#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 -0.28 0.36 1.61 0.15 -1.26 -5.15 113.70 109.13 1v88 s SER 2 Ca 0.00 0.27 -0.25 0.00 0.70 0.00 0.00 55.95 56.68 1v88 s SER 2 Cb 0.00 0.42 -0.10 0.00 -1.71 0.00 0.00 66.02 64.63 1v88 s SER 2 CO 0.00 -0.41 0.98 -0.55 1.20 0.00 0.00 173.24 174.46 1v88 s SER 3 N -1.06 7.08 0.00 5.45 0.15 -1.26 -5.02 113.70 119.04 1v88 s SER 3 Ca -0.11 1.89 0.00 0.00 0.70 0.00 0.00 55.95 58.43 1v88 s SER 3 Cb -0.04 -2.58 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 1v88 s SER 3 CO 0.04 -0.26 0.00 0.61 1.20 0.00 0.00 173.24 174.84 1v88 n GLY 4 N 0.31 0.70 1.68 9.45 0.00 -1.26 -5.04 105.19 111.03 1v88 n GLY 4 Ca 0.04 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1v88 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1v88 n SER 5 N -1.04 0.12 0.09 1.61 2.88 -1.26 -5.10 113.62 110.91 1v88 n SER 5 Ca 0.00 0.19 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1v88 n SER 5 Cb 0.00 0.09 0.00 0.00 -0.75 0.00 0.00 64.21 63.55 1v88 n SER 5 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1v88 n SER 6 N -2.99 -1.60 0.00 -3.46 2.88 -1.26 -5.05 113.62 102.14 1v88 n SER 6 Ca 0.00 0.45 0.00 0.00 -1.33 0.00 0.00 58.87 57.99 1v88 n SER 6 Cb 0.00 1.71 0.00 0.00 -0.75 0.00 0.00 64.21 65.17 1v88 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1v88 n GLY 7 N -1.39 -0.02 3.59 0.46 0.00 -1.26 -5.14 105.19 101.44 1v88 n GLY 7 Ca 0.00 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.62 1v88 n GLY 7 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1v88 n ILE 8 N -1.33 3.02 -0.07 -0.61 -0.00 -1.26 -4.03 119.36 115.09 1v88 n ILE 8 Ca 0.00 -0.42 -0.05 0.00 -0.00 0.00 0.00 62.75 62.27 1v88 n ILE 8 Cb 0.00 -1.06 -0.02 0.00 -0.00 0.00 0.00 39.64 38.56 1v88 n ILE 8 CO 0.00 0.00 0.00 0.52 -0.00 0.00 0.00 176.55 177.07 1v88 n VAL 9 N -2.23 1.25 -3.45 1.39 0.31 0.27 -4.91 118.33 110.96 1v88 n VAL 9 Ca 0.13 0.24 -0.12 0.00 -0.01 0.00 0.00 64.34 64.58 1v88 n VAL 9 Cb 0.49 -2.26 -0.02 0.00 -0.91 0.00 0.00 33.84 31.13 1v88 n VAL 9 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1v88 s MET 10 N -2.26 1.15 -0.08 5.55 0.23 -1.02 -4.75 119.30 118.12 1v88 s MET 10 Ca -0.17 -0.35 -0.03 0.00 -1.03 0.00 0.00 55.69 54.11 1v88 s MET 10 Cb 0.02 0.53 0.04 0.00 -1.53 0.00 0.00 34.83 33.90 1v88 s MET 10 CO 0.25 -0.49 0.16 0.00 -2.03 0.00 0.00 175.02 172.91 1v88 s ALA 11 N -3.32 -0.22 0.31 3.16 0.00 -1.26 0.18 121.76 120.61 1v88 s ALA 11 Ca 0.01 0.63 -0.14 0.00 0.00 0.00 0.00 51.96 52.45 1v88 s ALA 11 Cb -0.01 -0.66 0.02 0.00 