1um7 h ARG 104 N 0.00 0.00 0.17 2.24 0.11 0.21 -2.52 114.38 114.59 1um7 h ARG 104 Ca 0.52 0.00 -0.34 0.00 0.10 0.00 0.00 59.98 60.27 1um7 h ARG 104 Cb 2.14 0.00 0.01 0.00 1.11 0.00 0.00 29.97 33.23 1um7 h ARG 104 CO -0.01 0.11 -1.69 0.74 0.10 0.00 0.00 179.97 179.22 1um7 h PHE 105 N 0.00 0.65 -0.11 4.08 0.04 0.17 -3.21 116.94 118.57 1um7 h PHE 105 Ca -0.00 -0.47 0.03 0.00 2.80 0.00 0.00 57.97 60.32 1um7 h PHE 105 Cb 0.19 -0.03 -0.06 0.00 2.20 0.00 0.00 35.95 38.25 1um7 h PHE 105 CO 0.00 1.66 -0.53 0.93 -0.60 0.00 0.00 178.31 179.77 1um7 h GLU 106 N 0.01 -0.57 0.45 1.51 4.39 -0.99 -2.08 114.58 117.31 1um7 h GLU 106 Ca -0.34 0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.39 1um7 h GLU 106 Cb 2.02 0.13 -0.02 0.00 -0.10 0.00 0.00 28.75 30.78 1um7 h GLU 106 CO 0.15 -0.38 -0.48 1.03 -1.16 0.00 0.00 179.01 178.16 1um7 h SER 107 N -0.59 -1.33 -3.25 1.42 0.87 -1.64 -3.40 113.55 105.63 1um7 h SER 107 Ca 0.03 0.11 -0.56 0.00 -1.23 0.00 0.00 61.79 60.14 1um7 h SER 107 Cb 0.68 0.44 -0.37 0.00 -0.44 0.00 0.00 62.40 62.71 1um7 h SER 107 CO -0.41 -0.62 -0.80 -0.55 -0.53 0.00 0.00 176.83 173.91 1um7 s SER 108 N -4.24 2.63 0.01 6.23 0.15 -1.02 -5.10 113.70 112.36 1um7 s SER 108 Ca -0.17 -0.53 -0.08 0.00 0.70 0.00 0.00 55.95 55.87 1um7 s SER 108 Cb 0.04 -0.96 0.03 0.00 -1.71 0.00 0.00 66.02 63.42 1um7 s SER 108 CO 0.56 -0.14 0.37 0.61 1.20 0.00 0.00 173.24 175.85 1um7 n GLY 109 N 4.86 0.69 3.33 9.45 0.00 -0.81 -3.97 105.19 118.74 1um7 n GLY 109 Ca -0.13 -0.93 -0.38 0.00 0.00 0.00 0.00 46.02 44.58 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 -0.27 2.32 -3.39 1.61 -0.04 -1.26 -4.75 135.00 129.22 1um7 n PRO 110 Ca 0.01 -2.63 -0.19 0.00 -0.04 0.00 0.00 63.50 60.65 1um7 n PRO 110 Cb 0.18 -3.42 -0.09 0.00 -0.04 0.00 0.00 33.50 30.13 1um7 n PRO 110 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1um7 s SER 111 N 4.87 1.57 0.93 3.54 0.15 -1.26 -5.14 113.70 118.36 1um7 s SER 111 Ca 0.58 -1.37 -0.12 0.00 0.70 0.00 0.00 55.95 55.74 1um7 s SER 111 Cb 0.07 0.42 0.15 0.00 -1.71 0.00 0.00 66.02 64.95 1um7 s SER 111 CO 0.07 -0.31 1.09 -0.55 1.20 0.00 0.00 173.24 174.75 1um7 s SER 112 N 1.71 3.15 0.00 5.45 0.15 -1.26 -5.14 113.70 117.75 1um7 s SER 112 Ca 0.14 1.39 0.00 0.00 0.70 0.00 0.00 55.95 58.18 1um7 s SER 112 Cb -0.16 -2.06 0.00 0.00 -1.71 0.00 0.00 66.02 62.09 1um7 s SER 112 CO -0.13 -2.83 0.00 0.61 1.20 0.00 0.00 173.24 172.09