#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 -0.38 -0.74 1.61 0.15 -1.26 -5.09 113.70 107.99 1v88 s SER 2 Ca 0.00 0.65 -0.26 0.00 0.70 0.00 0.00 55.95 57.05 1v88 s SER 2 Cb 0.00 0.99 -0.05 0.00 -1.71 0.00 0.00 66.02 65.25 1v88 s SER 2 CO 0.00 -0.11 2.04 -0.55 1.20 0.00 0.00 173.24 175.83 1v88 s SER 3 N 0.90 4.91 -0.39 5.45 0.15 -1.26 -4.85 113.70 118.61 1v88 s SER 3 Ca -0.04 -0.02 0.01 0.00 0.70 0.00 0.00 55.95 56.60 1v88 s SER 3 Cb -0.04 -2.54 0.14 0.00 -1.71 0.00 0.00 66.02 61.87 1v88 s SER 3 CO -0.12 -2.81 0.24 -0.83 1.20 0.00 0.00 173.24 170.92 1v88 s GLY 4 N 9.00 1.17 0.07 9.45 0.00 -1.26 -5.12 107.32 120.62 1v88 s GLY 4 Ca 0.76 -2.18 -0.21 0.00 0.00 0.00 0.00 44.72 43.09 1v88 s GLY 4 CO 0.11 1.92 0.63 -0.56 0.00 0.00 0.00 173.10 175.20 1v88 s SER 5 N 0.69 7.11 0.13 1.64 0.01 -1.26 -4.91 113.70 117.10 1v88 s SER 5 Ca 0.20 1.32 0.00 0.00 1.31 0.00 0.00 55.95 58.78 1v88 s SER 5 Cb -0.19 -2.39 0.00 0.00 0.21 0.00 0.00 66.02 63.64 1v88 s SER 5 CO -0.02 0.20 0.00 -0.24 0.41 0.00 0.00 173.24 173.59 1v88 n SER 6 N 2.05 -2.37 0.03 2.44 2.88 -1.26 -4.64 113.62 112.75 1v88 n SER 6 Ca -0.08 0.26 -0.13 0.00 -1.33 0.00 0.00 58.87 57.59 1v88 n SER 6 Cb 0.50 -1.26 -0.09 0.00 -0.75 0.00 0.00 64.21 62.61 1v88 n SER 6 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1v88 h GLY 7 N -0.38 -0.11 -3.44 0.46 0.00 -2.00 -3.45 103.07 94.15 1v88 h GLY 7 Ca -0.02 0.04 -0.59 0.00 0.00 0.00 0.00 47.33 46.77 1v88 h GLY 7 CO 0.01 -0.04 -0.21 1.39 0.00 0.00 0.00 176.54 177.69 1v88 n ILE 8 N -4.91 2.34 -0.04 2.60 -0.00 -1.26 -4.06 119.36 114.03 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 0.26 -0.80 -0.01 0.00 -0.00 0.00 0.00 39.64 39.08 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 0.71 0.00 -2.64 1.39 2.07 0.19 -3.45 116.25 114.52 1v88 h VAL 9 Ca -0.44 -0.64 -0.01 0.00 0.82 0.00 0.00 66.70 66.42 1v88 h VAL 9 Cb 1.38 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 31.01 1v88 h VAL 9 CO 0.51 0.00 0.24 0.00 0.02 0.00 0.00 177.57 178.34 1v88 s MET 10 N -1.70 1.16 -0.03 1.57 0.23 -0.74 -4.95 119.30 114.84 1v88 s MET 10 Ca -0.07 -0.25 -0.01 0.00 -1.03 0.00 0.00 55.69 54.32 1v88 s MET 10 Cb 0.01 0.54 0.03 0.00 -1.53 0.00 0.00 34.83 33.88 1v88 s MET 10 CO 0.11 -0.47 0.06 0.00 -2.03 0.00 0.00 175.02 172.69 1v88 s ALA 11 N -2.98 0.01 0.25 3.16 0.00 -1.26 0.19 121.76 121.13 1v88 s ALA 11 Ca -0.02 0.39 -0.17 0.00 0.00 0.00 0.00 51.96 52.16 1v88 s ALA 11 Cb -0.01 -0.34 0.01 0.00 0.00 0.00 0.00 23.12 22.79 1v88 s ALA 11 CO -0.06 -0.16 0.58 0.34 0.00 0.00 0.00 175.76 176.46 1v88 s ASP 12 N 1.21 -0.21 -0.54 0.00 2.15 -1.15 -5.03 116.67 113.10 1v88 s ASP 12 Ca -0.08 -0.68 -0.25 0.00 0.43 0.00 0.00 52.55 51.98 1v88 s ASP 12 Cb -0.13 0.64 0.04 0.00 -0.30 0.00 0.00 42.92 43.17 1v88 s ASP 12 CO -0.04 -1.20 0.96 0.26 -0.17 0.00 0.00 175.17 174.99 1v88 s TRP 13 N -3.94 2.79 0.02 -5.34 0.52 -1.26 -2.99 118.94 108.74 1v88 s TRP 13 Ca 0.14 0.06 0.01 0.00 0.02 0.00 0.00 56.10 56.33 1v88 s TRP 13 Cb -0.03 -4.10 -0.04 0.00 -1.15 0.00 0.00 33.47 28.16 1v88 s TRP 13 CO 0.05 -1.34 0.07 -0.51 0.02 0.00 0.00 176.95 175.24 1v88 s LEU 14 N 4.00 3.82 -0.09 2.99 1.43 -0.97 -4.62 118.68 125.25 1v88 s LEU 14 Ca 0.32 0.09 -0.12 0.00 -1.03 0.00 0.00 54.13 53.39 1v88 s LEU 14 Cb -0.12 -2.29 -0.05 0.00 0.03 0.00 0.00 46.19 43.76 1v88 s LEU 14 CO 0.20 0.25 0.28 -0.54 0.23 0.00 0.00 176.35 176.78 1v88 s LYS 15 N -1.88 3.87 0.16 1.70 1.02 0.14 -1.66 119.74 123.10 1v88 s LYS 15 Ca 0.24 0.13 0.08 0.00 0.02 0.00 0.00 55.97 56.45 1v88 s LYS 15 Cb -0.12 -3.28 -0.04 0.00 -0.52 0.00 0.00 37.83 33.87 1v88 s LYS 15 CO 0.15 0.58 -0.07 0.42 -0.92 0.00 0.00 175.35 175.51 1v88 s ILE 16 N -0.57 3.37 0.13 2.17 1.09 0.11 0.41 121.20 127.90 1v88 s ILE 16 Ca 0.19 -1.50 -0.29 0.00 -1.10 0.00 0.00 60.65 57.95 1v88 s ILE 16 Cb -0.14 -2.65 -0.16 0.00 -1.06 0.00 0.00 42.46 38.45 1v88 s ILE 16 CO 0.07 -0.05 0.62 -1.14 -0.10 0.00 0.00 174.94 174.33 1v88 n ARG 17 N 0.17 0.00 -2.71 2.79 0.63 -1.26 -1.92 116.66 114.36 1v88 n ARG 17 Ca -0.11 0.00 -0.42 0.00 -0.92 0.00 0.00 57.85 56.40 1v88 n ARG 17 Cb 