0.00 0.00 0.00 23.12 22.47 1v88 s ALA 11 CO -0.10 -0.38 0.63 -0.51 0.00 0.00 0.00 175.76 175.39 1v88 s ASP 12 N 1.80 0.03 -0.42 0.00 1.11 -1.12 -5.04 116.67 113.03 1v88 s ASP 12 Ca -0.02 -0.97 -0.25 0.00 0.18 0.00 0.00 52.55 51.48 1v88 s ASP 12 Cb -0.12 0.71 0.02 0.00 1.07 0.00 0.00 42.92 44.60 1v88 s ASP 12 CO -0.06 -1.36 0.91 0.26 1.18 0.00 0.00 175.17 176.10 1v88 s TRP 13 N -3.43 3.00 -0.10 4.23 0.52 -1.26 -2.88 118.94 119.01 1v88 s TRP 13 Ca 0.19 0.54 -0.00 0.00 0.02 0.00 0.00 56.10 56.85 1v88 s TRP 13 Cb -0.03 -3.80 -0.02 0.00 -1.15 0.00 0.00 33.47 28.47 1v88 s TRP 13 CO 0.11 -0.96 -0.09 -0.51 0.02 0.00 0.00 176.95 175.52 1v88 s LEU 14 N 3.59 3.00 -0.30 2.99 1.43 -1.04 -4.42 118.68 123.92 1v88 s LEU 14 Ca 0.37 -0.16 -0.24 0.00 -1.03 0.00 0.00 54.13 53.07 1v88 s LEU 14 Cb -0.11 -1.67 0.00 0.00 0.03 0.00 0.00 46.19 44.44 1v88 s LEU 14 CO 0.23 0.26 0.83 -0.54 0.23 0.00 0.00 176.35 177.35 1v88 s LYS 15 N -0.18 4.00 -0.25 1.70 1.02 -0.52 -2.10 119.74 123.42 1v88 s LYS 15 Ca 0.02 0.69 -0.11 0.00 0.02 0.00 0.00 55.97 56.59 1v88 s LYS 15 Cb -0.13 -3.72 -0.05 0.00 -0.52 0.00 0.00 37.83 33.41 1v88 s LYS 15 CO 0.03 -0.69 0.19 0.42 -0.92 0.00 0.00 175.35 174.38 1v88 s ILE 16 N 3.03 5.33 -0.41 2.17 1.09 -1.26 -0.67 121.20 130.48 1v88 s ILE 16 Ca 0.34 0.23 -0.37 0.00 -1.10 0.00 0.00 60.65 59.75 1v88 s ILE 16 Cb -0.14 -3.53 -0.16 0.00 -1.06 0.00 0.00 42.46 37.57 1v88 s ILE 16 CO 0.12 0.31 1.54 -1.14 -0.10 0.00 0.00 174.94 175.68 1v88 n ARG 17 N 4.49 0.00 -2.93 2.79 0.63 -1.26 -3.43 116.66 116.95 1v88 n ARG 17 Ca -0.14 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.35 1v88 n ARG 17 Cb 0.52 -1.22 -0.04 0.00 0.45 0.00 0.00 32.46 32.17 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 3.76 1.51 0.08 5.14 0.00 -1.25 -4.86 107.32 111.69 1v88 s GLY 18 Ca 0.92 -2.00 0.10 0.00 0.00 0.00 0.00 44.72 43.74 1v88 s GLY 18 CO 0.60 1.94 1.30 -0.37 0.00 0.00 0.00 173.10 176.56 1v88 n THR 19 N 5.80 1.47 0.03 0.90 5.66 -1.26 -2.04 114.28 124.83 1v88 n THR 19 Ca -0.04 0.44 -0.13 0.00 -3.05 0.00 0.00 64.05 61.28 1v88 n THR 19 Cb 0.45 -1.37 -0.09 0.00 -1.55 0.00 0.00 70.33 67.77 1v88 n THR 19 CO 0.00 0.00 0.00 -0.07 -3.05 0.00 0.00 175.07 171.95 1v88 h LEU 20 N 0.00 -0.09 0.00 1.09 -0.00 -1.96 -3.47 115.31 110.88 1v88 h LEU 20 Ca 0.00 -0.40 0.00 0.00 -0.00 0.00 0.00 57.88 57.48 1v88 h LEU 20 Cb 0.10 0.02 0.00 0.00 -0.00 0.00 0.00 40.66 40.78 1v88 h LEU 20 CO 0.00 0.38 0.00 2.29 -0.00 0.00 0.00 178.44 181.11 1v88 n LYS 21 N -4.92 0.00 -4.23 1.13 2.85 -0.87 -5.14 118.16 