#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 -0.12 0.00 1.61 0.15 -1.26 -5.19 113.70 108.90 1um7 s SER 2 Ca 0.00 0.13 0.00 0.00 0.70 0.00 0.00 55.95 56.78 1um7 s SER 2 Cb 0.00 0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.41 1um7 s SER 2 CO 0.00 -0.10 0.00 -1.20 1.20 0.00 0.00 173.24 173.14 1um7 n SER 3 N 0.64 0.00 -3.55 5.45 7.64 -1.26 -5.19 113.62 117.35 1um7 n SER 3 Ca -0.03 0.00 -0.07 0.00 1.01 0.00 0.00 58.87 59.78 1um7 n SER 3 Cb 0.59 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.77 1um7 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1um7 s GLY 4 N 0.00 -0.42 -0.21 0.23 0.00 -1.26 -5.18 107.32 100.48 1um7 s GLY 4 Ca 0.00 0.97 -0.27 0.00 0.00 0.00 0.00 44.72 45.42 1um7 s GLY 4 CO 0.00 0.32 0.89 -0.56 0.00 0.00 0.00 173.10 173.74 1um7 s SER 5 N -2.51 -0.54 0.39 1.64 0.01 -1.26 -5.18 113.70 106.24 1um7 s SER 5 Ca 0.07 0.88 0.06 0.00 1.31 0.00 0.00 55.95 58.26 1um7 s SER 5 Cb -0.01 0.83 -0.07 0.00 0.21 0.00 0.00 66.02 66.98 1um7 s SER 5 CO -0.07 -0.30 0.02 -0.55 0.41 0.00 0.00 173.24 172.75 1um7 s SER 6 N -0.29 3.43 0.00 2.44 0.15 -1.26 -4.93 113.70 113.24 1um7 s SER 6 Ca -0.01 -1.38 0.00 0.00 0.70 0.00 0.00 55.95 55.26 1um7 s SER 6 Cb -0.03 -0.29 0.00 0.00 -1.71 0.00 0.00 66.02 63.98 1um7 s SER 6 CO 0.00 -0.50 0.00 0.61 1.20 0.00 0.00 173.24 174.55 1um7 n GLY 7 N -0.89 2.64 1.38 9.45 0.00 -1.26 -5.12 105.19 111.39 1um7 n GLY 7 Ca -0.04 -0.39 0.12 0.00 0.00 0.00 0.00 46.02 45.70 1um7 n GLY 7 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1um7 n ARG 8 N 0.00 -3.33 -2.49 1.61 5.12 -1.26 -4.81 116.66 111.50 1um7 n ARG 8 Ca 0.00 2.68 -0.41 0.00 -1.93 0.00 0.00 57.85 58.19 1um7 n ARG 8 Cb 0.00 -3.67 -0.04 0.00 -1.16 0.00 0.00 32.46 27.59 1um7 n ARG 8 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1um7 s PRO 9 N -4.55 4.59 -0.20 5.56 0.04 -1.26 -5.03 135.00 134.14 1um7 s PRO 9 Ca 0.00 1.75 -0.05 0.00 0.04 0.00 0.00 61.00 62.74 1um7 s PRO 9 Cb 0.00 -3.26 -0.02 0.00 0.04 0.00 0.00 34.50 31.26 1um7 s PRO 9 CO 0.00 0.08 0.01 0.20 0.04 0.00 0.00 177.00 177.33 1um7 s GLY 10 N -0.22 1.73 0.45 0.56 0.00 -1.26 -5.10 107.32 103.48 1um7 s GLY 10 Ca 0.49 -0.99 0.03 0.00 0.00 0.00 0.00 44.72 44.24 1um7 s GLY 10 CO 0.36 0.25 0.08 -0.32 0.00 0.00 0.00 173.10 173.47 1um7 s GLY 11 N 1.02 2.80 -0.23 0.20 0.00 -1.26 -5.02 107.32 104.83 1um7 s GLY 11 Ca 0.02 -0.87 0.07 0.00 0.00 0.00 0.00 44.72 43.94 1um7 s GLY 11 CO 0.02 -1.99 1.47 1.22 0.00 0.00 0.00 173.10 173.82 1um7 n ASP 12 N -1.31 3.93 -2.38 1.64 8.00 -1.26 -4.92 116.55 120.25 1um7 n ASP 12 Ca -0.12 -2.84 -0.00 0.00 0.71 0.00 0.00 54.79 52.54 1um7 n ASP 12 Cb 0.66 -0.67 -0.00 0.00 -0.02 0.00 0.00 41.12 41.08 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 -0.03 -3.38 0.07 2.24 0.00 -1.26 -5.04 120.51 113.11 1um7 n ALA 13 Ca 0.29 0.50 0.00 0.00 0.00 0.00 0.00 53.44 54.22 1um7 n ALA 13 Cb 1.08 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.54 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 0.58 0.00 -0.59 0.00 3.00 -1.26 -4.82 116.66 113.57 1um7 n ARG 14 Ca -0.03 0.00 -0.27 0.00 -0.01 0.00 0.00 57.85 57.54 1um7 n ARG 14 Cb 0.05 -0.35 0.17 0.00 0.00 0.00 0.00 32.46 32.32 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 -3.45 -2.10 -2.43 5.56 1.02 -1.26 -3.91 120.64 114.07 1um7 n GLU 15 Ca 0.00 -0.61 -0.42 0.00 -0.02 0.00 0.00 57.16 56.11 1um7 n GLU 15 Cb 0.03 -1.62 -0.03 0.00 -0.02 0.00 0.00 31.44 29.80 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 -3.55 4.31 0.60 3.49 0.04 -1.26 -4.31 135.00 134.33 1um7 s PRO 16 Ca 0.49 1.70 