0.55 -1.04 -0.03 0.00 0.45 0.00 0.00 32.46 32.39 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 -0.65 1.36 -0.02 5.14 0.00 -1.26 -4.40 107.32 107.49 1v88 s GLY 18 Ca 0.65 -2.11 0.18 0.00 0.00 0.00 0.00 44.72 43.44 1v88 s GLY 18 CO 0.51 2.39 0.58 -1.30 0.00 0.00 0.00 173.10 175.28 1v88 n THR 19 N 6.24 1.08 0.00 0.90 -2.24 -1.26 -4.59 114.28 114.41 1v88 n THR 19 Ca 0.17 -0.71 0.00 0.00 -2.27 0.00 0.00 64.05 61.24 1v88 n THR 19 Cb 0.49 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 68.14 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 -2.77 0.42 0.00 3.22 7.99 -1.26 -4.98 117.00 119.62 1v88 n LEU 20 Ca -0.15 0.37 0.00 0.00 -0.01 0.00 0.00 56.01 56.22 1v88 n LEU 20 Cb 0.89 -0.42 0.00 0.00 -0.11 0.00 0.00 43.42 43.78 1v88 n LEU 20 CO 0.44 -0.42 0.00 2.29 -1.51 0.00 0.00 177.39 178.18 1v88 n LYS 21 N -1.83 0.00 -4.20 3.23 2.85 -1.26 -5.14 118.16 111.81 1v88 n LYS 21 Ca 0.00 0.00 -0.12 0.00 -1.05 0.00 0.00 58.31 57.14 1v88 n LYS 21 Cb 0.00 -0.11 -0.10 0.00 -0.65 0.00 0.00 35.03 34.17 1v88 n LYS 21 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1v88 s SER 22 N -3.98 0.63 0.16 -5.58 0.15 -1.26 -4.96 113.70 98.86 1v88 s SER 22 Ca 0.00 -1.24 -0.34 0.00 0.70 0.00 0.00 55.95 55.07 1v88 s SER 22 Cb 0.00 0.24 -0.14 0.00 -1.71 0.00 0.00 66.02 64.41 1v88 s SER 22 CO 0.00 -0.70 1.49 0.79 1.20 0.00 0.00 173.24 176.02 1v88 n TRP 23 N -0.20 2.07 -3.34 3.44 7.02 -1.26 -4.37 117.44 120.79 1v88 n TRP 23 Ca -0.04 0.38 -0.38 0.00 -1.02 0.00 0.00 57.50 56.44 1v88 n TRP 23 Cb 0.64 -2.48 -0.06 0.00 -2.42 0.00 0.00 31.31 26.99 1v88 n TRP 23 CO 0.00 0.00 0.00 0.99 -2.02 0.00 0.00 177.69 176.66 1v88 s THR 24 N 0.65 5.20 -0.91 -0.99 2.01 -0.81 -4.82 115.64 115.98 1v88 s THR 24 Ca 0.78 0.90 -0.15 0.00 0.31 0.00 0.00 61.69 63.54 1v88 s THR 24 Cb -0.74 -3.79 0.20 0.00 0.01 0.00 0.00 72.50 68.18 1v88 s THR 24 CO 0.42 0.33 0.94 -0.75 -0.69 0.00 0.00 174.62 174.87 1v88 s LYS 25 N 0.60 3.69 0.60 4.92 2.20 -1.26 0.04 119.74 130.54 1v88 s LYS 25 Ca 0.25 -2.36 -0.01 0.00 -0.36 0.00 0.00 55.97 53.49 1v88 s LYS 25 Cb -0.15 -4.61 0.05 0.00 -1.51 0.00 0.00 37.83 31.61 1v88 s LYS 25 CO 0.09 -1.44 0.85 -0.51 -0.36 0.00 0.00 175.35 173.98 1v88 s LEU 26 N 0.78 3.13 -0.64 5.43 1.43 -0.66 -4.86 118.68 123.28 1v88 s LEU 26 Ca 0.25 0.11 -0.14 0.00 -1.03 0.00 0.00 54.13 53.32 1v88 s LEU 26 Cb -0.08 -2.90 0.16 0.00 0.03 0.00 0.00 46.19 43.40 1v88 s LEU 26 CO -0.09 -1.31 0.57 0.86 0.23 0.00 0.00 176.35 176.62 1v88 s TRP 27 N -2.92 3.46 0.03 0.29 -0.11 0.24 -2.28 118.94 117.65 1v88 s TRP 27 Ca 0.59 -1.69 -0.19 0.00 1.22 0.00 0.00 56.10 56.03 1v88 s TRP 27 Cb -0.10 -3.74 -0.06 0.00 -1.50 0.00 0.00 33.47 28.07 1v88 s TRP 27 CO 0.40 -1.00 0.55 0.00 -4.62 0.00 0.00 176.95 172.28 1v88 s VAL 29 N -0.73 2.33 -0.27 0.00 1.01 0.54 -2.92 120.40 120.37 1v88 s VAL 29 Ca 0.29 -0.90 -0.24 0.00 0.00 0.00 0.00 61.98 61.12 1v88 s VAL 29 Cb -0.18 -2.03 -0.00 0.00 0.00 0.00 0.00 36.38 34.17 1v88 s VAL 29 CO 0.17 0.47 0.80 -0.22 0.00 0.00 0.00 175.10 176.32 1v88 s LEU 30 N 1.31 4.08 0.47 3.92 0.20 0.51 0.01 118.68 129.18 1v88 s LEU 30 Ca 0.04 0.86 0.06 0.00 0.69 0.00 0.00 54.13 55.77 1v88 s LEU 30 Cb -0.14 -3.12 -0.02 0.00 -0.43 0.00 0.00 46.19 42.48 1v88 s LEU 30 CO -0.11 -0.55 0.21 -0.54 -0.29 0.00 0.00 176.35 175.08 1v88 s LYS 31 N 2.87 2.23 -1.06 1.98 1.02 0.37 0.20 119.74 127.36 1v88 s LYS 31 Ca 0.33 -1.98 -0.23 0.00 0.02 0.00 0.00 55.97 54.11 1v88 s LYS 31 Cb -0.15 -1.94 -0.00 0.00 -0.52 0.00 0.00 37.83 35.22 1v88 s LYS 31 CO 0.10 -0.30 1.74 -1.25 -0.92 0.00 0.00 175.35 174.72 1v88 s PRO 32 N -4.01 3.14 0.00 -1.68 0.04 -1.26 -2.91 135.00 128.33 1v88 s PRO 32 Ca 0.33 -1.01 0.00 0.00 0.04 0.00 0.00 61.00 60.36 1v88 s PRO 32 Cb 0.02 -5.28 0.00 0.00 0.04 0.00 0.00 34.50 29.28 1v88 s PRO 32 CO 0.19 -2.89 0.00 0.41 0.04 0.00 0.00 177.00 174.75 1v88 n GLY 33 N 6.44 0.81 3.57 0.56 0.00 -1.21 -4.93 105.19 110.43 1v88 n GLY 33 Ca 0.40 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.01 1.61 -7.23 -1.14 -3.26 120.40 108.36 1v88 s VAL 34 Ca 0.00 0.00 0.02 0.00 -1.81 0.00 0.00 61.98 60.19 