#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1v88 s SER 2 N 0.00 -0.13 -0.29 1.61 0.15 -1.26 -5.14 113.70 108.63 1v88 s SER 2 Ca 0.00 0.25 -0.16 0.00 0.70 0.00 0.00 55.95 56.74 1v88 s SER 2 Cb 0.00 0.37 0.18 0.00 -1.71 0.00 0.00 66.02 64.85 1v88 s SER 2 CO 0.00 -0.04 1.12 -0.55 1.20 0.00 0.00 173.24 174.96 1v88 s SER 3 N 0.21 -0.29 0.00 5.45 0.15 -1.26 -5.10 113.70 112.86 1v88 s SER 3 Ca 0.05 0.46 0.00 0.00 0.70 0.00 0.00 55.95 57.16 1v88 s SER 3 Cb -0.05 1.14 0.00 0.00 -1.71 0.00 0.00 66.02 65.41 1v88 s SER 3 CO -0.13 -0.07 0.00 0.61 1.20 0.00 0.00 173.24 174.84 1v88 n GLY 4 N 3.53 -1.86 3.38 9.45 0.00 -1.26 -5.02 105.19 113.42 1v88 n GLY 4 Ca -0.17 0.84 -0.31 0.00 0.00 0.00 0.00 46.02 46.38 1v88 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1v88 n SER 5 N 0.00 -1.98 -1.10 1.61 7.64 -1.26 -4.78 113.62 113.74 1v88 n SER 5 Ca 0.00 -0.06 0.14 0.00 1.01 0.00 0.00 58.87 59.95 1v88 n SER 5 Cb 0.00 -1.12 -0.07 0.00 -1.01 0.00 0.00 64.21 62.01 1v88 n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1v88 n SER 6 N -2.93 -6.15 0.15 6.43 7.64 -1.26 -4.55 113.62 112.94 1v88 n SER 6 Ca 0.03 1.02 -0.16 0.00 1.01 0.00 0.00 58.87 60.77 1v88 n SER 6 Cb 0.58 -3.73 -0.10 0.00 -1.01 0.00 0.00 64.21 59.96 1v88 n SER 6 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1v88 h GLY 7 N -1.08 -1.19 -3.75 0.23 0.00 -2.00 -3.42 103.07 91.87 1v88 h GLY 7 Ca -0.13 0.63 -0.60 0.00 0.00 0.00 0.00 47.33 47.23 1v88 h GLY 7 CO 0.05 -0.30 -0.39 1.39 0.00 0.00 0.00 176.54 177.29 1v88 n ILE 8 N -5.37 1.86 -0.04 2.60 -0.00 -1.26 -4.13 119.36 113.00 1v88 n ILE 8 Ca -0.09 -0.50 -0.02 0.00 -0.00 0.00 0.00 62.75 62.14 1v88 n ILE 8 Cb 0.41 -0.59 -0.01 0.00 -0.00 0.00 0.00 39.64 39.45 1v88 n ILE 8 CO 0.00 0.00 0.00 0.58 -0.00 0.00 0.00 176.55 177.13 1v88 h VAL 9 N 0.68 0.00 -2.53 1.39 2.07 0.85 -3.43 116.25 115.28 1v88 h VAL 9 Ca -0.42 -0.72 0.01 0.00 0.82 0.00 0.00 66.70 66.39 1v88 h VAL 9 Cb 1.40 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 31.02 1v88 h VAL 9 CO 0.50 0.00 0.29 0.00 0.02 0.00 0.00 177.57 178.39 1v88 s MET 10 N -1.68 1.08 -0.03 1.57 0.23 -0.87 -4.69 119.30 114.91 1v88 s MET 10 Ca -0.06 -0.24 -0.00 0.00 -1.03 0.00 0.00 55.69 54.36 1v88 s MET 10 Cb 0.01 0.50 0.03 0.00 -1.53 0.00 0.00 34.83 33.84 1v88 s MET 10 CO 0.09 -0.44 0.02 0.00 -2.03 0.00 0.00 175.02 172.66 1v88 s ALA 11 N -2.88 0.26 0.26 3.16 0.00 -1.26 0.20 121.76 121.50 1v88 s ALA 11 Ca -0.01 0.19 -0.16 0.00 0.00 0.00 0.00 51.96 51.98 1v88 s ALA 11 Cb -0.01 -0.37 0.01 0.00 0.00 0.00 0.00 23.12 22.75 1v88 s ALA 11 CO -0.06 -0.17 0.59 0.34 0.00 0.00 0.00 175.76 176.46 1v88 s ASP 12 N 1.27 -0.16 -0.51 0.00 -1.08 -1.11 -5.03 116.67 110.05 1v88 s ASP 12 Ca -0.06 -0.80 -0.22 0.00 -0.52 0.00 0.00 52.55 50.95 1v88 s ASP 12 Cb -0.13 0.65 0.04 0.00 -1.46 0.00 0.00 42.92 42.02 1v88 s ASP 12 CO -0.03 -1.24 0.79 0.26 0.52 0.00 0.00 175.17 175.47 1v88 s TRP 13 N -3.95 2.93 0.02 -5.34 0.52 -1.26 -2.79 118.94 109.07 1v88 s TRP 13 Ca 0.17 -0.14 0.03 0.00 0.02 0.00 0.00 56.10 56.19 1v88 s TRP 13 Cb -0.03 -3.76 -0.04 0.00 -1.15 0.00 0.00 33.47 28.49 1v88 s TRP 13 CO 0.08 -1.14 -0.04 -0.51 0.02 0.00 0.00 176.95 175.36 1v88 s LEU 14 N 3.32 3.29 -0.15 2.99 1.43 -1.10 -4.55 118.68 123.91 1v88 s LEU 14 Ca 0.25 -0.13 -0.12 0.00 -1.03 0.00 0.00 54.13 53.10 1v88 s LEU 14 Cb -0.15 -1.92 -0.05 0.00 0.03 0.00 0.00 46.19 44.10 1v88 s LEU 14 CO 0.18 0.26 0.25 -0.54 0.23 0.00 0.00 176.35 176.73 1v88 s LYS 15 N -1.64 4.14 0.03 1.70 1.02 0.55 -2.22 119.74 123.33 1v88 s LYS 15 Ca 0.19 0.03 0.01 0.00 0.02 0.00 0.00 55.97 56.22 1v88 s LYS 15 Cb -0.11 -3.39 -0.04 0.00 -0.52 0.00 0.00 37.83 33.77 1v88 s LYS 15 CO 0.10 0.33 0.10 0.42 -0.92 0.00 0.00 175.35 175.39 1v88 s ILE 16 N 0.20 4.79 0.33 2.17 1.09 0.62 0.61 121.20 131.01 1v88 s ILE 16 Ca 0.15 -0.52 -0.23 0.00 -1.10 0.00 0.00 60.65 58.95 1v88 s ILE 16 Cb -0.13 -3.26 -0.16 0.00 -1.06 0.00 0.00 42.46 37.86 1v88 s ILE 16 CO 0.03 0.24 0.22 -1.14 -0.10 0.00 0.00 174.94 174.19 1v88 n ARG 17 N 0.78 0.00 -4.19 2.79 0.63 -1.26 -2.19 116.66 113.22 1v88 n ARG 17 Ca -0.10 0.00 -0.24 0.00 -0.92 0.00 0.00 57.85 56.59 1v88 n ARG 17 Cb 0.52 -0.99 -0.17 0.00 0.45 0.00 0.00 32.46 32.27 1v88 n