0.03 0.00 0.04 0.00 0.00 61.00 63.26 1um7 s PRO 16 Cb -0.09 -3.62 0.08 0.00 0.04 0.00 0.00 34.50 30.91 1um7 s PRO 16 CO 0.53 -0.53 0.84 -0.98 0.04 0.00 0.00 177.00 176.89 1um7 s ARG 17 N 2.60 2.20 -0.16 4.56 1.70 0.05 -4.83 118.95 125.06 1um7 s ARG 17 Ca 0.56 -1.16 -0.06 0.00 -0.47 0.00 0.00 55.73 54.61 1um7 s ARG 17 Cb -0.24 -2.50 -0.04 0.00 -0.57 0.00 0.00 34.95 31.60 1um7 s ARG 17 CO 0.20 -0.97 0.03 0.21 -1.08 0.00 0.00 175.30 173.69 1um7 s LYS 18 N -4.84 3.78 -0.02 3.89 2.20 -1.26 -2.23 119.74 121.27 1um7 s LYS 18 Ca 0.61 -0.39 0.03 0.00 -0.36 0.00 0.00 55.97 55.86 1um7 s LYS 18 Cb -0.07 -3.09 0.00 0.00 -1.51 0.00 0.00 37.83 33.16 1um7 s LYS 18 CO 0.40 0.32 -0.09 0.42 -0.36 0.00 0.00 175.35 176.05 1um7 s ILE 19 N 0.20 0.75 -0.42 5.43 1.01 0.20 -4.99 121.20 123.38 1um7 s ILE 19 Ca 0.02 -0.36 0.04 0.00 0.00 0.00 0.00 60.65 60.35 1um7 s ILE 19 Cb -0.13 -0.66 0.11 0.00 0.01 0.00 0.00 42.46 41.79 1um7 s ILE 19 CO 0.01 0.23 0.15 -0.63 0.00 0.00 0.00 174.94 174.70 1um7 s ILE 20 N 0.10 2.39 0.03 2.92 1.01 -1.26 0.19 121.20 126.57 1um7 s ILE 20 Ca -0.01 -2.77 -0.21 0.00 0.00 0.00 0.00 60.65 57.66 1um7 s ILE 20 Cb -0.07 -2.72 -0.06 0.00 0.01 0.00 0.00 42.46 39.62 1um7 s ILE 20 CO 0.00 -0.69 0.60 -0.76 0.00 0.00 0.00 174.94 174.09 1um7 s LEU 21 N 0.37 4.46 -0.48 2.97 2.01 -0.65 -4.89 118.68 122.48 1um7 s LEU 21 Ca 0.14 1.23 -0.14 0.00 0.01 0.00 0.00 54.13 55.37 1um7 s LEU 21 Cb -0.22 -2.94 0.10 0.00 0.01 0.00 0.00 46.19 43.13 1um7 s LEU 21 CO -0.05 0.16 0.39 -1.00 1.01 0.00 0.00 176.35 176.87 1um7 s HIS 22 N -0.54 3.29 -0.49 0.29 3.76 -1.26 -2.58 115.29 117.76 1um7 s HIS 22 Ca 0.31 -1.29 -0.44 0.00 -0.15 0.00 0.00 55.06 53.49 1um7 s HIS 22 Cb -0.19 -3.37 -0.19 0.00 1.11 0.00 0.00 32.58 29.94 1um7 s HIS 22 CO 0.18 -0.90 2.08 1.63 -0.85 0.00 0.00 174.74 176.88 1um7 n LYS 23 N 5.12 0.08 0.08 1.40 5.02 -0.73 -4.72 118.16 124.41 1um7 n LYS 23 Ca -0.12 0.02 -0.05 0.00 -2.02 0.00 0.00 58.31 56.15 1um7 n LYS 23 Cb 0.42 -1.56 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 1um7 n LYS 23 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1um7 h GLY 24 N 8.76 -0.31 0.00 0.72 0.00 -1.87 -3.48 103.07 106.89 1um7 h GLY 24 Ca -0.15 0.12 0.00 0.00 0.00 0.00 0.00 47.33 47.29 1um7 h GLY 24 CO 1.07 -0.11 0.00 1.44 0.00 0.00 0.00 176.54 178.94 1um7 n SER 25 N -4.95 -0.08 -0.03 0.19 7.64 -1.26 -4.97 113.62 110.17 1um7 n SER 25 Ca -0.04 0.02 -0.15 0.00 1.01 0.00 0.00 58.87 59.71 1um7 n SER 25 Cb 0.12 0.46 -0.11 0.00 -1.01 0.00 0.00 64.21 63.67 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 1.51 0.00 0.44 1.35 -1.99 -3.50 112.91 110.72 1um7 h THR 26 Ca 0.00 -1.88 0.00 0.00 -0.55 0.00 0.00 66.41 63.98 1um7 h THR 26 Cb 0.00 2.66 0.00 0.00 -1.73 0.00 0.00 68.15 69.08 1um7 h THR 26 CO 0.00 0.52 0.00 0.61 -0.25 0.00 0.00 175.52 176.40 1um7 n GLY 27 N 0.95 -0.72 0.10 5.82 0.00 -1.26 -4.96 105.19 105.13 1um7 n GLY 27 Ca -0.09 0.21 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 0.92 -0.95 0.99 7.99 -1.26 -2.70 117.00 121.99 1um7 n LEU 28 Ca 0.00 -0.28 -0.01 0.00 -0.01 0.00 0.00 56.01 55.71 1um7 n LEU 28 Cb 0.00 -0.13 0.01 0.00 -0.11 0.00 0.00 43.42 43.19 1um7 n LEU 28 CO 0.00 0.20 0.01 0.61 -1.51 0.00 0.00 177.39 176.70 1um7 n GLY 29 N 1.46 0.61 3.61 -0.72 0.00 -1.26 -1.57 105.19 107.32 1um7 n GLY 29 Ca 0.07 -0.52 -0.06 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.19 0.40 1.61 -0.12 -1.26 -0.00 117.98 115.40 1um7 s PHE 30 Ca 0.02 0.29 0.08 0.00 -0.05 0.00 0.00 56.93 57.26 1um7 s PHE 30 Cb -0.01 0.48 -0.02 0.00 -0.63 0.00 0.00 43.02 42.84 