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 -0.08 -0.22 -0.31 0.00 0.00 175.10 174.49 1v88 s LEU 35 N -1.17 1.92 0.24 1.32 2.96 0.40 0.14 118.68 124.48 1v88 s LEU 35 Ca -0.03 -0.14 0.12 0.00 -0.22 0.00 0.00 54.13 53.85 1v88 s LEU 35 Cb -0.00 -0.42 -0.05 0.00 0.50 0.00 0.00 46.19 46.22 1v88 s LEU 35 CO 0.02 0.08 -0.22 -0.76 -1.32 0.00 0.00 176.35 174.15 1v88 s LEU 36 N -0.03 2.51 -0.01 -0.68 1.02 0.10 0.19 118.68 121.77 1v88 s LEU 36 Ca 0.01 -0.95 0.01 0.00 0.02 0.00 0.00 54.13 53.22 1v88 s LEU 36 Cb -0.05 -1.13 0.01 0.00 0.02 0.00 0.00 46.19 45.04 1v88 s LEU 36 CO -0.00 0.08 -0.03 -0.63 0.02 0.00 0.00 176.35 175.79 1v88 s ILE 37 N -2.10 0.29 -0.00 -0.59 1.09 -0.36 0.20 121.20 119.73 1v88 s ILE 37 Ca 0.25 -0.09 0.04 0.00 -1.10 0.00 0.00 60.65 59.75 1v88 s ILE 37 Cb -0.06 -0.30 -0.01 0.00 -1.06 0.00 0.00 42.46 41.03 1v88 s ILE 37 CO 0.12 0.12 -0.11 -0.31 -0.10 0.00 0.00 174.94 174.66 1v88 s TYR 38 N 0.34 1.01 0.36 3.97 1.51 0.20 0.07 117.35 124.81 1v88 s TYR 38 Ca -0.03 -0.21 0.14 0.00 -1.01 0.00 0.00 57.07 55.95 1v88 s TYR 38 Cb -0.07 -0.64 0.98 0.00 -0.11 0.00 0.00 41.96 42.13 1v88 s TYR 38 CO -0.01 -0.01 1.76 0.87 -1.11 0.00 0.00 175.55 177.05 1v88 h LYS 39 N 5.73 0.49 -2.62 -0.62 1.57 -1.86 0.68 116.57 119.93 1v88 h LYS 39 Ca -0.33 -0.03 0.12 0.00 -1.87 0.00 0.00 60.65 58.54 1v88 h LYS 39 Cb 1.17 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 33.32 1v88 h LYS 39 CO 0.48 0.32 0.42 -0.08 -0.57 0.00 0.00 179.45 180.03 1v88 s THR 40 N -5.63 0.00 -0.13 -0.16 -1.32 -1.26 -4.40 115.64 102.74 1v88 s THR 40 Ca -0.10 -0.77 -0.18 0.00 -1.21 0.00 0.00 61.69 59.43 1v88 s THR 40 Cb 0.26 -2.34 -0.25 0.00 -1.51 0.00 0.00 72.50 68.66 1v88 s THR 40 CO 0.80 0.00 0.51 -0.61 -2.21 0.00 0.00 174.62 173.11 1v88 h GLN 41 N 2.00 0.17 0.00 7.08 -0.00 -1.95 -3.20 115.11 119.21 1v88 h GLN 41 Ca -0.25 -0.29 0.00 0.00 -0.00 0.00 0.00 58.65 58.11 1v88 h GLN 41 Cb 1.23 0.11 0.00 0.00 0.00 0.00 0.00 27.48 28.82 1v88 h GLN 41 CO 0.30 1.14 0.00 1.63 0.00 0.00 0.00 178.83 181.90 1v88 n LYS 42 N -4.09 0.00 0.00 1.69 4.01 -1.26 -4.12 118.16 114.39 1v88 n LYS 42 Ca -0.25 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.55 1v88 n LYS 42 Cb 0.81 -0.30 0.00 0.00 -0.51 0.00 0.00 35.03 35.04 1v88 n LYS 42 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1v88 n ASN 43 N 0.00 0.00 -1.35 4.39 3.02 -1.26 -5.00 115.26 115.06 1v88 n ASN 43 Ca 0.00 0.99 0.00 0.00 -0.03 0.00 0.00 54.58 55.54 1v88 n ASN 43 Cb 0.00 -0.49 0.00 0.00 -0.61 0.00 0.00 39.78 38.68 1v88 n ASN 43 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1v88 n GLY 44 N -0.99 -0.91 0.31 7.41 0.00 -1.21 -4.97 105.19 104.83 1v88 n GLY 44 Ca 0.00 -0.19 0.13 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.37 0.99 -0.97 1.61 6.02 -1.26 -4.98 117.38 118.41 1v88 n GLN 45 Ca 0.00 -0.62 0.00 0.00 -0.01 0.00 0.00 57.00 56.37 1v88 n GLN 45 Cb 0.00 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.77 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 -0.46 -2.66 0.02 1.08 -0.00 -1.26 -3.85 117.44 110.31 1v88 n TRP 46 Ca 0.13 1.44 0.00 0.00 -0.00 0.00 0.00 57.50 59.07 1v88 n TRP 46 Cb 0.37 -2.43 0.00 0.00 -0.00 0.00 0.00 31.31 29.25 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 -2.15 0.38 -3.99 5.87 0.31 0.11 -2.69 118.33 116.17 1v88 n VAL 47 Ca 0.00 0.13 0.03 0.00 -0.01 0.00 0.00 64.34 64.48 1v88 n VAL 47 Cb 0.29 -1.41 0.01 0.00 -0.91 0.00 0.00 33.84 31.82 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 2.98 0.25 2.98 2.92 0.00 -1.14 -4.34 105.19 108.84 1v88 n GLY 48 Ca 0.00 -0.99 -0.18 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.03 0.60 -0.18 2.61 2.01 -1.26 -1.23 115.64 116.16 1v88 s THR 49 Ca 0.24 -0.30 -0.06 0.00 0.31 0.00 0.00 61.69 61.89 1v88 s THR 49 Cb -0.00 -0.52 -0.03 0.00 0.01 0.00 0.00 72.50 71.95 1v88 s THR 49 CO -0.01 0.18 0.02 -0.69 -0.69 0.00 0.00 174.62 173.43 1v88 s VAL 50 N -0.02 4.35 -0.05 3.82 1.01 0.50 -1.58 120.40 128.43 1v88 s VAL 50 Ca 0.01 -0.19 -0.18 0.00 0.00 0.00 0.00 61.98 61.61 1v88 s VAL 50 Cb -0.05 -2.95 -0.05 0.00 0.00 0.00 0.00 36.38 33.34 1v88 