ARG 17 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 1v88 s GLY 18 N -0.99 0.69 -0.01 5.14 0.00 -1.26 -4.49 107.32 106.40 1v88 s GLY 18 Ca 0.60 -0.34 0.07 0.00 0.00 0.00 0.00 44.72 45.05 1v88 s GLY 18 CO 0.60 0.51 0.17 -1.30 0.00 0.00 0.00 173.10 173.08 1v88 n THR 19 N 4.35 0.00 0.00 0.90 -2.24 -1.26 -4.62 114.28 111.41 1v88 n THR 19 Ca -0.19 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1v88 n THR 19 Cb 0.51 0.49 0.00 0.00 -2.10 0.00 0.00 70.33 69.23 1v88 n THR 19 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1v88 n LEU 20 N -1.61 0.00 -0.09 3.22 7.99 -1.26 -4.91 117.00 120.35 1v88 n LEU 20 Ca -0.01 0.00 -0.14 0.00 -0.01 0.00 0.00 56.01 55.86 1v88 n LEU 20 Cb 0.16 0.00 -0.07 0.00 -0.11 0.00 0.00 43.42 43.40 1v88 n LEU 20 CO 0.14 0.00 -0.44 0.11 -1.51 0.00 0.00 177.39 175.69 1v88 h LYS 21 N 0.00 0.00 -2.80 3.23 1.79 -2.02 -3.50 116.57 113.27 1v88 h LYS 21 Ca 0.00 0.00 0.06 0.00 -2.18 0.00 0.00 60.65 58.53 1v88 h LYS 21 Cb 0.00 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.64 1v88 h LYS 21 CO 0.00 0.53 0.41 0.45 -1.08 0.00 0.00 179.45 179.76 1v88 s SER 22 N -6.33 0.01 0.71 0.86 0.15 -1.26 -5.09 113.70 102.75 1v88 s SER 22 Ca -0.22 -0.96 -0.16 0.00 0.70 0.00 0.00 55.95 55.31 1v88 s SER 22 Cb 0.04 0.70 0.03 0.00 -1.71 0.00 0.00 66.02 65.08 1v88 s SER 22 CO 0.41 -1.40 1.22 0.26 1.20 0.00 0.00 173.24 174.94 1v88 s TRP 23 N -2.19 2.07 -0.09 3.44 0.52 -1.26 -4.44 118.94 116.98 1v88 s TRP 23 Ca 0.19 1.58 0.00 0.00 0.02 0.00 0.00 56.10 57.88 1v88 s TRP 23 Cb -0.04 -3.51 -0.03 0.00 -1.15 0.00 0.00 33.47 28.74 1v88 s TRP 23 CO 0.09 -2.65 -0.08 0.99 0.02 0.00 0.00 176.95 175.32 1v88 s THR 24 N -1.86 3.55 -0.72 2.01 2.01 -0.93 -4.90 115.64 114.79 1v88 s THR 24 Ca 0.76 -0.52 -0.14 0.00 0.31 0.00 0.00 61.69 62.11 1v88 s THR 24 Cb -0.31 -2.47 0.19 0.00 0.01 0.00 0.00 72.50 69.92 1v88 s THR 24 CO 0.44 0.56 0.66 -0.75 -0.69 0.00 0.00 174.62 174.84 1v88 s LYS 25 N -0.35 3.34 0.48 4.92 2.20 -1.26 -0.28 119.74 128.79 1v88 s LYS 25 Ca 0.05 -2.23 0.07 0.00 -0.36 0.00 0.00 55.97 53.50 1v88 s LYS 25 Cb -0.12 -4.34 0.03 0.00 -1.51 0.00 0.00 37.83 31.89 1v88 s LYS 25 CO 0.02 -1.29 0.65 -0.51 -0.36 0.00 0.00 175.35 173.87 1v88 s LEU 26 N 0.60 3.48 -0.69 5.43 1.43 -0.94 -4.91 118.68 123.08 1v88 s LEU 26 Ca 0.13 -0.41 -0.17 0.00 -1.03 0.00 0.00 54.13 52.65 1v88 s LEU 26 Cb -0.17 -2.51 0.15 0.00 0.03 0.00 0.00 46.19 43.68 1v88 s LEU 26 CO -0.05 -0.95 0.73 0.86 0.23 0.00 0.00 176.35 177.17 1v88 s TRP 27 N -2.50 3.29 -0.08 0.29 -0.11 0.49 -2.69 118.94 117.62 1v88 s TRP 27 Ca 0.57 -1.38 -0.22 0.00 1.22 0.00 0.00 56.10 56.29 1v88 s TRP 27 Cb -0.09 -3.95 -0.04 0.00 -1.50 0.00 0.00 33.47 27.89 1v88 s TRP 27 CO 0.35 -1.17 0.62 0.00 -4.62 0.00 0.00 176.95 172.13 1v88 s VAL 29 N 0.69 3.07 -0.13 0.00 1.01 0.61 -2.74 120.40 122.91 1v88 s VAL 29 Ca 0.33 -0.70 -0.25 0.00 0.00 0.00 0.00 61.98 61.37 1v88 s VAL 29 Cb -0.17 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 1v88 s VAL 29 CO 0.16 0.37 0.78 -0.22 0.00 0.00 0.00 175.10 176.19 1v88 s LEU 30 N 1.41 4.23 0.46 3.92 0.20 0.54 0.56 118.68 129.99 1v88 s LEU 30 Ca 0.04 1.18 0.04 0.00 0.69 0.00 0.00 54.13 56.08 1v88 s LEU 30 Cb -0.15 -3.18 -0.05 0.00 -0.43 0.00 0.00 46.19 42.39 1v88 s LEU 30 CO -0.05 -0.30 0.03 -0.54 -0.29 0.00 0.00 176.35 175.20 1v88 s LYS 31 N 1.66 2.08 -1.04 1.98 1.02 0.33 0.13 119.74 125.91 1v88 s LYS 31 Ca 0.38 -2.22 -0.23 0.00 0.02 0.00 0.00 55.97 53.92 1v88 s LYS 31 Cb -0.17 -1.63 -0.00 0.00 -0.52 0.00 0.00 37.83 35.51 1v88 s LYS 31 CO 0.15 -0.20 1.73 -1.25 -0.92 0.00 0.00 175.35 174.86 1v88 s PRO 32 N -3.81 3.13 0.00 -1.68 0.04 -1.26 -2.87 135.00 128.56 1v88 s PRO 32 Ca 0.23 -0.97 0.00 0.00 0.04 0.00 0.00 61.00 60.30 1v88 s PRO 32 Cb 0.06 -5.27 0.00 0.00 0.04 0.00 0.00 34.50 29.33 1v88 s PRO 32 CO 0.12 -2.87 0.00 0.41 0.04 0.00 0.00 177.00 174.70 1v88 n GLY 33 N 6.51 0.84 3.53 0.56 0.00 -1.22 -4.97 105.19 110.44 1v88 n GLY 33 Ca 0.39 -0.62 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 1v88 n GLY 33 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1v88 s VAL 34 N -2.00 0.00 -0.00 1.61 -7.23 -1.14 -3.47 120.40 108.17 1v88 s VAL 34 Ca 0.00 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.17 