1um7 s PHE 30 CO 0.05 -0.19 0.37 1.21 -0.05 0.00 0.00 175.22 176.61 1um7 s ASN 31 N -1.26 5.15 0.11 1.98 3.84 0.13 -4.94 114.94 119.95 1um7 s ASN 31 Ca 0.05 -0.67 0.03 0.00 0.21 0.00 0.00 52.86 52.48 1um7 s ASN 31 Cb -0.01 -0.66 -0.04 0.00 -0.55 0.00 0.00 41.25 39.99 1um7 s ASN 31 CO -0.04 -0.60 -0.09 0.27 -2.79 0.00 0.00 177.10 173.85 1um7 s ILE 32 N -2.43 0.92 0.31 -5.21 -4.36 -1.26 -2.18 121.20 106.98 1um7 s ILE 32 Ca 0.47 -1.78 0.06 0.00 -0.26 0.00 0.00 60.65 59.14 1um7 s ILE 32 Cb -0.04 -1.52 -0.03 0.00 1.25 0.00 0.00 42.46 42.12 1um7 s ILE 32 CO 0.28 -0.67 0.25 0.68 0.24 0.00 0.00 174.94 175.72 1um7 s VAL 33 N -2.88 0.01 0.00 8.37 -7.23 0.52 -4.63 120.40 114.57 1um7 s VAL 33 Ca 0.09 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.26 1um7 s VAL 33 Cb 0.00 -2.50 0.00 0.00 0.56 0.00 0.00 36.38 34.44 1um7 s VAL 33 CO -0.01 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.39 1um7 n GLY 34 N -0.57 -0.84 0.60 2.32 0.00 -1.26 -1.92 105.19 103.53 1um7 n GLY 34 Ca 0.06 -2.00 0.00 0.00 0.00 0.00 0.00 46.02 44.08 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 1.17 2.89 -0.02 0.00 -1.26 -4.26 105.19 103.71 1um7 n GLY 35 Ca 0.00 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.47 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 -1.89 1.46 -1.64 1.61 2.02 -1.26 -4.58 118.70 114.42 1um7 s GLU 36 Ca 0.00 -0.39 -0.20 0.00 0.02 0.00 0.00 54.97 54.40 1um7 s GLU 36 Cb 0.00 -1.81 0.19 0.00 0.10 0.00 0.00 34.13 32.61 1um7 s GLU 36 CO 0.00 -0.36 0.58 -0.25 0.02 0.00 0.00 175.26 175.25 1um7 n ASP 37 N 4.91 -2.21 -3.82 -0.19 8.00 -1.26 0.45 116.55 122.42 1um7 n ASP 37 Ca -0.12 -0.98 -0.28 0.00 0.71 0.00 0.00 54.79 54.11 1um7 n ASP 37 Cb 0.49 -1.89 0.01 0.00 -0.02 0.00 0.00 41.12 39.71 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 -1.09 -0.58 0.11 0.44 0.00 -1.26 -4.87 105.19 97.94 1um7 n GLY 38 Ca 0.09 0.28 -0.01 0.00 0.00 0.00 0.00 46.02 46.38 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 -1.89 0.00 0.00 1.61 -0.00 -0.30 -3.46 114.58 110.54 1um7 h GLU 39 Ca -0.65 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.71 1um7 h GLU 39 Cb 1.37 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 30.12 1um7 h GLU 39 CO 0.55 0.66 0.00 0.41 -0.00 0.00 0.00 179.01 180.63 1um7 n GLY 40 N 1.29 3.61 3.88 1.06 0.00 -1.26 -5.05 105.19 108.72 1um7 n GLY 40 Ca 0.00 -1.71 -0.35 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 -2.24 5.42 0.06 -0.61 -1.09 -1.26 -4.07 121.20 117.41 1um7 s ILE 41 Ca 0.00 0.04 -0.06 0.00 -2.23 0.00 0.00 60.65 58.40 1um7 s ILE 41 Cb 0.00 -3.42 -0.02 0.00 -1.58 0.00 0.00 42.46 37.44 1um7 s ILE 41 CO 0.00 0.50 0.10 -0.36 -1.23 0.00 0.00 174.94 173.95 1um7 s PHE 42 N -1.14 0.28 0.07 3.97 0.40 -0.81 -0.61 117.98 120.14 1um7 s PHE 42 Ca 0.20 -0.71 -0.30 0.00 -0.60 0.00 0.00 56.93 55.52 1um7 s PHE 42 Cb -0.12 -0.18 -0.05 0.00 0.51 0.00 0.00 43.02 43.18 1um7 s PHE 42 CO 0.10 -0.45 1.03 0.08 0.70 0.00 0.00 175.22 176.67 1um7 s VAL 43 N -3.57 4.46 -0.13 -0.44 1.01 -0.69 0.20 120.40 121.24 1um7 s VAL 43 Ca 0.03 1.90 0.18 0.00 0.00 0.00 0.00 61.98 64.09 1um7 s VAL 43 Cb 0.04 -4.22 -0.23 0.00 0.00 0.00 0.00 36.38 31.98 1um7 s VAL 43 CO -0.09 0.22 0.44 -1.54 0.00 0.00 0.00 175.10 174.14 1um7 n SER 44 N 3.29 0.36 -3.55 3.32 3.41 -0.93 -3.04 113.62 116.49 1um7 n SER 44 Ca 0.05 0.16 -0.07 0.00 -0.26 0.00 0.00 58.87 58.74 1um7 n SER 44 Cb 0.49 0.81 -0.02 0.00 -0.26 0.00 0.00 64.21 65.23 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 -2.83 -0.30 -0.11 7.33 5.36 -1.26 -4.94 117.98 121.23 1um7 s PHE 