s VAL 50 CO -0.00 0.47 0.51 -0.76 0.00 0.00 0.00 175.10 175.31 1v88 s LEU 51 N 0.47 4.37 -0.30 3.92 1.43 -0.96 -0.45 118.68 127.15 1v88 s LEU 51 Ca 0.00 0.98 0.07 0.00 -1.03 0.00 0.00 54.13 54.16 1v88 s LEU 51 Cb -0.13 -2.76 0.46 0.00 0.03 0.00 0.00 46.19 43.78 1v88 s LEU 51 CO 0.02 0.11 1.31 0.18 0.23 0.00 0.00 176.35 178.19 1v88 n LEU 52 N 2.91 4.53 -0.33 1.79 4.77 -1.20 -4.58 117.00 124.89 1v88 n LEU 52 Ca -0.08 -4.39 0.17 0.00 -0.03 0.00 0.00 56.01 51.68 1v88 n LEU 52 Cb 0.51 -0.48 0.34 0.00 -2.33 0.00 0.00 43.42 41.47 1v88 n LEU 52 CO 0.42 1.78 0.88 0.78 -1.33 0.00 0.00 177.39 179.92 1v88 h ASN 53 N 1.73 -0.22 0.00 -1.43 2.35 -1.92 -3.32 115.58 112.77 1v88 h ASN 53 Ca 0.28 0.26 -0.16 0.00 -0.55 0.00 0.00 56.30 56.13 1v88 h ASN 53 Cb 1.37 0.39 -0.13 0.00 0.05 0.00 0.00 38.32 40.01 1v88 h ASN 53 CO 0.60 -0.32 -0.15 0.00 -1.65 0.00 0.00 177.43 175.91 1v88 n ALA 54 N -2.87 -1.94 -2.81 -0.83 0.00 -1.26 -4.95 120.51 105.84 1v88 n ALA 54 Ca 0.25 -0.88 -0.22 0.00 0.00 0.00 0.00 53.44 52.59 1v88 n ALA 54 Cb 0.83 -2.12 -0.02 0.00 0.00 0.00 0.00 19.45 18.15 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 -4.14 1.63 -0.04 0.00 2.02 -1.18 -4.85 118.70 112.14 1v88 s GLU 56 Ca 0.37 -1.91 0.05 0.00 0.02 0.00 0.00 54.97 53.50 1v88 s GLU 56 Cb -0.09 -0.76 -0.01 0.00 0.10 0.00 0.00 34.13 33.37 1v88 s GLU 56 CO 0.32 -0.22 -0.19 0.42 0.02 0.00 0.00 175.26 175.61 1v88 s ILE 57 N -3.36 1.56 -0.08 -1.63 1.01 -1.26 -3.47 121.20 113.96 1v88 s ILE 57 Ca 0.36 -0.79 0.06 0.00 0.00 0.00 0.00 60.65 60.28 1v88 s ILE 57 Cb 0.08 -1.33 -0.09 0.00 0.01 0.00 0.00 42.46 41.13 1v88 s ILE 57 CO 0.15 0.44 0.01 2.30 0.00 0.00 0.00 174.94 177.84 1v88 n ILE 58 N 3.07 0.56 0.00 2.92 -5.35 -1.16 -5.03 119.36 114.37 1v88 n ILE 58 Ca -0.18 -0.32 0.00 0.00 -0.27 0.00 0.00 62.75 61.98 1v88 n ILE 58 Cb 0.53 -0.80 0.00 0.00 -1.74 0.00 0.00 39.64 37.63 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 -2.39 0.00 -2.94 6.28 2.13 -1.26 -4.94 120.64 117.53 1v88 n GLU 59 Ca -0.14 0.00 -0.01 0.00 0.66 0.00 0.00 57.16 57.67 1v88 n GLU 59 Cb 0.75 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.46 1v88 n GLU 59 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 1v88 s ARG 60 N -3.56 0.72 0.00 5.31 0.52 0.54 -4.53 118.95 117.95 1v88 s ARG 60 Ca 0.00 -0.46 0.19 0.00 -0.52 0.00 0.00 55.73 54.94 1v88 s ARG 60 Cb 0.00 0.03 1.13 0.00 0.52 0.00 0.00 34.95 36.63 1v88 s ARG 60 CO 0.00 -0.97 1.57 -0.35 0.02 0.00 0.00 175.30 175.57 1v88 n PRO 61 N 3.64 0.75 -4.08 3.54 -0.04 -1.10 -2.63 135.00 135.07 1v88 n PRO 61 Ca 0.12 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.15 1v88 n PRO 61 Cb 0.59 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.66 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 -0.90 -3.41 0.00 3.54 7.64 -1.26 -3.61 113.62 115.62 1v88 n SER 62 Ca 0.14 -1.28 0.00 0.00 1.01 0.00 0.00 58.87 58.75 1v88 n SER 62 Cb 0.06 -1.80 0.00 0.00 -1.01 0.00 0.00 64.21 61.46 1v88 n SER 62 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1v88 n LYS 63 N -4.93 0.00 -3.76 1.43 5.02 -1.26 -4.23 118.16 110.43 1v88 n LYS 63 Ca -0.14 0.00 -0.26 0.00 -2.02 0.00 0.00 58.31 55.88 1v88 n LYS 63 Cb 0.59 0.00 -0.17 0.00 -0.02 0.00 0.00 35.03 35.43 1v88 n LYS 63 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1v88 s LYS 64 N 0.00 0.73 0.00 1.97 3.01 -1.24 -4.95 119.74 119.26 1v88 s LYS 64 Ca 0.00 -0.30 0.00 0.00 -1.01 0.00 0.00 55.97 54.66 1v88 s LYS 64 Cb 0.00 -1.82 0.00 0.00 -1.01 0.00 0.00 37.83 35.00 1v88 s LYS 64 CO 0.00 -0.53 0.00 -0.40 0.51 0.00 0.00 175.35 174.93 1v88 n ASP 65 N 5.06 0.00 0.00 2.83 5.68 -1.25 -5.10 116.55 123.77 1v88 n ASP 65 Ca -0.09 0.00 0.00 0.00 -0.50 0.00 0.00 54.79 54.20 1v88 n ASP 65 Cb 0.48 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.46 1v88 n ASP 65 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1v88 n GLY 66 N 0.00 1.57 3.29 6.12 0.00 -1.26 -4.77 105.19 110.15 1v88 n GLY 66 Ca 0.00 -0.57 0.03 0.00 0.00 0.00 0.00 46.02 45.48 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 -0.62 0.17 1.61 2.19 -1.26 -4.89 117.98 115.18 1v88 s