1v88 s VAL 34 Cb 0.00 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.94 1v88 s VAL 34 CO 0.00 0.00 -0.01 -0.22 -0.31 0.00 0.00 175.10 174.56 1v88 s LEU 35 N -2.03 1.95 0.22 1.32 2.96 0.21 0.12 118.68 123.43 1v88 s LEU 35 Ca 0.02 -0.02 0.12 0.00 -0.22 0.00 0.00 54.13 54.02 1v88 s LEU 35 Cb -0.01 -0.08 -0.05 0.00 0.50 0.00 0.00 46.19 46.56 1v88 s LEU 35 CO -0.05 0.01 -0.23 -0.76 -1.32 0.00 0.00 176.35 174.00 1v88 s LEU 36 N 0.03 2.48 -0.05 -0.68 1.02 0.19 0.14 118.68 121.82 1v88 s LEU 36 Ca -0.00 -0.92 -0.00 0.00 0.02 0.00 0.00 54.13 53.23 1v88 s LEU 36 Cb -0.01 -1.14 0.03 0.00 0.02 0.00 0.00 46.19 45.08 1v88 s LEU 36 CO -0.00 0.09 -0.00 -0.63 0.02 0.00 0.00 176.35 175.83 1v88 s ILE 37 N -1.95 0.29 0.07 -0.59 1.09 -0.30 0.23 121.20 120.04 1v88 s ILE 37 Ca 0.24 0.08 0.09 0.00 -1.10 0.00 0.00 60.65 59.95 1v88 s ILE 37 Cb -0.07 -0.40 -0.03 0.00 -1.06 0.00 0.00 42.46 40.90 1v88 s ILE 37 CO 0.11 0.20 -0.24 -0.31 -0.10 0.00 0.00 174.94 174.60 1v88 s TYR 38 N 1.38 2.09 0.13 3.97 1.51 0.30 0.27 117.35 127.00 1v88 s TYR 38 Ca -0.04 -0.40 -0.20 0.00 -1.01 0.00 0.00 57.07 55.42 1v88 s TYR 38 Cb -0.13 -1.21 -0.01 0.00 -0.11 0.00 0.00 41.96 40.49 1v88 s TYR 38 CO -0.02 0.17 1.70 0.87 -1.11 0.00 0.00 175.55 177.15 1v88 h LYS 39 N 4.54 -0.01 -4.03 -0.62 1.57 -1.86 1.42 116.57 117.58 1v88 h LYS 39 Ca -0.46 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.19 1v88 h LYS 39 Cb 1.16 0.00 -0.13 0.00 0.08 0.00 0.00 32.23 33.34 1v88 h LYS 39 CO 0.42 -0.01 -0.38 -0.08 -0.57 0.00 0.00 179.45 178.83 1v88 s THR 40 N -6.20 0.05 -0.09 -0.16 -1.32 -1.26 -4.18 115.64 102.48 1v88 s THR 40 Ca -0.14 -1.55 0.13 0.00 -1.21 0.00 0.00 61.69 58.92 1v88 s THR 40 Cb 0.11 -2.01 -0.01 0.00 -1.51 0.00 0.00 72.50 69.08 1v88 s THR 40 CO 0.69 -0.24 1.38 -0.61 -2.21 0.00 0.00 174.62 173.63 1v88 h GLN 41 N 2.57 0.00 0.00 7.08 -0.00 -1.96 -3.03 115.11 119.77 1v88 h GLN 41 Ca -0.32 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.33 1v88 h GLN 41 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 27.48 28.71 1v88 h GLN 41 CO 0.49 0.62 0.00 1.17 0.00 0.00 0.00 178.83 181.11 1v88 n LYS 42 N -3.25 0.00 -1.23 1.69 0.00 -1.26 -4.34 118.16 109.77 1v88 n LYS 42 Ca 0.01 0.10 -0.24 0.00 0.00 0.00 0.00 58.31 58.18 1v88 n LYS 42 Cb 0.79 -0.52 -0.10 0.00 0.00 0.00 0.00 35.03 35.20 1v88 n LYS 42 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1v88 n ASN 43 N -1.04 6.68 -4.55 3.14 2.85 -1.26 -4.88 115.26 116.20 1v88 n ASN 43 Ca 0.00 -2.65 -0.19 0.00 -0.11 0.00 0.00 54.58 51.63 1v88 n ASN 43 Cb 0.00 -1.43 -0.09 0.00 1.24 0.00 0.00 39.78 39.49 1v88 n ASN 43 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1v88 n GLY 44 N 2.57 -0.17 0.29 8.20 0.00 -1.15 -4.40 105.19 110.53 1v88 n GLY 44 Ca 0.56 0.35 0.13 0.00 0.00 0.00 0.00 46.02 47.06 1v88 n GLY 44 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1v88 n GLN 45 N 8.28 1.02 -0.88 1.61 6.02 -1.26 -4.97 117.38 127.20 1v88 n GLN 45 Ca 0.50 -0.58 0.00 0.00 -0.01 0.00 0.00 57.00 56.91 1v88 n GLN 45 Cb 0.38 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.16 1v88 n GLN 45 CO 0.00 0.00 0.00 1.87 -1.01 0.00 0.00 177.06 177.92 1v88 n TRP 46 N -0.48 -2.41 0.00 1.08 -0.00 -1.26 -4.15 117.44 110.21 1v88 n TRP 46 Ca 0.14 1.30 0.00 0.00 -0.00 0.00 0.00 57.50 58.94 1v88 n TRP 46 Cb 0.34 -2.28 0.00 0.00 -0.00 0.00 0.00 31.31 29.37 1v88 n TRP 46 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 177.69 177.97 1v88 n VAL 47 N -1.81 0.00 -0.41 5.87 0.31 0.14 -2.86 118.33 119.57 1v88 n VAL 47 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1v88 n VAL 47 Cb 0.20 -0.96 0.00 0.00 -0.91 0.00 0.00 33.84 32.17 1v88 n VAL 47 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1v88 n GLY 48 N 2.81 -1.23 2.88 2.92 0.00 -1.06 -4.33 105.19 107.19 1v88 n GLY 48 Ca 0.00 -1.01 -0.14 0.00 0.00 0.00 0.00 46.02 44.87 1v88 n GLY 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1v88 s THR 49 N -2.13 0.14 -0.17 2.61 2.01 -1.26 -1.15 115.64 115.69 1v88 s THR 49 Ca 0.00 -0.04 -0.06 0.00 0.31 0.00 0.00 61.69 61.90 1v88 s THR 49 Cb 0.00 -0.15 -0.04 0.00 0.01 0.00 0.00 72.50 72.32 1v88 s THR 49 CO 0.00 0.06 0.04 -0.69 -0.69 0.00 0.00 174.62 173.34 