45 Ca -0.07 0.14 -0.01 0.00 -0.96 0.00 0.00 56.93 56.03 1um7 s PHE 45 Cb 0.09 0.55 0.03 0.00 -0.34 0.00 0.00 43.02 43.35 1um7 s PHE 45 CO 0.84 -0.58 -0.03 0.42 -1.46 0.00 0.00 175.22 174.41 1um7 s ILE 46 N -3.12 0.71 0.58 3.12 -1.09 -1.26 0.21 121.20 120.35 1um7 s ILE 46 Ca 0.06 -0.20 -0.19 0.00 -2.23 0.00 0.00 60.65 58.10 1um7 s ILE 46 Cb -0.01 -0.87 -0.07 0.00 -1.58 0.00 0.00 42.46 39.93 1um7 s ILE 46 CO -0.07 0.22 0.78 -0.11 -1.23 0.00 0.00 174.94 174.53 1um7 n LEU 47 N 5.03 2.42 -4.57 2.97 7.94 0.99 -4.91 117.00 126.88 1um7 n LEU 47 Ca -0.10 0.79 -0.42 0.00 -1.11 0.00 0.00 56.01 55.17 1um7 n LEU 47 Cb 0.49 -1.30 -0.06 0.00 0.53 0.00 0.00 43.42 43.08 1um7 n LEU 47 CO 0.14 -2.34 0.42 0.00 -1.11 0.00 0.00 177.39 174.50 1um7 s ALA 48 N -1.59 3.43 0.00 1.96 0.00 -1.26 -3.52 121.76 120.78 1um7 s ALA 48 Ca 0.72 -0.86 0.00 0.00 0.00 0.00 0.00 51.96 51.82 1um7 s ALA 48 Cb -0.44 -3.23 0.00 0.00 0.00 0.00 0.00 23.12 19.45 1um7 s ALA 48 CO 0.50 -1.44 0.00 0.41 0.00 0.00 0.00 175.76 175.24 1um7 n GLY 49 N 4.70 0.26 2.70 0.00 0.00 -1.26 -5.07 105.19 106.52 1um7 n GLY 49 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.89 0.14 -0.02 0.00 -1.23 -4.55 105.19 94.65 1um7 n GLY 50 Ca 0.00 -1.45 -0.08 0.00 0.00 0.00 0.00 46.02 44.48 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 0.24 0.00 1.61 0.13 -1.84 0.70 132.00 132.84 1um7 h PRO 51 Ca -0.32 -0.24 -0.02 0.00 -0.87 0.00 0.00 66.00 64.55 1um7 h PRO 51 Cb 0.99 0.06 -0.00 0.00 0.13 0.00 0.00 31.00 32.18 1um7 h PRO 51 CO 0.21 0.93 -0.10 0.00 -0.23 0.00 0.00 178.00 178.81 1um7 h ALA 52 N 0.99 1.03 0.00 -0.56 0.00 -1.47 -0.65 119.26 118.60 1um7 h ALA 52 Ca -0.04 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.65 1um7 h ALA 52 Cb 1.41 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 19.17 1um7 h ALA 52 CO 0.13 0.12 -1.28 -3.47 0.00 0.00 0.00 179.25 174.75 1um7 n ASP 53 N -3.24 1.90 -0.06 0.00 2.03 -1.11 -3.10 116.55 112.97 1um7 n ASP 53 Ca 0.00 0.42 -0.10 0.00 0.52 0.00 0.00 54.79 55.63 1um7 n ASP 53 Cb 0.35 -0.82 -0.03 0.00 -0.72 0.00 0.00 41.12 39.90 1um7 n ASP 53 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1um7 h LEU 54 N -1.00 -1.12 -1.47 -2.67 3.38 0.35 0.36 115.31 113.14 1um7 h LEU 54 Ca -0.21 0.18 0.48 0.00 0.09 0.00 0.00 57.88 58.42 1um7 h LEU 54 Cb 1.07 0.49 -0.13 0.00 0.09 0.00 0.00 40.66 42.18 1um7 h LEU 54 CO -0.13 -0.35 0.95 0.28 0.09 0.00 0.00 178.44 179.28 1um7 h SER 55 N -0.34 0.18 0.00 -0.43 0.02 -1.30 -3.43 113.55 108.25 1um7 h SER 55 Ca 0.13 0.13 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1um7 h SER 55 Cb 0.56 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.23 1um7 h SER 55 CO -0.46 -0.22 0.00 0.61 -1.14 0.00 0.00 176.83 175.62 1um7 n GLY 56 N -1.57 0.69 0.09 -3.77 0.00 0.13 -4.84 105.19 95.92 1um7 n GLY 56 Ca 0.40 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.30 1um7 n GLY 56 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1um7 n GLU 57 N -2.05 0.52 -2.17 1.61 -0.58 -1.26 -4.91 120.64 111.81 1um7 n GLU 57 Ca 0.00 0.38 -0.42 0.00 -0.42 0.00 0.00 57.16 56.70 1um7 n GLU 57 Cb 0.03 -1.58 -0.03 0.00 -0.57 0.00 0.00 31.44 29.29 1um7 n GLU 57 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1um7 s LEU 58 N -7.96 4.36 -0.04 -4.62 2.96 -1.18 -5.01 118.68 107.20 1um7 s LEU 58 Ca -0.25 2.31 -0.05 0.00 -0.22 0.00 0.00 54.13 55.92 1um7 s LEU 58 Cb 0.05 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 43.17 1um7 s LEU 58 CO 0.39 -0.67 0.12 -0.13 -1.32 0.00 0.00 176.35 174.74 1um7 s ARG 59 N 1.28 0.19 -0.21 1.98 0.52 -1.26 -4.39 118.95 117.06 1um7 s ARG 59 Ca 0.65 0.08 -0.37 0.00 -0.52 0.00 0.00 55.73 55.57 1um7 s ARG 59 Cb -0.36 0.09 -0.14 0.00 0.52 0.00 0.00 34.95 35.06 1um7 s ARG 59 CO 0.30 -0.03 1.84 -2.13 0.02 0.00 0.00 175.30 175.30 1um7 n ARG 60 N 2.78 1.59 0.00 3.54 0.63 -1.26 -1.12 116.66 122.82 1um7 n ARG 60 Ca -0.14 0.57 0.00 0.00 -0.92 0.00 0.00 57.85 57.36 1um7 n ARG 60 Cb 0.59 -2.36 0.00 0.00 0.45 0.00 0.00 32.46 31.13 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 4.48 2.04 3.71 5.14 0.00 -1.17 -4.94 105.19 114.45 1um7 n GLY 61 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 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 -1.86 6.82 -0.33 1.61 1.11 -0.27 -3.34 116.67 120.41 1um7 s ASP 62 Ca 0.00 2.29 -0.27 0.00 0.18 0.00 0.00 52.55 54.75 1um7 s ASP 62 Cb 0.00 -2.58 0.01 0.00 1.07 0.00 0.00 42.92 41.42 1um7 s ASP 62 CO 0.00 -0.67 0.98 -0.60 1.18 0.00 0.00 175.17 176.06 1um7 s ARG 63 N 1.41 4.00 -0.54 8.23 3.52 0.35 -1.70 118.95 134.22 1um7 s ARG 63 Ca 0.65 0.86 -0.27 0.00 -0.13 0.00 0.00 55.73 56.84 1um7 s ARG 63 Cb -0.36 -3.75 -0.01 0.00 -1.56 0.00 0.00 34.95 29.28 1um7 s ARG 63 CO 0.30 -0.86 1.68 0.42 -0.81 0.00 0.00 175.30 176.02 1um7 s ILE 64 N 3.46 3.54 -0.04 4.11 -1.09 0.22 -0.57 121.20 130.84 1um7 s ILE 64 Ca 0.41 0.43 -0.20 0.00 -2.23 0.00 0.00 60.65 59.06 1um7 s ILE 64 Cb -0.13 -4.08 -0.14 0.00 -1.58 0.00 0.00 42.46 36.53 1um7 s ILE 64 CO 0.15 -0.92 0.88 -0.07 -1.23 0.00 0.00 174.94 173.75 1um7 h LEU 65 N 14.60 -0.26 -7.98 2.97 -0.00 -0.52 -3.38 115.31 120.74 1um7 h LEU 65 Ca -0.28 -0.26 -0.09 0.00 -0.00 0.00 0.00 57.88 57.25 1um7 h LEU 65 Cb 1.14 0.07 -0.13 0.00 -0.00 0.00 0.00 40.66 41.74 1um7 h LEU 65 CO 1.17 0.24 -0.30 -0.44 -0.00 0.00 0.00 178.44 179.11 1um7 s SER 66 N -5.31 0.03 -0.02 -0.43 0.01 -0.74 -1.41 113.70 105.83 1um7 s SER 66 Ca -0.12 -0.78 0.05 0.00 1.31 0.00 0.00 55.95 56.40 1um7 s SER 66 Cb 0.01 0.43 -0.01 0.00 0.21 0.00 0.00 66.02 66.65 1um7 s SER 66 CO 0.44 -0.87 -0.16 -0.69 0.41 0.00 0.00 173.24 172.37 1um7 s VAL 67 N -3.93 1.28 -0.65 3.43 1.01 -0.78 -1.12 120.40 119.63 1um7 s VAL 67 Ca 0.14 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.36 1um7 s VAL 67 Cb 0.03 -1.07 0.08 0.00 0.00 0.00 0.00 36.38 35.42 1um7 s VAL 67 CO -0.03 0.36 0.20 -3.20 0.00 0.00 0.00 175.10 172.44 1um7 n ASN 68 N 2.81 -1.33 -1.58 3.32 2.85 0.25 0.18 115.26 121.75 1um7 n ASN 68 Ca -0.15 -0.09 -0.05 0.00 -0.11 0.00 0.00 54.58 54.18 1um7 n ASN 68 Cb 0.54 -1.24 0.02 0.00 1.24 0.00 0.00 39.78 40.34 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 -0.70 0.29 2.86 8.20 0.00 -1.25 -4.91 105.19 109.69 1um7 n GLY 69 Ca 0.04 -0.35 -0.29 0.00 0.00 0.00 0.00 46.02 45.42 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 -3.09 1.10 -0.53 1.61 1.01 0.47 -5.07 120.40 115.90 1um7 s VAL 70 Ca 0.03 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.82 1um7 s VAL 70 Cb -0.01 -1.45 -0.11 0.00 0.00 0.00 0.00 36.38 34.81 1um7 s VAL 70 CO 0.19 -0.11 2.40 -3.20 0.00 0.00 0.00 175.10 174.38 1um7 n ASN 71 N 4.84 1.95 -0.99 3.32 2.85 -1.26 -1.87 115.26 124.10 1um7 n ASN 71 Ca -0.11 -0.07 0.11 0.00 -0.11 0.00 0.00 54.58 54.40 1um7 n ASN 71 Cb 0.46 -1.37 0.15 0.00 1.24 0.00 0.00 39.78 40.25 1um7 n ASN 71 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 1um7 n LEU 72 N 12.90 3.11 0.00 1.20 4.77 -0.50 -4.62 117.00 133.86 1um7 n LEU 72 Ca 0.43 -1.25 0.00 0.00 -0.03 0.00 0.00 56.01 55.16 1um7 n LEU 72 Cb 0.35 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1um7 n LEU 72 CO 0.76 0.60 0.43 0.54 -1.33 0.00 0.00 177.39 178.39 