PHE 67 Ca 0.00 0.91 0.04 0.00 0.33 0.00 0.00 56.93 58.22 1v88 s PHE 67 Cb 0.00 0.31 -0.05 0.00 -1.31 0.00 0.00 43.02 41.98 1v88 s PHE 67 CO 0.00 -0.32 -0.08 0.00 1.83 0.00 0.00 175.22 176.66 1v88 n PHE 69 N -0.27 -0.68 -3.80 0.00 -1.74 -1.23 0.20 117.46 109.94 1v88 n PHE 69 Ca -0.09 -2.85 -0.14 0.00 -0.56 0.00 0.00 57.45 53.82 1v88 n PHE 69 Cb 0.61 0.26 -0.15 0.00 1.52 0.00 0.00 39.48 41.72 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 -3.42 -0.02 -0.24 3.97 2.36 -1.26 -3.41 119.74 117.72 1v88 s LYS 70 Ca 0.38 0.15 0.02 0.00 -2.55 0.00 0.00 55.97 53.97 1v88 s LYS 70 Cb 0.02 -0.17 0.05 0.00 -1.05 0.00 0.00 37.83 36.68 1v88 s LYS 70 CO 0.27 -0.12 -0.13 -1.17 1.55 0.00 0.00 175.35 175.75 1v88 s LEU 71 N 0.77 3.12 0.35 5.43 0.20 -0.92 -3.00 118.68 124.63 1v88 s LEU 71 Ca -0.06 -1.19 0.07 0.00 0.69 0.00 0.00 54.13 53.64 1v88 s LEU 71 Cb -0.09 -1.54 -0.07 0.00 -0.43 0.00 0.00 46.19 44.06 1v88 s LEU 71 CO -0.02 -0.14 -0.01 0.72 -0.29 0.00 0.00 176.35 176.60 1v88 s PHE 72 N 1.16 2.26 -0.22 5.38 -0.71 -1.23 -1.25 117.98 123.38 1v88 s PHE 72 Ca -0.05 -0.71 -0.10 0.00 -1.04 0.00 0.00 56.93 55.04 1v88 s PHE 72 Cb -0.18 -1.46 -0.05 0.00 -1.21 0.00 0.00 43.02 40.12 1v88 s PHE 72 CO -0.07 0.34 0.13 -1.58 -1.34 0.00 0.00 175.22 172.70 1v88 s HIS 73 N -2.88 3.30 0.07 3.49 2.46 -1.14 -3.13 115.29 117.44 1v88 s HIS 73 Ca 0.34 0.16 -0.15 0.00 0.47 0.00 0.00 55.06 55.87 1v88 s HIS 73 Cb 0.07 -2.21 -0.21 0.00 -0.13 0.00 0.00 32.58 30.10 1v88 s HIS 73 CO 0.16 0.08 1.21 -1.00 -2.47 0.00 0.00 174.74 172.72 1v88 h PRO 74 N 7.28 0.66 0.00 2.88 0.13 -1.95 -2.96 132.00 138.04 1v88 h PRO 74 Ca -0.38 -0.64 0.00 0.00 -0.87 0.00 0.00 66.00 64.10 1v88 h PRO 74 Cb 1.17 0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.46 1v88 h PRO 74 CO 0.67 1.25 0.00 1.28 -0.23 0.00 0.00 178.00 180.97 1v88 n LEU 75 N -3.98 0.27 -3.19 1.56 4.77 -1.26 -4.90 117.00 110.26 1v88 n LEU 75 Ca -0.10 0.57 -0.09 0.00 -0.03 0.00 0.00 56.01 56.36 1v88 n LEU 75 Cb 0.78 -0.53 0.04 0.00 -2.33 0.00 0.00 43.42 41.38 1v88 n LEU 75 CO 0.53 -0.39 0.16 -0.62 -1.33 0.00 0.00 177.39 175.74 1v88 n GLU 76 N -1.80 -1.78 0.00 3.23 1.02 -1.12 -5.00 120.64 115.20 1v88 n GLU 76 Ca 0.03 1.13 0.00 0.00 -0.02 0.00 0.00 57.16 58.30 1v88 n GLU 76 Cb 0.19 -5.67 0.00 0.00 -0.02 0.00 0.00 31.44 25.94 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 -2.61 0.00 -3.65 3.49 1.13 -1.26 -5.12 117.38 109.36 1v88 n GLN 77 Ca -0.04 0.00 -0.01 0.00 -1.94 0.00 0.00 57.00 55.00 1v88 n GLN 77 Cb 0.57 0.00 -0.07 0.00 0.11 0.00 0.00 30.24 30.85 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 0.49 -0.12 -0.46 1.08 0.15 -1.26 -4.99 113.70 108.59 1v88 s SER 78 Ca 0.00 0.22 0.03 0.00 0.70 0.00 0.00 55.95 56.90 1v88 s SER 78 Cb 0.00 0.61 0.49 0.00 -1.71 0.00 0.00 66.02 65.41 1v88 s SER 78 CO 0.00 -0.04 1.67 2.30 1.20 0.00 0.00 173.24 178.37 1v88 n ILE 79 N 2.38 3.05 -4.08 6.45 -5.35 -1.17 -4.72 119.36 115.92 1v88 n ILE 79 Ca -0.14 -3.13 -0.11 0.00 -0.27 0.00 0.00 62.75 59.11 1v88 n ILE 79 Cb 0.57 -0.89 -0.11 0.00 -1.74 0.00 0.00 39.64 37.47 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 -3.58 0.64 -0.06 4.28 0.52 -1.26 -2.28 118.94 117.21 1v88 s TRP 80 Ca 0.56 -0.73 0.00 0.00 0.02 0.00 0.00 56.10 55.95 1v88 s TRP 80 Cb 0.46 -0.40 -0.03 0.00 -1.15 0.00 0.00 33.47 32.35 1v88 s TRP 80 CO 0.02 -0.17 -0.03 0.00 0.02 0.00 0.00 176.95 176.79 1v88 s ALA 81 N -2.51 3.17 0.13 0.98 0.00 -0.61 -4.57 121.76 118.35 1v88 s ALA 81 Ca -0.02 -0.88 -0.14 0.00 0.00 0.00 0.00 51.96 50.93 1v88 s ALA 81 Cb -0.02 -1.35 -0.01 0.00 0.00 0.00 0.00 23.12 21.74 1v88 s ALA 81 CO -0.03 0.60 1.58 -0.39 0.00 0.00 0.00 175.76 177.51 1v88 h VAL 82 N 4.02 1.26 -3.43 0.00 -1.51 -1.92 -3.44 116.25 111.24 1v88 h VAL 82 Ca -0.50 -1.03 0.00 0.00 -1.23 0.00 0.00 66.70 63.94 1v88 h VAL 82 Cb 1.18 1.09 0.00 0.00 -2.13 0.00 0.00 31.29 31.43 1v88 h VAL 82 CO 0.54 0.35 0.00 0.29 -1.23 0.00 0.00 177.57 177.52 1v88 n LYS 83 N -4.41 1.53 0.00 5.19 5.02 -1.26 -3.83 118.16 120.41 1v88 n LYS 83 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1v88 n LYS 83 