106.98 1v88 n LYS 21 Ca -0.08 0.00 -0.15 0.00 -1.05 0.00 0.00 58.31 57.02 1v88 n LYS 21 Cb 0.25 0.00 -0.10 0.00 -0.65 0.00 0.00 35.03 34.52 1v88 n LYS 21 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1v88 s SER 22 N 0.00 1.76 0.80 -5.58 1.04 -1.24 -4.94 113.70 105.54 1v88 s SER 22 Ca 0.00 -0.91 -0.14 0.00 0.48 0.00 0.00 55.95 55.38 1v88 s SER 22 Cb 0.00 -0.02 0.06 0.00 0.10 0.00 0.00 66.02 66.16 1v88 s SER 22 CO 0.00 -0.27 1.08 0.79 0.98 0.00 0.00 173.24 175.83 1v88 n TRP 23 N 0.18 0.91 -0.12 5.02 7.02 -1.26 -3.96 117.44 125.23 1v88 n TRP 23 Ca -0.13 0.39 -0.25 0.00 -1.02 0.00 0.00 57.50 56.49 1v88 n TRP 23 Cb 0.59 -2.07 -0.08 0.00 -2.42 0.00 0.00 31.31 27.32 1v88 n TRP 23 CO 0.00 0.00 0.00 2.41 -2.02 0.00 0.00 177.69 178.08 1v88 n THR 24 N -3.15 1.36 -1.79 -0.99 -1.04 -1.22 -4.85 114.28 102.59 1v88 n THR 24 Ca 0.13 -0.29 -0.02 0.00 -2.04 0.00 0.00 64.05 61.83 1v88 n THR 24 Cb 0.50 -1.87 -0.01 0.00 -1.82 0.00 0.00 70.33 67.13 1v88 n THR 24 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 1v88 n LYS 25 N -4.12 -1.35 -4.53 -2.82 4.81 -1.26 -4.95 118.16 103.95 1v88 n LYS 25 Ca -0.45 1.37 -0.30 0.00 -0.87 0.00 0.00 58.31 58.06 1v88 n LYS 25 Cb 0.81 -2.15 -0.07 0.00 0.02 0.00 0.00 35.03 33.63 1v88 n LYS 25 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1v88 s LEU 26 N -0.19 2.55 -0.74 3.14 1.43 -0.89 -4.93 118.68 119.04 1v88 s LEU 26 Ca -0.08 -1.48 -0.19 0.00 -1.03 0.00 0.00 54.13 51.35 1v88 s LEU 26 Cb 0.01 -0.91 0.12 0.00 0.03 0.00 0.00 46.19 45.43 1v88 s LEU 26 CO 0.22 -0.79 0.90 0.86 0.23 0.00 0.00 176.35 177.76 1v88 s TRP 27 N -2.80 3.07 -0.06 0.29 -0.11 0.27 -2.51 118.94 117.08 1v88 s TRP 27 Ca 0.19 -1.15 -0.20 0.00 1.22 0.00 0.00 56.10 56.17 1v88 s TRP 27 Cb 0.03 -4.13 -0.05 0.00 -1.50 0.00 0.00 33.47 27.82 1v88 s TRP 27 CO 0.11 -1.39 0.56 0.00 -4.62 0.00 0.00 176.95 171.60 1v88 s VAL 29 N 0.31 2.94 -0.15 0.00 1.01 0.58 -2.81 120.40 122.27 1v88 s VAL 29 Ca 0.30 -0.64 -0.24 0.00 0.00 0.00 0.00 61.98 61.39 1v88 s VAL 29 Cb -0.17 -2.31 -0.02 0.00 0.00 0.00 0.00 36.38 33.89 1v88 s VAL 29 CO 0.14 0.47 0.76 -0.22 0.00 0.00 0.00 175.10 176.25 1v88 s LEU 30 N 1.36 4.20 0.43 3.92 0.20 0.48 -0.25 118.68 129.02 1v88 s LEU 30 Ca 0.05 1.11 0.05 0.00 0.69 0.00 0.00 54.13 56.02 1v88 s LEU 30 Cb -0.14 -3.13 -0.06 0.00 -0.43 0.00 0.00 46.19 42.43 1v88 s LEU 30 CO -0.06 -0.32 0.02 -0.54 -0.29 0.00 0.00 176.35 175.16 1v88 s LYS 31 N 1.83 1.98 -1.04 1.98 1.02 0.17 0.94 119.74 126.62 1v88 s LYS 31 Ca 0.36 -2.17 -0.23 0.00 0.02 0.00 0.00 55.97 53.96 