1um7 n ARG 73 N 1.32 0.00 -1.43 3.23 1.74 -0.99 -0.33 116.66 120.20 1um7 n ARG 73 Ca 0.16 0.85 -0.36 0.00 -0.77 0.00 0.00 57.85 57.73 1um7 n ARG 73 Cb 0.57 -1.30 0.07 0.00 -1.02 0.00 0.00 32.46 30.78 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 -2.75 7.67 -4.89 0.55 5.03 -1.26 -4.23 115.26 115.38 1um7 n ASN 74 Ca 0.00 -3.80 -0.35 0.00 0.87 0.00 0.00 54.58 51.30 1um7 n ASN 74 Cb 0.00 -0.99 -0.06 0.00 -1.02 0.00 0.00 39.78 37.72 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 -3.87 3.90 0.73 5.41 0.00 0.55 -4.87 121.76 123.62 1um7 s ALA 75 Ca 0.63 -0.69 -0.11 0.00 0.00 0.00 0.00 51.96 51.78 1um7 s ALA 75 Cb 0.50 -1.92 0.03 0.00 0.00 0.00 0.00 23.12 21.72 1um7 s ALA 75 CO -0.07 0.67 1.08 0.95 0.00 0.00 0.00 175.76 178.39 1um7 s THR 76 N -1.15 3.60 0.21 0.00 -4.23 -1.26 -4.44 115.64 108.37 1um7 s THR 76 Ca 0.20 0.52 -0.15 0.00 -1.18 0.00 0.00 61.69 61.08 1um7 s THR 76 Cb -0.12 -3.34 0.23 0.00 1.34 0.00 0.00 72.50 70.60 1um7 s THR 76 CO 0.10 -0.68 1.61 -0.74 -0.54 0.00 0.00 174.62 174.37 1um7 h HIS 77 N -0.81 -0.50 -0.10 3.99 2.76 -1.81 0.58 115.15 119.26 1um7 h HIS 77 Ca -0.45 0.06 -0.00 0.00 -2.20 0.00 0.00 60.37 57.78 1um7 h HIS 77 Cb 1.24 0.32 -0.00 0.00 1.55 0.00 0.00 27.41 30.52 1um7 h HIS 77 CO 0.54 -0.32 0.06 1.49 -1.30 0.00 0.00 177.93 178.40 1um7 h GLU 78 N -0.05 0.14 -0.94 5.26 4.81 -1.93 -1.16 114.58 120.71 1um7 h GLU 78 Ca 0.30 -0.01 0.12 0.00 -0.13 0.00 0.00 59.36 59.64 1um7 h GLU 78 Cb 0.51 -0.03 -0.08 0.00 0.63 0.00 0.00 28.75 29.78 1um7 h GLU 78 CO -0.69 0.12 0.57 1.96 -0.73 0.00 0.00 179.01 180.24 1um7 h GLN 79 N 0.11 0.86 -0.02 1.92 4.20 -1.21 1.32 115.11 122.29 1um7 h GLN 79 Ca 0.04 -0.05 -0.07 0.00 0.06 0.00 0.00 58.65 58.63 1um7 h GLN 79 Cb 0.02 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.59 1um7 h GLN 79 CO -0.01 0.57 -0.30 0.00 -0.67 0.00 0.00 178.83 178.43 1um7 h ALA 80 N 1.53 1.47 0.11 3.87 0.00 0.58 -1.52 119.26 125.29 1um7 h ALA 80 Ca 0.48 -0.28 -0.15 0.00 0.00 0.00 0.00 54.91 54.95 1um7 h ALA 80 Cb 0.51 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 18.26 1um7 h ALA 80 CO -0.28 0.40 -0.66 0.00 0.00 0.00 0.00 179.25 178.71 1um7 h ALA 81 N 1.67 -0.07 -0.32 0.00 0.00 0.92 -3.22 119.26 118.25 1um7 h ALA 81 Ca 0.00 -0.66 0.09 0.00 0.00 0.00 0.00 54.91 54.35 1um7 h ALA 81 Cb 0.55 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 1um7 h ALA 81 CO 0.04 0.30 0.28 0.00 0.00 0.00 0.00 179.25 179.88 1um7 h ALA 82 N 0.08 2.10 0.00 0.00 0.00 0.17 1.23 119.26 122.84 1um7 h ALA 82 Ca -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.79 1um7 h ALA 82 Cb 1.51 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1um7 h ALA 82 CO 0.12 -0.44 0.00 0.00 0.00 0.00 0.00 179.25 178.93 1um7 h ALA 83 N 1.73 1.00 0.01 0.00 0.00 -1.29 -1.79 119.26 118.93 1um7 h ALA 83 Ca 0.15 0.00 -0.35 0.00 0.00 0.00 0.00 54.91 54.71 1um7 h ALA 83 Cb 0.71 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.44 1um7 h ALA 83 CO -0.00 0.00 -2.20 1.28 0.00 0.00 0.00 179.25 178.33 1um7 n LEU 84 N -2.98 0.89 0.22 0.00 4.77 0.39 -3.33 117.00 116.96 1um7 n LEU 84 Ca 0.02 0.10 0.15 0.00 -0.03 0.00 0.00 56.01 56.25 1um7 n LEU 84 Cb 0.34 0.07 0.59 0.00 -2.33 0.00 0.00 43.42 42.10 1um7 n LEU 84 CO 0.28 0.57 0.94 0.11 -1.33 0.00 0.00 177.39 177.95 1um7 h LYS 85 N 0.01 0.00 0.00 3.23 6.56 -0.33 -2.33 116.57 123.71 1um7 h LYS 85 Ca -0.48 0.00 -0.06 0.00 -1.06 0.00 0.00 60.65 59.05 1um7 h LYS 85 Cb 2.12 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 33.77 1um7 h LYS 85 CO 0.03 0.00 -1.58 2.89 -2.06 0.00 0.00 179.45 