1v88 s VAL 50 N 0.18 4.60 -0.15 3.82 1.01 0.38 -1.08 120.40 129.15 1v88 s VAL 50 Ca -0.01 -0.11 -0.15 0.00 0.00 0.00 0.00 61.98 61.71 1v88 s VAL 50 Cb -0.03 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 1v88 s VAL 50 CO -0.00 0.48 0.34 -0.76 0.00 0.00 0.00 175.10 175.16 1v88 s LEU 51 N 0.23 4.24 -0.47 3.92 1.43 -1.11 -0.62 118.68 126.30 1v88 s LEU 51 Ca 0.03 0.58 0.03 0.00 -1.03 0.00 0.00 54.13 53.73 1v88 s LEU 51 Cb -0.13 -2.46 0.46 0.00 0.03 0.00 0.00 46.19 44.10 1v88 s LEU 51 CO 0.01 0.06 1.63 0.18 0.23 0.00 0.00 176.35 178.46 1v88 n LEU 52 N 3.66 6.23 -0.34 1.79 4.77 -1.23 -4.57 117.00 127.32 1v88 n LEU 52 Ca -0.10 -4.43 0.30 0.00 -0.03 0.00 0.00 56.01 51.74 1v88 n LEU 52 Cb 0.52 -0.68 0.56 0.00 -2.33 0.00 0.00 43.42 41.49 1v88 n LEU 52 CO 0.41 1.72 1.09 0.78 -1.33 0.00 0.00 177.39 180.06 1v88 h ASN 53 N 1.98 0.38 0.00 -1.43 2.35 -1.90 -3.32 115.58 113.63 1v88 h ASN 53 Ca 0.48 0.23 -0.10 0.00 -0.55 0.00 0.00 56.30 56.35 1v88 h ASN 53 Cb 1.24 0.21 -0.11 0.00 0.05 0.00 0.00 38.32 39.72 1v88 h ASN 53 CO 1.14 -0.32 0.07 0.00 -1.65 0.00 0.00 177.43 176.66 1v88 n ALA 54 N -2.29 -3.12 -2.90 -0.83 0.00 -1.26 -5.00 120.51 105.11 1v88 n ALA 54 Ca 0.36 -0.42 -0.25 0.00 0.00 0.00 0.00 53.44 53.13 1v88 n ALA 54 Cb 1.20 -3.09 -0.03 0.00 0.00 0.00 0.00 19.45 17.53 1v88 n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1v88 s GLU 56 N -3.42 2.07 -0.03 0.00 -1.05 -1.01 -4.83 118.70 110.43 1v88 s GLU 56 Ca 0.35 -2.28 0.03 0.00 -0.15 0.00 0.00 54.97 52.93 1v88 s GLU 56 Cb -0.11 -1.33 -0.00 0.00 -0.44 0.00 0.00 34.13 32.25 1v88 s GLU 56 CO 0.29 -0.32 -0.12 0.42 0.95 0.00 0.00 175.26 176.48 1v88 s ILE 57 N -2.94 1.04 -0.06 1.83 1.09 -1.26 -3.15 121.20 117.74 1v88 s ILE 57 Ca 0.16 -0.51 0.05 0.00 -1.10 0.00 0.00 60.65 59.25 1v88 s ILE 57 Cb 0.04 -0.90 -0.08 0.00 -1.06 0.00 0.00 42.46 40.46 1v88 s ILE 57 CO 0.09 0.31 0.02 2.30 -0.10 0.00 0.00 174.94 177.55 1v88 n ILE 58 N 3.14 0.43 0.00 2.92 -5.35 -1.10 -5.02 119.36 114.38 1v88 n ILE 58 Ca -0.17 -0.26 0.00 0.00 -0.27 0.00 0.00 62.75 62.05 1v88 n ILE 58 Cb 0.54 -0.83 0.00 0.00 -1.74 0.00 0.00 39.64 37.61 1v88 n ILE 58 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1v88 n GLU 59 N -2.26 0.00 -2.74 6.28 2.13 -1.26 -4.92 120.64 117.86 1v88 n GLU 59 Ca -0.10 0.00 -0.05 0.00 0.66 0.00 0.00 57.16 57.66 1v88 n GLU 59 Cb 0.70 0.00 0.03 0.00 0.27 0.00 0.00 31.44 32.44 1v88 n GLU 59 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1v88 n ARG 60 N -0.47 0.55 0.00 5.31 1.74 0.32 -4.56 116.66 119.55 1v88 n ARG 60 Ca 0.00 -1.73 0.12 0.00 -0.77 0.00 0.00 57.85 55.47 1v88 n ARG 60 Cb 0.00 -1.24 0.63 0.00 -1.02 0.00 0.00 32.46 30.84 1v88 n ARG 60 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1v88 n PRO 61 N 2.37 0.51 -0.94 5.56 -0.04 -0.92 -3.49 135.00 138.05 1v88 n PRO 61 Ca 0.13 0.04 0.12 0.00 -0.04 0.00 0.00 63.50 63.75 1v88 n PRO 61 Cb 0.60 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.53 1v88 n PRO 61 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1v88 n SER 62 N -1.16 -5.17 -0.31 3.54 7.64 -1.26 -3.56 113.62 113.34 1v88 n SER 62 Ca 0.14 0.45 0.13 0.00 1.01 0.00 0.00 58.87 60.59 1v88 n SER 62 Cb 0.14 -3.05 0.30 0.00 -1.01 0.00 0.00 64.21 60.59 1v88 n SER 62 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1v88 h LYS 63 N -0.97 0.42 -1.62 1.43 3.11 -2.03 -3.41 116.57 113.50 1v88 h LYS 63 Ca -0.01 -0.03 0.09 0.00 -2.81 0.00 0.00 60.65 57.90 1v88 h LYS 63 Cb 1.21 -0.10 -0.26 0.00 -1.00 0.00 0.00 32.23 32.09 1v88 h LYS 63 CO 0.01 0.28 0.32 -1.59 -2.81 0.00 0.00 179.45 175.67 1v88 s LYS 64 N -5.89 0.45 0.00 1.90 0.00 -1.24 -5.09 119.74 109.87 1v88 s LYS 64 Ca -0.12 0.75 0.00 0.00 0.00 0.00 0.00 55.97 56.61 1v88 s LYS 64 Cb 0.25 0.10 0.00 0.00 0.00 0.00 0.00 37.83 38.18 1v88 s LYS 64 CO 0.78 -0.09 0.00 -0.25 0.00 0.00 0.00 175.35 175.79 1v88 n ASP 65 N 3.71 0.00 0.00 0.03 8.00 -1.23 -5.06 116.55 122.00 1v88 n ASP 65 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1v88 n ASP 65 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.68 1v88 n ASP 65 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1v88 n GLY 66 N 0.00 0.45 3.29 0.44 0.00 -1.26 -4.10 105.19 104.00 1v88 n GLY 66 Ca 0.00 