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.31 1v88 n LYS 83 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v88 n GLY 84 N 5.00 5.33 0.15 0.72 0.00 -0.49 -4.71 105.19 111.19 1v88 n GLY 84 Ca 0.00 -1.39 -0.17 0.00 0.00 0.00 0.00 46.02 44.46 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 0.45 0.07 1.61 0.13 -1.96 -3.31 132.00 129.00 1v88 h PRO 85 Ca 0.00 -0.44 -0.28 0.00 -0.87 0.00 0.00 66.00 64.41 1v88 h PRO 85 Cb 0.00 0.11 -0.02 0.00 0.13 0.00 0.00 31.00 31.23 1v88 h PRO 85 CO 0.00 1.09 -1.41 0.87 -0.23 0.00 0.00 178.00 178.32 1v88 h LYS 86 N -0.01 0.16 0.00 0.86 1.57 -2.05 -3.48 116.57 113.61 1v88 h LYS 86 Ca -0.06 -0.27 0.00 0.00 -1.87 0.00 0.00 60.65 58.45 1v88 h LYS 86 Cb 1.27 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.68 1v88 h LYS 86 CO 0.12 1.00 0.00 0.41 -0.57 0.00 0.00 179.45 180.41 1v88 n GLY 87 N 1.57 0.62 3.19 3.86 0.00 -1.25 -5.16 105.19 108.02 1v88 n GLY 87 Ca -0.12 -0.49 -0.23 0.00 0.00 0.00 0.00 46.02 45.18 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 -0.02 1.17 0.21 1.61 8.01 -1.26 -4.74 118.70 123.69 1v88 s GLU 88 Ca 0.00 -0.82 -0.19 0.00 0.01 0.00 0.00 54.97 53.97 1v88 s GLU 88 Cb 0.00 -1.23 0.19 0.00 -4.31 0.00 0.00 34.13 28.78 1v88 s GLU 88 CO 0.00 0.31 1.56 0.00 0.01 0.00 0.00 175.26 177.14 1v88 h ALA 89 N 4.98 0.05 -1.96 5.21 0.00 -1.88 -1.30 119.26 124.37 1v88 h ALA 89 Ca -0.40 0.23 0.08 0.00 0.00 0.00 0.00 54.91 54.82 1v88 h ALA 89 Cb 1.17 0.97 -0.19 0.00 0.00 0.00 0.00 17.79 19.74 1v88 h ALA 89 CO 0.44 -0.66 0.48 0.54 0.00 0.00 0.00 179.25 180.05 1v88 s VAL 90 N -5.93 0.00 0.00 0.00 0.11 -1.26 -4.19 120.40 109.13 1v88 s VAL 90 Ca -0.14 0.00 0.00 0.00 -2.93 0.00 0.00 61.98 58.91 1v88 s VAL 90 Cb 0.18 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 34.03 1v88 s VAL 90 CO 0.70 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 173.08 1v88 n GLY 91 N 0.28 1.30 3.88 6.54 0.00 -1.26 -5.03 105.19 110.90 1v88 n GLY 91 Ca -0.10 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 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 -1.00 5.54 -0.11 1.61 0.15 -1.10 -5.03 113.70 113.77 1v88 s SER 92 Ca 0.00 -0.35 -0.22 0.00 0.70 0.00 0.00 55.95 56.08 1v88 s SER 92 Cb 0.00 -1.17 -0.19 0.00 -1.71 0.00 0.00 66.02 62.95 1v88 s SER 92 CO 0.00 -0.29 0.71 0.40 1.20 0.00 0.00 173.24 175.26 1v88 h ILE 93 N 1.22 1.27 -1.78 6.45 2.04 -1.90 -3.44 117.51 121.37 1v88 h ILE 93 Ca -0.46 -1.77 0.20 0.00 1.00 0.00 0.00 64.86 63.83 1v88 h ILE 93 Cb 1.25 2.33 -0.06 0.00 -0.74 0.00 0.00 36.82 39.60 1v88 h ILE 93 CO 0.58 0.40 -0.31 0.41 0.00 0.00 0.00 178.15 179.23 1v88 n THR 94 N -4.72 0.00 -0.80 -0.27 -1.04 -1.26 -4.74 114.28 101.45 1v88 n THR 94 Ca -0.08 0.04 -0.34 0.00 -2.04 0.00 0.00 64.05 61.64 1v88 n THR 94 Cb 0.33 -0.30 0.12 0.00 -1.82 0.00 0.00 70.33 68.66 1v88 n THR 94 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1v88 n GLN 95 N -2.59 -0.64 -1.62 -2.82 10.64 -1.26 -4.94 117.38 114.15 1v88 n GLN 95 Ca 0.00 -0.16 -0.31 0.00 -1.83 0.00 0.00 57.00 54.70 1v88 n GLN 95 Cb 0.59 -1.62 0.05 0.00 -0.86 0.00 0.00 30.24 28.40 1v88 n GLN 95 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 1v88 s PRO 96 N -3.22 2.98 0.19 2.61 0.04 -1.26 -5.08 135.00 131.26 1v88 s PRO 96 Ca 0.53 0.98 -0.06 0.00 0.04 0.00 0.00 61.00 62.48 1v88 s PRO 96 Cb -0.15 -1.99 -0.02 0.00 0.04 0.00 0.00 34.50 32.37 1v88 s PRO 96 CO 0.69 -1.07 0.26 -0.48 0.04 0.00 0.00 177.00 176.44 1v88 s LEU 97 N -5.44 0.94 0.00 -3.56 0.05 -1.26 -4.97 118.68 104.44 1v88 s LEU 97 Ca 0.59 -1.10 0.00 0.00 0.05 0.00 0.00 54.13 53.67 1v88 s LEU 97 Cb -0.14 0.98 0.00 0.00 -2.05 0.00 0.00 46.19 44.98 1v88 s LEU 97 CO 0.53 -0.92 0.00 -0.81 -0.55 0.00 0.00 176.35 174.60 1v88 n PRO 98 N -0.26 0.51 0.00 1.48 -0.04 -1.26 -5.06 135.00 130.36 1v88 n PRO 98 Ca -0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 1v88 n PRO 98 Cb 0.64 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.10 1v88 n PRO 98 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1v88 n SER 99 N -0.98 0.00 -0.06 3.54 3.41 -1.26 -4.93 113.62 113.34 1v88 n SER 99 Ca 