178.73 1um7 n ARG 86 N -2.79 0.64 0.00 3.15 1.85 -0.69 -4.89 116.66 113.93 1um7 n ARG 86 Ca 0.01 0.01 0.00 0.00 -1.00 0.00 0.00 57.85 56.87 1um7 n ARG 86 Cb 0.29 -1.68 0.00 0.00 -1.05 0.00 0.00 32.46 30.02 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 -2.30 0.00 -2.98 2.89 0.00 -0.88 -5.08 120.51 112.15 1um7 n ALA 87 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.38 1um7 n ALA 87 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 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 0.45 1.06 0.16 0.00 0.00 -1.26 -5.01 105.19 100.59 1um7 n GLY 88 Ca 0.00 -0.15 -0.11 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 -0.17 -4.53 1.61 1.08 -1.92 -3.38 115.11 107.80 1um7 h GLN 89 Ca 0.00 0.01 -0.71 0.00 -1.45 0.00 0.00 58.65 56.50 1um7 h GLN 89 Cb 0.00 0.04 -0.23 0.00 -0.05 0.00 0.00 27.48 27.24 1um7 h GLN 89 CO 0.00 -0.11 -0.47 -1.54 -0.95 0.00 0.00 178.83 175.75 1um7 s SER 90 N -5.05 5.89 -0.09 1.46 1.04 -1.26 -1.77 113.70 113.92 1um7 s SER 90 Ca -0.14 -1.01 0.04 0.00 0.48 0.00 0.00 55.95 55.32 1um7 s SER 90 Cb 0.08 -2.08 -0.00 0.00 0.10 0.00 0.00 66.02 64.12 1um7 s SER 90 CO 0.67 -0.43 -0.23 -0.69 0.98 0.00 0.00 173.24 173.54 1um7 s VAL 91 N 1.60 1.93 -0.54 5.02 1.01 -1.07 -5.02 120.40 123.32 1um7 s VAL 91 Ca 0.03 -0.95 -0.17 0.00 0.00 0.00 0.00 61.98 60.89 1um7 s VAL 91 Cb -0.20 -1.67 0.11 0.00 0.00 0.00 0.00 36.38 34.62 1um7 s VAL 91 CO 0.08 0.53 0.56 -0.89 0.00 0.00 0.00 175.10 175.38 1um7 s THR 92 N 0.29 5.06 -0.35 3.92 2.01 -1.26 -1.64 115.64 123.67 1um7 s THR 92 Ca -0.15 -1.19 -0.15 0.00 0.31 0.00 0.00 61.69 60.50 1um7 s THR 92 Cb -0.17 -4.35 -0.01 0.00 0.01 0.00 0.00 72.50 67.98 1um7 s THR 92 CO 0.07 -0.90 0.37 -0.63 -0.69 0.00 0.00 174.62 172.84 1um7 s ILE 93 N 2.04 5.16 -0.49 1.82 1.09 0.49 0.85 121.20 132.16 1um7 s ILE 93 Ca 0.07 0.03 -0.13 0.00 -1.10 0.00 0.00 60.65 59.51 1um7 s ILE 93 Cb -0.26 -3.83 0.11 0.00 -1.06 0.00 0.00 42.46 37.41 1um7 s ILE 93 CO 0.05 -0.11 0.40 -0.69 -0.10 0.00 0.00 174.94 174.50 1um7 s VAL 94 N 2.02 4.81 0.10 2.92 1.01 -0.28 -0.63 120.40 130.36 1um7 s VAL 94 Ca 0.12 -1.48 0.06 0.00 0.00 0.00 0.00 61.98 60.68 1um7 s VAL 94 Cb -0.17 -4.04 -0.03 0.00 0.00 0.00 0.00 36.38 32.14 1um7 s VAL 94 CO 0.12 -0.74 -0.15 0.00 0.00 0.00 0.00 175.10 174.33 1um7 s ALA 95 N 1.52 1.42 -0.16 5.51 0.00 -0.95 0.20 121.76 129.30 1um7 s ALA 95 Ca 0.04 -1.19 -0.02 0.00 0.00 0.00 0.00 51.96 50.78 1um7 s ALA 95 Cb -0.27 -0.10 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 1um7 s ALA 95 CO 0.03 0.15 -0.07 1.14 0.00 0.00 0.00 175.76 177.00 1um7 s GLN 96 N -2.30 3.48 -0.78 0.00 -2.07 0.26 -0.77 119.66 117.47 1um7 s GLN 96 Ca 0.05 -0.61 -0.25 0.00 -1.82 0.00 0.00 55.36 52.72 1um7 s GLN 96 Cb -0.07 -2.84 -0.14 0.00 -1.09 0.00 0.00 33.01 28.87 1um7 s GLN 96 CO 0.03 0.10 2.41 0.98 -1.32 0.00 0.00 175.29 177.49 1um7 n TYR 97 N 3.90 1.14 -3.78 9.60 4.19 -1.25 -0.50 117.16 130.46 1um7 n TYR 97 Ca -0.18 -0.01 -0.28 0.00 3.31 0.00 0.00 57.90 60.74 1um7 n TYR 97 Cb 0.52 -2.56 -0.12 0.00 0.49 0.00 0.00 39.34 37.68 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 8.84 1.95 0.50 2.98 6.06 -1.21 -4.85 118.95 133.22 1um7 s ARG 98 Ca 0.95 -2.86 0.28 0.00 -2.50 0.00 0.00 55.73 51.61 1um7 s ARG 98 Cb -0.16 -2.87 0.87 0.00 0.06 0.00 0.00 34.95 32.85 1um7 s ARG 98 CO 0.11 -1.27 1.80 -1.00 -2.50 0.00 0.00 175.30 172.44 1um7 h PRO 99 N 5.73 0.00 -0.56 5.12 0.13 -1.88 -3.06 132.00 137.47 1um7 h PRO 99 Ca 0.13 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 65.23 1um7 h PRO 99 Cb 0.82 