0.42 0.03 0.00 0.00 0.00 0.00 46.02 46.47 1v88 n GLY 66 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1v88 s PHE 67 N 0.00 -0.56 0.15 1.61 2.19 -1.26 -4.60 117.98 115.50 1v88 s PHE 67 Ca 0.00 0.85 0.06 0.00 0.33 0.00 0.00 56.93 58.17 1v88 s PHE 67 Cb 0.00 0.29 -0.04 0.00 -1.31 0.00 0.00 43.02 41.96 1v88 s PHE 67 CO 0.00 -0.29 -0.12 0.00 1.83 0.00 0.00 175.22 176.64 1v88 n PHE 69 N -0.02 -0.50 -3.73 0.00 -1.74 -1.24 0.12 117.46 110.34 1v88 n PHE 69 Ca -0.11 -2.79 -0.18 0.00 -0.56 0.00 0.00 57.45 53.80 1v88 n PHE 69 Cb 0.59 0.20 -0.17 0.00 1.52 0.00 0.00 39.48 41.62 1v88 n PHE 69 CO 0.00 0.00 0.00 0.21 -0.56 0.00 0.00 176.76 176.41 1v88 s LYS 70 N -3.45 0.02 -0.26 3.97 2.36 -1.26 -3.64 119.74 117.48 1v88 s LYS 70 Ca 0.34 0.28 -0.03 0.00 -2.55 0.00 0.00 55.97 54.00 1v88 s LYS 70 Cb 0.02 -0.46 0.02 0.00 -1.05 0.00 0.00 37.83 36.35 1v88 s LYS 70 CO 0.24 -0.26 -0.02 -1.17 1.55 0.00 0.00 175.35 175.69 1v88 s LEU 71 N 1.73 3.36 0.38 5.43 0.20 -0.93 -2.70 118.68 126.15 1v88 s LEU 71 Ca -0.01 -0.79 0.07 0.00 0.69 0.00 0.00 54.13 54.10 1v88 s LEU 71 Cb -0.12 -1.73 -0.07 0.00 -0.43 0.00 0.00 46.19 43.83 1v88 s LEU 71 CO -0.03 -0.14 -0.01 0.72 -0.29 0.00 0.00 176.35 176.60 1v88 s PHE 72 N 1.39 2.43 -0.23 5.38 -0.12 -1.19 -1.31 117.98 124.33 1v88 s PHE 72 Ca 0.01 -0.66 -0.07 0.00 -0.05 0.00 0.00 56.93 56.17 1v88 s PHE 72 Cb -0.17 -1.62 -0.03 0.00 -0.63 0.00 0.00 43.02 40.57 1v88 s PHE 72 CO -0.02 0.44 0.05 -1.58 -0.05 0.00 0.00 175.22 174.05 1v88 s HIS 73 N -2.75 3.08 0.09 3.49 2.46 -1.11 -2.41 115.29 118.14 1v88 s HIS 73 Ca 0.34 -0.40 -0.13 0.00 0.47 0.00 0.00 55.06 55.34 1v88 s HIS 73 Cb 0.08 -2.19 -0.20 0.00 -0.13 0.00 0.00 32.58 30.14 1v88 s HIS 73 CO 0.17 -0.30 1.24 -1.00 -2.47 0.00 0.00 174.74 172.38 1v88 h PRO 74 N 7.94 0.74 -0.05 2.88 0.13 -1.95 -3.00 132.00 138.69 1v88 h PRO 74 Ca -0.38 -0.72 0.02 0.00 -0.87 0.00 0.00 66.00 64.05 1v88 h PRO 74 Cb 1.17 0.18 -0.00 0.00 0.13 0.00 0.00 31.00 32.49 1v88 h PRO 74 CO 0.60 1.30 0.22 -0.07 -0.23 0.00 0.00 178.00 179.81 1v88 h LEU 75 N 0.45 0.00 -2.04 1.56 4.07 -1.94 -3.45 115.31 113.96 1v88 h LEU 75 Ca -0.10 0.00 -0.20 0.00 0.08 0.00 0.00 57.88 57.66 1v88 h LEU 75 Cb 1.59 0.00 0.12 0.00 1.08 0.00 0.00 40.66 43.45 1v88 h LEU 75 CO 0.19 0.00 -0.52 -0.62 -1.08 0.00 0.00 178.44 176.41 1v88 n GLU 76 N -3.15 -3.45 0.00 1.13 1.02 -1.13 -5.00 120.64 110.06 1v88 n GLU 76 Ca -0.01 0.56 0.00 0.00 -0.02 0.00 0.00 57.16 57.69 1v88 n GLU 76 Cb 0.29 -4.59 0.00 0.00 -0.02 0.00 0.00 31.44 27.12 1v88 n GLU 76 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1v88 n GLN 77 N -2.91 0.00 -3.64 3.49 1.13 -1.26 -5.15 117.38 109.04 1v88 n GLN 77 Ca -0.15 0.00 -0.03 0.00 -1.94 0.00 0.00 57.00 54.89 1v88 n GLN 77 Cb 0.60 -0.01 -0.03 0.00 0.11 0.00 0.00 30.24 30.92 1v88 n GLN 77 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1v88 s SER 78 N 0.24 -0.04 -0.30 1.08 0.15 -1.26 -4.96 113.70 108.61 1v88 s SER 78 Ca 0.00 0.02 0.11 0.00 0.70 0.00 0.00 55.95 56.78 1v88 s SER 78 Cb 0.00 0.04 0.47 0.00 -1.71 0.00 0.00 66.02 64.82 1v88 s SER 78 CO 0.00 -0.06 1.15 2.30 1.20 0.00 0.00 173.24 177.83 1v88 n ILE 79 N 0.18 2.12 -4.04 6.45 -5.35 -1.04 -4.84 119.36 112.84 1v88 n ILE 79 Ca 0.02 -3.92 -0.14 0.00 -0.27 0.00 0.00 62.75 58.44 1v88 n ILE 79 Cb 0.57 -0.45 -0.14 0.00 -1.74 0.00 0.00 39.64 37.88 1v88 n ILE 79 CO 0.00 0.00 0.00 0.26 -1.76 0.00 0.00 176.55 175.05 1v88 s TRP 80 N -3.62 0.27 0.11 4.28 0.52 -1.26 -2.75 118.94 116.50 1v88 s TRP 80 Ca 0.44 -0.05 -0.25 0.00 0.02 0.00 0.00 56.10 56.25 1v88 s TRP 80 Cb 0.39 -0.18 -0.07 0.00 -1.15 0.00 0.00 33.47 32.46 1v88 s TRP 80 CO -0.01 -0.01 0.78 0.00 0.02 0.00 0.00 176.95 177.74 1v88 s ALA 81 N -0.06 3.41 0.25 0.98 0.00 -0.24 -4.64 121.76 121.45 1v88 s ALA 81 Ca 0.01 0.34 -0.06 0.00 0.00 0.00 0.00 51.96 52.25 1v88 s ALA 81 Cb -0.01 -2.99 0.26 0.00 0.00 0.00 0.00 23.12 20.38 1v88 s ALA 81 CO -0.00 0.18 1.92 -0.39 0.00 0.00 0.00 175.76 177.47 1v88 h VAL 82 N 3.69 1.24 -2.98 0.00 -1.51 -1.94 -3.45 116.25 111.30 1v88 h VAL 82 Ca -0.46 -0.45 0.00 0.00 -1.23 0.00 0.00 66.70 64.56 1v88 h VAL 82 Cb 1.21 -0.19 0.00 0.00 -2.13 0.00 0.00 31.29 30.18 1v88 h VAL 82 CO 0.68 0.24 0.00 2.29 -1.23 0.00 0.00 