1v88 s LYS 31 Cb -0.17 -1.45 -0.00 0.00 -0.52 0.00 0.00 37.83 35.69 1v88 s LYS 31 CO 0.13 -0.18 1.73 -1.25 -0.92 0.00 0.00 175.35 174.87 1v88 s PRO 32 N -3.78 3.13 0.00 -1.68 0.04 -1.26 -2.91 135.00 128.54 1v88 s PRO 32 Ca 0.27 -0.96 0.00 0.00 0.04 0.00 0.00 61.00 60.35 1v88 s PRO 32 Cb 0.07 -5.26 0.00 0.00 0.04 0.00 0.00 34.50 29.35 1v88 s PRO 32 CO 0.13 -2.88 0.00 0.41 0.04 0.00 0.00 177.00 174.70 1v88 n GLY 33 N 6.51 0.88 3.52 0.56 0.00 -1.25 -4.98 105.19 110.44 1v88 n GLY 33 Ca 0.39 -0.61 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.08 1.61 -7.23 -1.15 -3.29 120.40 108.27 1v88 s VAL 34 Ca 0.00 0.00 -0.05 0.00 -1.81 0.00 0.00 61.98 60.12 1v88 s VAL 34 Cb 0.00 -1.00 0.03 0.00 0.56 0.00 0.00 36.38 35.97 1v88 s VAL 34 CO 0.00 0.00 0.18 -0.22 -0.31 0.00 0.00 175.10 174.75 1v88 s LEU 35 N -2.28 0.90 0.17 1.32 2.96 0.49 0.43 118.68 122.67 1v88 s LEU 35 Ca 0.05 0.38 0.09 0.00 -0.22 0.00 0.00 54.13 54.43 1v88 s LEU 35 Cb -0.01 0.56 -0.04 0.00 0.50 0.00 0.00 46.19 47.20 1v88 s LEU 35 CO -0.07 -0.12 -0.14 -0.76 -1.32 0.00 0.00 176.35 173.94 1v88 s LEU 36 N 0.74 2.82 -0.06 -0.68 1.02 0.65 0.22 118.68 123.38 1v88 s LEU 36 Ca -0.05 -0.63 -0.01 0.00 0.02 0.00 0.00 54.13 53.46 1v88 s LEU 36 Cb -0.07 -1.54 0.03 0.00 0.02 0.00 0.00 46.19 44.63 1v88 s LEU 36 CO -0.04 0.12 0.00 -0.63 0.02 0.00 0.00 176.35 175.82 1v88 s ILE 37 N -1.59 0.32 0.07 -0.59 1.09 0.14 0.21 121.20 120.86 1v88 s ILE 37 Ca 0.23 0.12 0.09 0.00 -1.10 0.00 0.00 60.65 59.98 1v88 s ILE 37 Cb -0.09 -0.47 -0.03 0.00 -1.06 0.00 0.00 42.46 40.81 1v88 s ILE 37 CO 0.13 0.23 -0.22 -0.31 -0.10 0.00 0.00 174.94 174.67 1v88 s TYR 38 N 1.75 2.43 0.24 3.97 1.51 0.19 0.35 117.35 127.80 1v88 s TYR 38 Ca 0.01 -0.33 -0.05 0.00 -1.01 0.00 0.00 57.07 55.69 1v88 s TYR 38 Cb -0.13 -1.38 0.44 0.00 -0.11 0.00 0.00 41.96 40.78 1v88 s TYR 38 CO -0.04 0.24 1.69 0.87 -1.11 0.00 0.00 175.55 177.21 1v88 h LYS 39 N 4.39 0.29 -3.34 -0.62 1.57 -1.87 0.77 116.57 117.76 1v88 h LYS 39 Ca -0.48 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.28 1v88 h LYS 39 Cb 1.16 -0.06 -0.08 0.00 0.08 0.00 0.00 32.23 33.32 1v88 h LYS 39 CO 0.44 0.19 0.04 -0.08 -0.57 0.00 0.00 179.45 179.47 1v88 s THR 40 N -6.05 0.01 0.01 -0.16 -1.32 -1.26 -4.24 115.64 102.63 1v88 s THR 40 Ca -0.13 -1.12 0.05 0.00 -1.21 0.00 0.00 61.69 59.29 1v88 s THR 40 Cb 0.21 -1.99 -0.24 0.00 -1.51 0.00 0.00 72.50 68.97 1v88 s THR 40 CO 0.75 -0.03 0.86 1.56 -2.21 0.00 0.00 174.62 175.56 1v88 h GLN 41 N 2.15 0.09 0.00 7.08 1.08 -1.95 -3.19 115.11 120.37 1v88 h GLN 