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.92 1um7 h PRO 99 CO 0.62 0.00 0.23 1.49 -0.23 0.00 0.00 178.00 180.11 1um7 h GLU 100 N 0.00 0.81 0.03 0.86 4.81 -1.90 -1.94 114.58 117.25 1um7 h GLU 100 Ca -0.00 -0.12 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 1um7 h GLU 100 Cb 0.75 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 29.99 1um7 h GLU 100 CO 0.00 0.66 -0.01 0.93 -0.73 0.00 0.00 179.01 179.86 1um7 h GLU 101 N 0.80 -0.04 -1.59 1.92 4.39 -1.88 -3.29 114.58 114.91 1um7 h GLU 101 Ca 0.19 0.00 0.46 0.00 0.34 0.00 0.00 59.36 60.36 1um7 h GLU 101 Cb 0.15 0.01 -0.06 0.00 -0.10 0.00 0.00 28.75 28.74 1um7 h GLU 101 CO -0.02 -0.02 1.29 0.98 -1.16 0.00 0.00 179.01 180.07 1um7 n TYR 102 N -2.48 0.00 -0.31 4.33 9.36 -1.20 -0.08 117.16 126.78 1um7 n TYR 102 Ca -0.00 0.00 0.24 0.00 3.32 0.00 0.00 57.90 61.45 1um7 n TYR 102 Cb 0.01 -0.40 0.45 0.00 -0.63 0.00 0.00 39.34 38.77 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 -3.59 0.16 0.01 2.98 2.88 -0.73 0.13 113.62 115.46 1um7 n SER 103 Ca 0.36 1.57 -0.10 0.00 -1.33 0.00 0.00 58.87 59.37 1um7 n SER 103 Cb 1.76 -0.69 -0.03 0.00 -0.75 0.00 0.00 64.21 64.50 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 -0.72 -1.92 114.38 112.70 1um7 h ARG 104 Ca 0.71 0.02 -0.12 0.00 0.07 0.00 0.00 59.98 60.66 1um7 h ARG 104 Cb 1.75 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.85 1um7 h ARG 104 CO -0.78 -0.19 -0.24 0.74 -1.07 0.00 0.00 179.97 178.43 1um7 h PHE 105 N -0.29 0.89 -0.89 3.04 -1.00 0.94 -3.20 116.94 116.43 1um7 h PHE 105 Ca 0.10 -0.21 0.11 0.00 2.81 0.00 0.00 57.97 60.78 1um7 h PHE 105 Cb 0.43 -0.21 -0.13 0.00 3.61 0.00 0.00 35.95 39.65 1um7 h PHE 105 CO -0.32 0.94 -0.48 0.93 -1.61 0.00 0.00 178.31 177.77 1um7 h GLU 106 N 0.67 -0.06 -0.45 1.51 4.39 0.38 0.18 114.58 121.21 1um7 h GLU 106 Ca 0.09 0.00 0.08 0.00 0.34 0.00 0.00 59.36 59.88 1um7 h GLU 106 Cb 0.75 0.01 -0.10 0.00 -0.10 0.00 0.00 28.75 29.32 1um7 h GLU 106 CO 0.06 -0.04 -0.37 1.03 -1.16 0.00 0.00 179.01 178.53 1um7 h SER 107 N -0.06 -1.25 -1.11 1.42 0.87 -1.48 -3.36 113.55 108.57 1um7 h SER 107 Ca 0.23 0.21 -0.52 0.00 -1.23 0.00 0.00 61.79 60.48 1um7 h SER 107 Cb 0.52 0.57 -0.02 0.00 -0.44 0.00 0.00 62.40 63.03 1um7 h SER 107 CO -0.89 -0.34 1.62 -1.20 -0.53 0.00 0.00 176.83 175.49 1um7 n SER 108 N -5.42 1.81 -1.12 6.23 7.64 0.64 -4.88 113.62 118.52 1um7 n SER 108 Ca 0.01 -0.11 0.00 0.00 1.01 0.00 0.00 58.87 59.78 1um7 n SER 108 Cb 0.35 -1.35 0.00 0.00 -1.01 0.00 0.00 64.21 62.20 1um7 n SER 108 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1um7 n GLY 109 N 6.23 4.77 2.49 0.23 0.00 -1.26 -4.97 105.19 112.68 1um7 n GLY 109 Ca 0.45 -2.12 -0.29 0.00 0.00 0.00 0.00 46.02 44.05 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 -0.15 2.76 -2.91 1.61 -0.04 -1.26 -4.85 135.00 130.15 1um7 n PRO 110 Ca 0.00 -1.78 -0.43 0.00 -0.04 0.00 0.00 63.50 61.25 1um7 n PRO 110 Cb 0.00 -2.61 -0.05 0.00 -0.04 0.00 0.00 33.50 30.80 1um7 n PRO 110 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1um7 s SER 111 N 2.91 6.29 -0.18 3.54 0.01 -1.26 -4.85 113.70 120.16 1um7 s SER 111 Ca 0.52 -0.56 -0.17 0.00 1.31 0.00 0.00 55.95 57.06 1um7 s SER 111 Cb 0.13 -2.40 -0.07 0.00 0.21 0.00 0.00 66.02 63.90 1um7 s SER 111 CO -0.04 -1.17 -0.34 -1.20 0.41 0.00 0.00 173.24 170.89 1um7 n SER 112 N 7.19 1.91 0.00 2.44 7.64 -1.26 -5.23 113.62 126.30 1um7 n SER 112 Ca -0.01 0.32 0.00 0.00 1.01 0.00 0.00 58.87 60.20 1um7 n SER 112 Cb 0.47 -0.73 0.00 0.00 -1.01 0.00 0.00 64.21 62.93 1um7 n SER 112 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64