177.57 179.55 1v88 n LYS 83 N -4.41 3.77 0.00 5.19 -0.00 -1.26 -4.63 118.16 116.81 1v88 n LYS 83 Ca 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.43 1v88 n LYS 83 Cb 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.05 1v88 n LYS 83 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1v88 n GLY 84 N 5.00 5.33 0.10 2.58 0.00 -0.99 -4.67 105.19 112.54 1v88 n GLY 84 Ca 0.00 -1.38 -0.11 0.00 0.00 0.00 0.00 46.02 44.53 1v88 n GLY 84 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1v88 h PRO 85 N 0.00 -0.11 -1.81 1.61 0.13 -1.96 -3.32 132.00 126.54 1v88 h PRO 85 Ca 0.00 0.01 -0.75 0.00 -0.87 0.00 0.00 66.00 64.38 1v88 h PRO 85 Cb 0.00 0.02 -0.27 0.00 0.13 0.00 0.00 31.00 30.88 1v88 h PRO 85 CO 0.00 0.43 1.03 1.63 -0.23 0.00 0.00 178.00 180.86 1v88 n LYS 86 N -4.82 2.74 -3.00 0.86 4.01 -1.26 -4.93 118.16 111.76 1v88 n LYS 86 Ca -0.08 -3.48 0.00 0.00 -0.51 0.00 0.00 58.31 54.25 1v88 n LYS 86 Cb 0.29 -2.27 0.00 0.00 -0.51 0.00 0.00 35.03 32.54 1v88 n LYS 86 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1v88 n GLY 87 N -0.61 0.00 3.53 0.72 0.00 -1.25 -5.01 105.19 102.57 1v88 n GLY 87 Ca 0.56 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 46.43 1v88 n GLY 87 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1v88 s GLU 88 N -0.69 0.82 0.12 1.61 0.41 -1.26 -4.85 118.70 114.85 1v88 s GLU 88 Ca 0.00 0.71 -0.29 0.00 -0.41 0.00 0.00 54.97 54.97 1v88 s GLU 88 Cb 0.00 0.39 -0.07 0.00 -1.78 0.00 0.00 34.13 32.67 1v88 s GLU 88 CO 0.00 -0.15 1.59 0.00 -0.49 0.00 0.00 175.26 176.22 1v88 h ALA 89 N 4.60 -0.63 -2.79 5.21 0.00 -1.92 -2.64 119.26 121.10 1v88 h ALA 89 Ca -0.28 -0.04 -0.05 0.00 0.00 0.00 0.00 54.91 54.54 1v88 h ALA 89 Cb 1.16 0.71 -0.11 0.00 0.00 0.00 0.00 17.79 19.55 1v88 h ALA 89 CO 0.17 -0.93 -0.09 0.08 0.00 0.00 0.00 179.25 178.48 1v88 s VAL 90 N -5.92 0.04 -0.26 0.00 1.01 -1.26 -4.73 120.40 109.27 1v88 s VAL 90 Ca -0.16 -0.99 -0.15 0.00 0.00 0.00 0.00 61.98 60.68 1v88 s VAL 90 Cb 0.08 -1.66 -0.12 0.00 0.00 0.00 0.00 36.38 34.68 1v88 s VAL 90 CO 0.64 -0.19 -0.29 0.61 0.00 0.00 0.00 175.10 175.88 1v88 n GLY 91 N -0.29 -0.51 3.58 4.51 0.00 -1.26 -5.06 105.19 106.15 1v88 n GLY 91 Ca -0.09 -0.12 -0.09 0.00 0.00 0.00 0.00 46.02 45.72 1v88 n GLY 91 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1v88 s SER 92 N -7.29 -0.20 -0.19 1.61 0.15 -1.13 -4.87 113.70 101.79 1v88 s SER 92 Ca -0.37 -0.65 -0.06 0.00 0.70 0.00 0.00 55.95 55.57 1v88 s SER 92 Cb 0.13 0.60 -0.03 0.00 -1.71 0.00 0.00 66.02 65.00 1v88 s SER 92 CO 0.49 -1.11 0.04 -0.63 1.20 0.00 0.00 173.24 173.23 1v88 s ILE 93 N -3.93 4.45 0.00 6.45 1.01 -1.26 -4.83 121.20 123.09 1v88 s ILE 93 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.63 1v88 s ILE 93 Cb -0.01 -3.01 0.00 0.00 0.01 0.00 0.00 42.46 39.45 1v88 s ILE 93 CO 0.02 0.44 0.00 0.35 0.00 0.00 0.00 174.94 175.75 1v88 n THR 94 N 3.83 0.00 -0.96 2.92 -2.24 -1.26 -5.14 114.28 111.42 1v88 n THR 94 Ca -0.17 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.25 1v88 n THR 94 Cb 0.52 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.80 1v88 n THR 94 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1v88 n GLN 95 N 0.00 -0.11 -1.57 -0.78 6.02 -1.26 -4.91 117.38 114.77 1v88 n GLN 95 Ca 0.00 -0.03 -0.31 0.00 -0.01 0.00 0.00 57.00 56.65 1v88 n GLN 95 Cb 0.00 -1.12 0.05 0.00 1.02 0.00 0.00 30.24 30.20 1v88 n GLN 95 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1v88 s PRO 96 N -2.23 2.89 0.13 -1.09 0.04 -1.26 -5.08 135.00 128.40 1v88 s PRO 96 Ca 0.41 0.93 -0.05 0.00 0.04 0.00 0.00 61.00 62.33 1v88 s PRO 96 Cb -0.09 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.44 1v88 s PRO 96 CO 0.75 -1.13 0.16 -0.48 0.04 0.00 0.00 177.00 176.34 1v88 s LEU 97 N -5.56 1.45 0.00 -3.56 0.05 -1.26 -5.01 118.68 104.79 1v88 s LEU 97 Ca 0.58 -0.99 0.00 0.00 0.05 0.00 0.00 54.13 53.77 1v88 s LEU 97 Cb -0.14 0.75 0.00 0.00 -2.05 0.00 0.00 46.19 44.75 1v88 s LEU 97 CO 0.55 -0.79 0.00 -0.81 -0.55 0.00 0.00 176.35 174.75 1v88 n PRO 98 N -0.13 0.60 0.00 1.48 -0.04 -1.26 -5.06 135.00 130.59 1v88 n PRO 98 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1v88 n PRO 98 Cb 0.63 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.09 