41 Ca -0.24 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 56.81 1v88 h GLN 41 Cb 1.25 0.06 0.00 0.00 -0.05 0.00 0.00 27.48 28.74 1v88 h GLN 41 CO 0.31 0.85 0.00 1.63 -0.95 0.00 0.00 178.83 180.67 1v88 n LYS 42 N -3.27 0.00 0.02 1.46 4.76 -1.26 -4.38 118.16 115.50 1v88 n LYS 42 Ca -0.13 0.00 -0.11 0.00 -2.87 0.00 0.00 58.31 55.20 1v88 n LYS 42 Cb 1.02 -0.11 -0.07 0.00 -1.84 0.00 0.00 35.03 34.03 1v88 n LYS 42 CO 0.00 0.00 0.00 -0.91 -1.37 0.00 0.00 177.40 175.12 1v88 h ASN 43 N 0.00 -1.16 -2.78 4.39 2.35 -2.01 -3.48 115.58 112.89 1v88 h ASN 43 Ca 0.00 0.13 0.00 0.00 -0.55 0.00 0.00 56.30 55.88 1v88 h ASN 43 Cb 0.00 0.44 0.00 0.00 0.05 0.00 0.00 38.32 38.81 1v88 h ASN 43 CO 0.00 -0.35 0.00 0.61 -1.65 0.00 0.00 177.43 176.04 1v88 n GLY 44 N -1.31 -2.08 0.71 2.83 0.00 -1.21 -4.99 105.19 99.15 1v88 n GLY 44 Ca -0.05 -0.25 0.10 0.00 0.00 0.00 0.00 46.02 45.83 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 -0.13 1.76 -1.49 1.61 6.02 -1.26 -4.99 117.38 118.90 1v88 n GLN 45 Ca 0.00 -1.47 0.18 0.00 -0.01 0.00 0.00 57.00 55.69 1v88 n GLN 45 Cb 0.00 -1.40 -0.10 0.00 1.02 0.00 0.00 30.24 29.76 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 0.76 -3.99 0.07 1.08 -0.00 -1.26 -3.73 117.44 110.36 1v88 n TRP 46 Ca 0.11 2.21 0.00 0.00 -0.00 0.00 0.00 57.50 59.82 1v88 n TRP 46 Cb 0.49 -3.63 0.00 0.00 -0.00 0.00 0.00 31.31 28.17 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 -4.41 0.18 -3.95 5.87 0.31 0.16 -3.41 118.33 113.09 1v88 n VAL 47 Ca -0.10 0.06 0.00 0.00 -0.01 0.00 0.00 64.34 64.29 1v88 n VAL 47 Cb 0.71 -0.77 0.02 0.00 -0.91 0.00 0.00 33.84 32.88 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 1.96 0.41 3.03 2.92 0.00 -0.92 -4.38 105.19 108.21 1v88 n GLY 48 Ca 0.00 -1.08 -0.15 0.00 0.00 0.00 0.00 46.02 44.79 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 -2.05 0.54 -0.13 2.61 2.01 -1.26 -0.69 115.64 116.68 1v88 s THR 49 Ca 0.26 -0.70 -0.01 0.00 0.31 0.00 0.00 61.69 61.54 1v88 s THR 49 Cb -0.02 -0.54 -0.02 0.00 0.01 0.00 0.00 72.50 71.93 1v88 s THR 49 CO 0.02 -0.13 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.04 1v88 s VAL 50 N -0.78 3.42 -0.12 3.82 1.01 0.58 -2.12 120.40 126.21 1v88 s VAL 50 Ca -0.04 -0.54 -0.15 0.00 0.00 0.00 0.00 61.98 61.25 1v88 s VAL 50 Cb -0.06 -2.45 -0.05 0.00 0.00 0.00 0.00 36.38 33.82 1v88 s VAL 50 CO 0.00 0.53 0.36 -0.76 0.00 0.00 0.00 175.10 175.23 1v88 s LEU 51 N 0.14 4.30 -0.61 3.92 1.43 -0.90 -0.38 118.68 126.58 1v88 s LEU 51 Ca -0.04 0.68 0.02 0.00 -1.03 0.00 0.00 54.13 53.76 1v88 