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 58.87 58.44 1v88 n SER 99 Cb 0.00 0.03 -0.13 0.00 -0.26 0.00 0.00 64.21 63.85 1v88 n SER 99 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 1v88 h SER 100 N 0.00 0.09 -4.81 4.04 4.64 -1.94 -3.10 113.55 112.47 1v88 h SER 100 Ca 0.00 -0.88 -0.28 0.00 -0.47 0.00 0.00 61.79 60.16 1v88 h SER 100 Cb 0.00 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.05 1v88 h SER 100 CO 0.00 1.20 -0.12 0.00 -0.87 0.00 0.00 176.83 177.04 1v88 n TYR 101 N -4.46 -1.37 -3.26 4.77 0.18 -1.26 -2.90 117.16 108.87 1v88 n TYR 101 Ca -0.16 -1.15 0.03 0.00 1.88 0.00 0.00 57.90 58.50 1v88 n TYR 101 Cb 0.60 -0.24 -0.02 0.00 -0.38 0.00 0.00 39.34 39.30 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 -0.95 -0.07 -3.48 1.43 -0.38 -4.54 118.68 110.70 1v88 s LEU 102 Ca 0.19 0.79 -0.16 0.00 -1.03 0.00 0.00 54.13 53.92 1v88 s LEU 102 Cb -0.01 1.87 -0.05 0.00 0.03 0.00 0.00 46.19 48.03 1v88 s LEU 102 CO 0.12 -0.18 0.41 -0.63 0.23 0.00 0.00 176.35 176.30 1v88 s ILE 103 N 2.82 5.13 0.17 -0.59 -1.09 -1.26 -2.17 121.20 124.22 1v88 s ILE 103 Ca 0.07 0.83 0.03 0.00 -2.23 0.00 0.00 60.65 59.34 1v88 s ILE 103 Cb -0.12 -3.73 -0.05 0.00 -1.58 0.00 0.00 42.46 36.98 1v88 s ILE 103 CO -0.17 0.46 -0.03 -0.63 -1.23 0.00 0.00 174.94 173.34 1v88 s ILE 104 N -0.23 0.88 -0.01 2.92 1.01 -1.22 -4.44 121.20 120.12 1v88 s ILE 104 Ca 0.23 -2.01 0.00 0.00 0.00 0.00 0.00 60.65 58.87 1v88 s ILE 104 Cb -0.15 -2.07 0.01 0.00 0.01 0.00 0.00 42.46 40.25 1v88 s ILE 104 CO 0.11 -0.54 0.01 -0.60 0.00 0.00 0.00 174.94 173.92 1v88 s ARG 105 N -3.86 0.01 0.35 2.79 3.52 0.17 -3.50 118.95 118.43 1v88 s ARG 105 Ca 0.22 0.04 0.08 0.00 -0.13 0.00 0.00 55.73 55.95 1v88 s ARG 105 Cb 0.05 -0.09 -0.04 0.00 -1.56 0.00 0.00 34.95 33.30 1v88 s ARG 105 CO 0.04 -0.04 0.16 0.00 -0.81 0.00 0.00 175.30 174.64 1v88 s ALA 106 N 0.31 3.55 0.00 6.12 0.00 -1.25 0.29 121.76 130.76 1v88 s ALA 106 Ca -0.03 -1.86 0.00 0.00 0.00 0.00 0.00 51.96 50.08 1v88 s ALA 106 Cb -0.04 -0.72 0.00 0.00 0.00 0.00 0.00 23.12 22.36 1v88 s ALA 106 CO -0.01 -0.00 0.54 2.41 0.00 0.00 0.00 175.76 178.70 1v88 n THR 107 N -1.19 0.00 -4.14 0.00 -1.04 -1.26 -4.79 114.28 101.86 1v88 n THR 107 Ca -0.02 1.00 -0.33 0.00 -2.04 0.00 0.00 64.05 62.66 1v88 n THR 107 Cb 0.62 -1.92 -0.07 0.00 -1.82 0.00 0.00 70.33 67.13 1v88 n THR 107 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1v88 s SER 108 N -2.23 5.55 0.25 8.00 0.01 -1.26 -4.90 113.70 119.12 1v88 s SER 108 Ca 0.00 0.11 -0.11 0.00 1.31 0.00 0.00 55.95 57.26 1v88 s SER 108 Cb 0.00 -1.56 0.36 0.00 0.21 0.00 0.00 66.02 65.03 1v88 s SER 108 CO 0.00 0.27 1.57 -0.08 0.41 0.00 0.00 173.24 175.42 1v88 h GLU 109 N 4.15 -0.01 -0.80 12.44 4.81 -1.90 0.98 114.58 134.25 1v88 h GLU 109 Ca -0.49 0.00 0.18 0.00 -0.13 0.00 0.00 59.36 58.92 1v88 h GLU 109 Cb 1.18 0.00 -0.12 0.00 0.63 0.00 0.00 28.75 30.45 1v88 h GLU 109 CO 0.61 -0.01 0.25 1.03 -0.73 0.00 0.00 179.01 180.17 1v88 h SER 110 N -0.01 0.12 0.41 1.04 0.87 -1.97 1.20 113.55 115.21 1v88 h SER 110 Ca 0.41 0.15 -0.02 0.00 -1.23 0.00 0.00 61.79 61.10 1v88 h SER 110 Cb 0.64 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.79 1v88 h SER 110 CO -0.92 -0.03 -0.20 0.44 -0.53 0.00 0.00 176.83 175.59 1v88 h ASP 111 N 0.32 -0.47 -0.30 6.23 5.19 0.56 -1.64 116.42 126.30 1v88 h ASP 111 Ca 0.47 0.02 0.07 0.00 -0.62 0.00 0.00 57.03 56.96 1v88 h ASP 111 Cb 0.84 0.12 -0.08 0.00 0.18 0.00 0.00 39.33 40.39 1v88 h ASP 111 CO -0.53 -0.31 -0.35 1.23 -3.12 0.00 0.00 179.24 176.16 1v88 h GLY 112 N -0.60 -0.39 -0.34 2.75 0.00 -0.55 0.48 103.07 104.43 1v88 h GLY 112 Ca -0.06 0.44 0.32 0.00 0.00 0.00 0.00 47.33 48.03 1v88 h GLY 112 CO 0.09 -0.21 0.79 3.21 0.00 0.00 0.00 176.54 180.42 1v88 h ARG 113 N -0.32 0.14 0.15 4.80 3.08 0.14 1.57 114.38 123.94 1v88 h ARG 113 Ca 0.14 -0.01 -0.29 0.00 0.07 0.00 0.00 59.98 59.89 1v88 h ARG 113 Cb 0.56 -0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.58 1v88 h ARG 113 CO -0.48 0.09 -1.30 0.00 -1.07 0.00 0.00 179.97 177.21 1v88 h TRP 115 N 0.08 -0.58 0.00 0.00 4.06 0.59 1.36 115.95 121.47 1v88 