1v88 n PRO 98 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1v88 n SER 99 N -0.80 0.00 0.00 3.54 7.64 -1.26 -4.92 113.62 117.82 1v88 n SER 99 Ca 0.00 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.69 1v88 n SER 99 Cb 0.00 0.07 -0.14 0.00 -1.01 0.00 0.00 64.21 63.13 1v88 n SER 99 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 1v88 h SER 100 N 0.00 0.31 -5.05 6.43 4.64 -1.95 -2.76 113.55 115.17 1v88 h SER 100 Ca 0.00 -0.91 -0.41 0.00 -0.47 0.00 0.00 61.79 60.01 1v88 h SER 100 Cb 0.00 -0.10 -0.04 0.00 -0.31 0.00 0.00 62.40 61.95 1v88 h SER 100 CO 0.00 1.36 -0.20 0.00 -0.87 0.00 0.00 176.83 177.12 1v88 n TYR 101 N -4.21 -0.69 -3.59 4.77 0.18 -1.26 -2.74 117.16 109.61 1v88 n TYR 101 Ca -0.17 -1.63 -0.02 0.00 1.88 0.00 0.00 57.90 57.97 1v88 n TYR 101 Cb 0.75 -0.30 -0.05 0.00 -0.38 0.00 0.00 39.34 39.36 1v88 n TYR 101 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 1v88 s LEU 102 N 0.00 -0.89 -0.14 -3.48 1.43 -0.42 -4.52 118.68 110.66 1v88 s LEU 102 Ca 0.19 1.28 -0.07 0.00 -1.03 0.00 0.00 54.13 54.51 1v88 s LEU 102 Cb -0.02 2.10 -0.04 0.00 0.03 0.00 0.00 46.19 48.26 1v88 s LEU 102 CO 0.12 -0.19 0.12 -0.63 0.23 0.00 0.00 176.35 176.00 1v88 s ILE 103 N 2.37 5.32 0.17 -0.59 -1.09 -1.26 -2.19 121.20 123.92 1v88 s ILE 103 Ca -0.06 0.14 0.03 0.00 -2.23 0.00 0.00 60.65 58.52 1v88 s ILE 103 Cb -0.08 -3.33 -0.05 0.00 -1.58 0.00 0.00 42.46 37.42 1v88 s ILE 103 CO -0.18 0.57 -0.02 -0.63 -1.23 0.00 0.00 174.94 173.45 1v88 s ILE 104 N -0.66 0.83 -0.01 2.92 1.01 -1.24 -4.13 121.20 119.92 1v88 s ILE 104 Ca 0.13 -2.00 0.00 0.00 0.00 0.00 0.00 60.65 58.78 1v88 s ILE 104 Cb -0.12 -2.08 0.01 0.00 0.01 0.00 0.00 42.46 40.28 1v88 s ILE 104 CO 0.02 -0.53 -0.01 -0.60 0.00 0.00 0.00 174.94 173.83 1v88 s ARG 105 N -3.87 0.16 0.34 2.79 3.52 0.20 -3.69 118.95 118.41 1v88 s ARG 105 Ca 0.23 -0.01 0.08 0.00 -0.13 0.00 0.00 55.73 55.89 1v88 s ARG 105 Cb 0.05 -0.22 -0.04 0.00 -1.56 0.00 0.00 34.95 33.18 1v88 s ARG 105 CO 0.04 -0.02 0.16 0.00 -0.81 0.00 0.00 175.30 174.67 1v88 s ALA 106 N 0.28 3.54 0.03 6.12 0.00 -1.24 -0.33 121.76 130.15 1v88 s ALA 106 Ca -0.02 -1.83 -0.30 0.00 0.00 0.00 0.00 51.96 49.81 1v88 s ALA 106 Cb -0.05 -0.75 -0.17 0.00 0.00 0.00 0.00 23.12 22.16 1v88 s ALA 106 CO -0.01 0.02 1.27 1.15 0.00 0.00 0.00 175.76 178.19 1v88 h THR 107 N 1.51 0.08 -2.90 0.00 2.02 -1.92 -3.43 112.91 108.27 1v88 h THR 107 Ca -0.44 -0.22 -0.59 0.00 0.77 0.00 0.00 66.41 65.93 1v88 h THR 107 Cb 1.25 0.10 -0.17 0.00 -1.74 0.00 0.00 68.15 67.59 1v88 h THR 107 CO 0.63 0.01 -0.79 -0.44 0.37 0.00 0.00 175.52 175.30 1v88 s SER 108 N -4.38 3.20 0.20 4.18 0.01 -1.26 -4.88 113.70 110.77 1v88 s SER 108 Ca -0.16 -0.93 -0.20 0.00 1.31 0.00 0.00 55.95 55.97 1v88 s SER 108 Cb 0.02 -0.23 0.16 0.00 0.21 0.00 0.00 66.02 66.17 1v88 s SER 108 CO 0.49 0.03 1.58 -0.08 0.41 0.00 0.00 173.24 175.66 1v88 h GLU 109 N 2.88 -0.11 -0.12 12.44 4.81 -1.88 -1.12 114.58 131.48 1v88 h GLU 109 Ca -0.43 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 58.82 1v88 h GLU 109 Cb 1.22 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 1v88 h GLU 109 CO 0.54 -0.07 -0.10 1.03 -0.73 0.00 0.00 179.01 179.68 1v88 h SER 110 N -0.11 -0.34 -0.35 1.04 0.87 -1.96 1.20 113.55 113.90 1v88 h SER 110 Ca 0.27 0.05 0.03 0.00 -1.23 0.00 0.00 61.79 60.91 1v88 h SER 110 Cb 0.56 0.14 -0.05 0.00 -0.44 0.00 0.00 62.40 62.62 1v88 h SER 110 CO -0.78 -0.05 -0.26 0.44 -0.53 0.00 0.00 176.83 175.65 1v88 h ASP 111 N -0.03 -0.92 -0.74 6.23 3.32 -1.74 0.57 116.42 123.11 1v88 h ASP 111 Ca 0.02 0.13 0.15 0.00 0.02 0.00 0.00 57.03 57.35 1v88 h ASP 111 Cb 0.08 0.40 -0.14 0.00 0.22 0.00 0.00 39.33 39.89 1v88 h ASP 111 CO -0.13 -0.13 -0.19 1.23 -1.72 0.00 0.00 179.24 178.29 1v88 h GLY 112 N -0.07 0.51 1.08 2.75 0.00 -0.51 1.10 103.07 107.93 1v88 h GLY 112 Ca 0.06 0.25 0.07 0.00 0.00 0.00 0.00 47.33 47.71 1v88 h GLY 112 CO -0.36 -0.28 0.43 3.21 0.00 0.00 0.00 176.54 179.54 1v88 h ARG 113 N -0.01 0.59 0.01 4.80 3.08 0.41 1.15 114.38 124.41 1v88 h ARG 113 Ca 0.35 -0.04 -0.19 0.00 0.07 0.00 0.00 59.98 60.18 1v88 h ARG 113 Cb 0.54 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.44 1v88 h ARG 113 CO -0.77 0.39 -0.88 0.00 -1.07 0.00 0.00 179.97 177.64 1v88 h TRP 115 N 0.05 -0.48 -0.02 0.00 4.06 0.37 0.94 115.95 120.87 1v88 h TRP 115 Ca -0.03 -0.01 0.00 0.00 2.06 0.00 0.00 58.89 60.91 1v88 h TRP 115 Cb 1.53 0.16 -0.00 0.00 -1.00 0.00 0.00 29.16 29.85 1v88 h TRP 115 CO 0.02 -0.23 0.03 0.00 -3.56 0.00 0.00 178.44 174.70 1v88 h MET 116 N -1.09 0.00 0.00 0.49 -0.00 0.11 0.25 114.93 114.69 1v88 h MET 116 Ca -0.05 0.00 -0.04 0.00 -0.00 0.00 0.00 59.70 59.61 1v88 h MET 116 Cb 0.47 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 32.06 1v88 h MET 116 CO 0.09 0.00 -0.41 -0.44 -0.00 0.00 0.00 176.91 176.14 1v88 h ASP 117 N 0.00 0.00 -0.86 -0.10 5.19 -1.07 -3.26 116.42 116.32 1v88 h ASP 117 Ca 0.01 -0.20 0.21 0.00 -0.62 0.00 0.00 57.03 56.43 1v88 h ASP 117 Cb 0.07 0.00 -0.12 0.00 0.18 0.00 0.00 39.33 39.46 1v88 h ASP 117 CO -0.00 0.82 0.32 0.00 -3.12 0.00 0.00 179.24 177.26 1v88 h ALA 118 N -0.80 1.30 0.07 3.45 0.00 0.12 -1.09 119.26 122.32 1v88 h ALA 118 Ca -0.06 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1v88 h ALA 118 Cb 0.54 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.50 1v88 h ALA 118 CO -0.03 -0.36 -0.26 -0.07 0.00 0.00 0.00 179.25 178.53 1v88 h LEU 119 N 0.34 -0.76 -1.00 0.00 3.38 -1.10 1.32 115.31 117.48 1v88 h LEU 119 Ca 0.53 0.08 0.39 0.00 0.09 0.00 0.00 57.88 58.97 1v88 h LEU 119 Cb 0.98 0.28 -0.17 0.00 0.09 0.00 0.00 40.66 41.84 1v88 h LEU 119 CO -0.54 -0.27 0.53 -0.33 0.09 0.00 0.00 178.44 177.91 1v88 h GLU 120 N -0.37 0.07 0.13 1.13 5.08 -1.26 0.55 114.58 119.91 1v88 h GLU 120 Ca -0.01 -0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.34 1v88 h GLU 120 Cb 0.37 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.61 1v88 h GLU 120 CO -0.13 0.05 -0.06 -0.07 -1.00 0.00 0.00 179.01 177.79 1v88 h LEU 121 N 0.07 -0.15 -0.54 1.33 3.38 -0.39 -1.79 115.31 117.22 1v88 h LEU 121 Ca 0.81 -0.40 0.05 0.00 0.09 0.00 0.00 57.88 58.44 1v88 h LEU 121 Cb 2.08 0.04 -0.07 0.00 0.09 0.00 0.00 40.66 42.80 1v88 h LEU 121 CO -0.74 0.39 -0.35 0.00 0.09 0.00 0.00 178.44 177.83 1v88 h ALA 122 N -0.12 -0.38 -0.66 1.53 0.00 0.68 1.75 119.26 122.06 1v88 h ALA 122 Ca -0.02 0.06 0.11 0.00 0.00 0.00 0.00 54.91 55.06 1v88 h ALA 122 Cb 0.54 1.18 -0.04 0.00 0.00 0.00 0.00 17.79 19.47 1v88 h ALA 122 CO 0.03 -0.62 0.44 1.37 0.00 0.00 0.00 179.25 180.47 1v88 h LEU 123 N -0.04 0.42 -0.31 0.00 8.10 -1.18 1.19 115.31 123.49 1v88 h LEU 123 Ca 0.09 0.01 0.00 0.00 0.11 0.00 0.00 57.88 58.09 1v88 h LEU 123 Cb 0.27 -0.07 0.00 0.00 -0.44 0.00 0.00 40.66 40.42 1v88 h LEU 123 CO -0.53 0.24 0.00 0.29 -4.11 0.00 0.00 178.44 174.33 1v88 n LYS 124 N -4.48 1.20 0.00 0.17 4.76 0.43 -4.84 118.16 115.40 1v88 n LYS 124 Ca 0.11 -0.30 0.00 0.00 -2.87 0.00 0.00 58.31 55.25 1v88 n LYS 124 Cb 0.40 -1.22 0.00 0.00 -1.84 0.00 0.00 35.03 32.37 1v88 n LYS 124 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1v88 n SER 125 N -0.39 0.00 0.00 4.39 2.88 0.49 -4.87 113.62 116.12 1v88 n SER 125 Ca 0.10 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.64 1v88 n SER 125 Cb 0.11 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.57 1v88 n SER 125 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v88 n GLY 126 N 0.00 -0.22 2.54 0.46 0.00 -0.68 -4.58 105.19 102.71 1v88 n GLY 126 Ca 0.00 -1.68 -0.31 0.00 0.00 0.00 0.00 46.02 44.03 1v88 n GLY 126 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1v88 n PRO 127 N -0.04 2.71 -3.87 1.61 -0.04 -1.26 -4.79 135.00 129.31 1v88 n PRO 127 Ca 0.00 -1.83 -0.11 0.00 -0.04 0.00 0.00 63.50 61.52 1v88 n PRO 127 Cb 0.00 -2.66 -0.11 0.00 -0.04 0.00 0.00 33.50 30.69 1v88 n PRO 127 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1v88 s SER 128 N 3.03 0.01 0.12 3.54 1.04 -1.26 -5.12 113.70 115.06 1v88 s SER 128 Ca 0.53 -0.11 -0.08 0.00 0.48 0.00 0.00 55.95 56.76 1v88 s SER 128 Cb 0.14 0.21 -0.06 0.00 0.10 0.00 0.00 66.02 66.41 1v88 s SER 128 CO -0.04 -0.26 0.40 -0.44 0.98 0.00 0.00 173.24 173.88 1v88 s SER 129 N -0.97 6.57 0.00 7.02 0.01 -1.26 -5.09 113.70 119.98 1v88 s SER 129 Ca -0.11 0.72 0.00 0.00 1.31 0.00 0.00 55.95 57.87 1v88 s SER 129 Cb -0.06 -2.15 0.00 0.00 0.21 0.00 0.00 66.02 64.02 1v88 s SER 129 CO 0.01 0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.37