h TRP 115 Ca -0.16 -0.01 -0.00 0.00 2.06 0.00 0.00 58.89 60.78 1v88 h TRP 115 Cb 2.01 0.19 -0.00 0.00 -1.00 0.00 0.00 29.16 30.36 1v88 h TRP 115 CO 0.07 -0.26 -0.00 0.00 -3.56 0.00 0.00 178.44 174.69 1v88 h MET 116 N -0.98 0.00 0.00 0.49 -0.00 0.14 0.10 114.93 114.68 1v88 h MET 116 Ca -0.06 0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.61 1v88 h MET 116 Cb 0.58 0.00 -0.00 0.00 -0.00 0.00 0.00 31.60 32.18 1v88 h MET 116 CO 0.10 0.00 -0.42 -0.44 -0.00 0.00 0.00 176.91 176.16 1v88 h ASP 117 N 0.00 0.00 -0.54 -0.10 3.32 -1.04 -3.30 116.42 114.75 1v88 h ASP 117 Ca -0.00 -0.12 0.11 0.00 0.02 0.00 0.00 57.03 57.04 1v88 h ASP 117 Cb 0.07 0.00 -0.11 0.00 0.22 0.00 0.00 39.33 39.51 1v88 h ASP 117 CO 0.00 0.78 -0.18 0.00 -1.72 0.00 0.00 179.24 178.13 1v88 h ALA 118 N -0.88 0.28 -0.20 3.45 0.00 0.20 -1.89 119.26 120.23 1v88 h ALA 118 Ca -0.04 0.20 0.02 0.00 0.00 0.00 0.00 54.91 55.09 1v88 h ALA 118 Cb 0.48 0.48 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1v88 h ALA 118 CO -0.03 -0.48 -0.15 -0.07 0.00 0.00 0.00 179.25 178.52 1v88 h LEU 119 N -0.04 -0.54 -0.99 0.00 3.38 -1.16 1.57 115.31 117.53 1v88 h LEU 119 Ca 0.26 0.08 0.31 0.00 0.09 0.00 0.00 57.88 58.62 1v88 h LEU 119 Cb 0.44 0.23 -0.18 0.00 0.09 0.00 0.00 40.66 41.24 1v88 h LEU 119 CO -0.58 -0.08 0.18 -0.33 0.09 0.00 0.00 178.44 177.72 1v88 h GLU 120 N -0.04 0.01 0.09 1.13 5.08 -1.44 0.71 114.58 120.12 1v88 h GLU 120 Ca 0.03 -0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1v88 h GLU 120 Cb 0.13 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.38 1v88 h GLU 120 CO -0.21 0.01 -0.04 -0.07 -1.00 0.00 0.00 179.01 177.69 1v88 h LEU 121 N 0.01 -0.11 -0.24 1.33 3.38 0.37 -1.89 115.31 118.17 1v88 h LEU 121 Ca 0.67 -0.31 0.02 0.00 0.09 0.00 0.00 57.88 58.35 1v88 h LEU 121 Cb 1.52 0.03 -0.03 0.00 0.09 0.00 0.00 40.66 42.27 1v88 h LEU 121 CO -0.88 0.26 -0.14 0.00 0.09 0.00 0.00 178.44 177.78 1v88 n ALA 122 N -2.34 -0.15 -0.19 1.53 0.00 0.49 0.19 120.51 120.04 1v88 n ALA 122 Ca -0.08 0.20 0.18 0.00 0.00 0.00 0.00 53.44 53.74 1v88 n ALA 122 Cb 0.22 0.33 0.54 0.00 0.00 0.00 0.00 19.45 20.54 1v88 n ALA 122 CO 0.00 0.00 0.00 1.37 0.00 0.00 0.00 177.50 178.87 1v88 h LEU 123 N 0.00 0.33 -2.39 0.00 8.10 -1.33 1.43 115.31 121.46 1v88 h LEU 123 Ca 0.04 0.03 -0.02 0.00 0.11 0.00 0.00 57.88 58.03 1v88 h LEU 123 Cb 0.10 -0.04 -0.01 0.00 -0.44 0.00 0.00 40.66 40.27 1v88 h LEU 123 CO -0.22 0.15 0.03 0.29 -4.11 0.00 0.00 178.44 174.58 1v88 n LYS 124 N -4.47 2.91 -1.81 0.17 4.76 0.51 -4.84 118.16 115.39 1v88 n LYS 124 Ca 0.16 -1.63 0.00 0.00 -2.87 0.00 0.00 58.31 53.98 1v88 n LYS 124 Cb 0.64 -1.87 0.00 0.00 -1.84 0.00 0.00 35.03 31.96 1v88 n LYS 124 CO 0.00 0.00 0.00 0.43 -1.37 0.00 0.00 177.40 176.46 1v88 n SER 125 N 0.26 -9.10 0.00 4.39 7.64 0.49 -4.92 113.62 112.38 1v88 n SER 125 Ca 0.16 1.29 0.00 0.00 1.01 0.00 0.00 58.87 61.33 1v88 n SER 125 Cb 0.78 -4.80 0.00 0.00 -1.01 0.00 0.00 64.21 59.17 1v88 n SER 125 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1v88 n GLY 126 N 0.62 0.22 3.81 0.23 0.00 -1.24 -4.61 105.19 104.21 1v88 n GLY 126 Ca 0.00 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.61 1v88 n GLY 126 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1v88 s PRO 127 N 0.00 3.46 0.16 1.61 0.04 -1.26 -5.03 135.00 133.98 1v88 s PRO 127 Ca 0.00 1.20 -0.24 0.00 0.04 0.00 0.00 61.00 61.99 1v88 s PRO 127 Cb 0.00 -2.05 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 1v88 s PRO 127 CO 0.00 -0.70 0.75 -1.54 0.04 0.00 0.00 177.00 175.56 1v88 s SER 128 N -2.71 7.34 -0.53 6.66 1.04 -1.26 -5.03 113.70 119.21 1v88 s SER 128 Ca 0.64 1.60 -0.06 0.00 0.48 0.00 0.00 55.95 58.60 1v88 s SER 128 Cb -0.15 -2.48 0.14 0.00 0.10 0.00 0.00 66.02 63.62 1v88 s SER 128 CO 0.34 0.20 0.37 -0.94 0.98 0.00 0.00 173.24 174.19 1v88 s SER 129 N -1.18 5.54 0.00 7.02 1.04 -1.26 -5.12 113.70 119.75 1v88 s SER 129 Ca 0.36 -2.27 0.00 0.00 0.48 0.00 0.00 55.95 54.52 1v88 s SER 129 Cb -0.22 -1.94 0.00 0.00 0.10 0.00 0.00 66.02 63.96 1v88 s SER 129 CO 0.25 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.53