s LEU 51 Cb -0.14 -2.50 0.39 0.00 0.03 0.00 0.00 46.19 43.97 1v88 s LEU 51 CO 0.04 0.12 1.50 0.18 0.23 0.00 0.00 176.35 178.42 1v88 n LEU 52 N 3.23 5.90 -0.35 1.79 4.77 -1.21 -4.54 117.00 126.59 1v88 n LEU 52 Ca -0.11 -5.06 0.10 0.00 -0.03 0.00 0.00 56.01 50.90 1v88 n LEU 52 Cb 0.52 -0.72 0.27 0.00 -2.33 0.00 0.00 43.42 41.17 1v88 n LEU 52 CO 0.40 2.04 1.20 0.78 -1.33 0.00 0.00 177.39 180.48 1v88 h ASN 53 N 2.76 0.82 0.00 -1.43 2.35 -1.90 -3.38 115.58 114.80 1v88 h ASN 53 Ca 0.41 0.08 -0.12 0.00 -0.55 0.00 0.00 56.30 56.12 1v88 h ASN 53 Cb 0.54 -0.08 -0.11 0.00 0.05 0.00 0.00 38.32 38.72 1v88 h ASN 53 CO 1.10 0.37 0.04 0.00 -1.65 0.00 0.00 177.43 177.28 1v88 n ALA 54 N -2.35 -2.90 -2.83 -0.83 0.00 -1.26 -5.00 120.51 105.34 1v88 n ALA 54 Ca 0.21 -0.50 -0.29 0.00 0.00 0.00 0.00 53.44 52.86 1v88 n ALA 54 Cb 0.46 -2.91 -0.04 0.00 0.00 0.00 0.00 19.45 16.96 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 -3.01 1.72 -0.07 0.00 2.02 -1.10 -4.82 118.70 113.44 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 -0.12 -1.38 -0.01 0.00 0.10 0.00 0.00 34.13 32.72 1v88 s GLU 56 CO 0.28 0.03 -0.23 0.42 0.02 0.00 0.00 175.26 175.78 1v88 s ILE 57 N -2.86 2.24 -0.09 -1.63 1.09 -1.26 -3.14 121.20 115.55 1v88 s ILE 57 Ca 0.32 -0.99 0.08 0.00 -1.10 0.00 0.00 60.65 58.97 1v88 s ILE 57 Cb 0.05 -1.84 -0.12 0.00 -1.06 0.00 0.00 42.46 39.49 1v88 s ILE 57 CO 0.15 0.56 0.05 2.30 -0.10 0.00 0.00 174.94 177.90 1v88 n ILE 58 N 3.10 0.59 0.00 2.92 -5.35 -1.06 -5.02 119.36 114.53 1v88 n ILE 58 Ca -0.18 -0.38 0.00 0.00 -0.27 0.00 0.00 62.75 61.92 1v88 n ILE 58 Cb 0.52 -0.68 0.00 0.00 -1.74 0.00 0.00 39.64 37.74 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 -2.30 0.00 -2.83 6.28 2.13 -1.26 -4.91 120.64 117.75 1v88 n GLU 59 Ca -0.14 0.00 -0.03 0.00 0.66 0.00 0.00 57.16 57.65 1v88 n GLU 59 Cb 0.76 0.00 0.01 0.00 0.27 0.00 0.00 31.44 32.48 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 -4.06 0.87 0.00 5.31 0.52 0.58 -4.43 118.95 117.75 1v88 s ARG 60 Ca 0.00 -0.76 0.22 0.00 -0.52 0.00 0.00 55.73 54.67 1v88 s ARG 60 Cb 0.00 -0.01 0.94 0.00 0.52 0.00 0.00 34.95 36.39 1v88 s ARG 60 CO 0.00 -1.11 1.70 -0.35 0.02 0.00 0.00 175.30 175.56 1v88 n PRO 61 N 3.20 0.01 -1.30 3.54 -0.04 -1.02 -2.73 135.00 136.66 1v88 n PRO 61 Ca 0.15 0.12 0.15 0.00 -0.04 0.00 0.00 63.50 63.89 1v88 n PRO 61 Cb 0.58 -1.50 -0.06 0.00 -0.04 0.00 0.00 33.50 32.48 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 -1.49 -7.14 -4.56 3.54 7.64 -1.26 -3.55 113.62 106.79 1v88 n SER 62 Ca 0.05 0.92 -0.23 0.00 1.01 0.00 0.00 58.87 60.62 1v88 n SER 62 Cb 0.25 -4.22 -0.06 0.00 -1.01 0.00 0.00 64.21 59.18 1v88 n SER 62 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1v88 s LYS 63 N -3.43 2.22 -0.07 1.43 1.02 -1.26 -4.20 119.74 115.44 1v88 s LYS 63 Ca 0.00 0.05 -0.06 0.00 0.02 0.00 0.00 55.97 55.98 1v88 s LYS 63 Cb 0.00 -4.93 0.02 0.00 -0.52 0.00 0.00 37.83 32.40 1v88 s LYS 63 CO 0.00 -3.73 0.11 1.63 -0.92 0.00 0.00 175.35 172.45 1v88 n LYS 64 N 8.86 -4.00 0.00 1.68 4.76 -1.26 -5.03 118.16 123.17 1v88 n LYS 64 Ca 0.42 2.99 0.00 0.00 -2.87 0.00 0.00 58.31 58.84 1v88 n LYS 64 Cb 0.46 -4.01 0.00 0.00 -1.84 0.00 0.00 35.03 29.64 1v88 n LYS 64 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1v88 n ASP 65 N 1.90 0.00 0.00 4.39 2.03 -1.23 -5.09 116.55 118.55 1v88 n ASP 65 Ca -0.19 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.12 1v88 n ASP 65 Cb 0.29 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.69 1v88 n ASP 65 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1v88 n GLY 66 N 0.00 0.77 3.64 0.27 0.00 -1.26 -4.52 105.19 104.10 1v88 n GLY 66 Ca 0.00 0.61 -0.04 0.00 0.00 0.00 0.00 46.02 46.59 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 -0.48 0.12 1.61 2.19 -1.26 -4.83 117.98 115.33 1v88 s PHE 67 Ca 0.00 1.03 -0.11 0.00 0.33 0.00 0.00 56.93 58.18 1v88 s PHE 67 Cb 0.00 0.35 0.01 0.00 -1.31 0.00 0.00 43.02 42.06 1v88 s PHE 67 CO 0.00 -0.24 0.28 0.00 1.83 0.00 0.00 175.22 177.09 1v88 s PHE 69 N -3.88 1.44 -0.08 0.00 -0.71 -1.23 0.22 117.98 113.74 1v88 s PHE 69 Ca 0.08 -1.19 -0.00 0.00 -1.04 0.00 0.00 56.93 54.78 1v88 s PHE 69 Cb 0.04 -0.83 0.02 0.00 -1.21 0.00 0.00 43.02 41.04 1v88 s PHE 69 CO -0.08 -0.37 -0.06 0.21 -1.34 0.00 0.00 175.22 173.59 1v88 s LYS 70 N -4.04 1.18 -0.09 1.99 2.36 -1.26 -3.54 119.74 116.34 1v88 s LYS 70 Ca 0.36 -0.15 0.02 0.00 -2.55 0.00 0.00 55.97 53.65 1v88 s LYS 70 Cb 0.08 -1.26 -0.02 0.00 -1.05 0.00 0.00 37.83 35.57 1v88 s LYS 70 CO 0.12 -0.20 -0.15 -1.17 1.55 0.00 0.00 175.35 175.51 1v88 s LEU 71 N 1.49 2.68 0.26 5.43 0.20 -1.17 -2.56 118.68 125.00 1v88 s LEU 71 Ca -0.01 -0.28 0.03 0.00 0.69 0.00 0.00 54.13 54.56 1v88 s LEU 71 Cb -0.13 -1.57 -0.04 0.00 -0.43 0.00 0.00 46.19 44.02 1v88 s LEU 71 CO -0.04 0.26 0.19 0.72 -0.29 0.00 0.00 176.35 177.18 1v88 s PHE 72 N -0.20 1.44 -0.22 5.38 -0.71 -1.19 -1.40 117.98 121.08 1v88 s PHE 72 Ca 0.00 -1.48 -0.06 0.00 -1.04 0.00 0.00 56.93 54.35 1v88 s PHE 72 Cb -0.13 -0.66 -0.03 0.00 -1.21 0.00 0.00 43.02 40.99 1v88 s PHE 72 CO 0.03 -0.70 0.03 -1.58 -1.34 0.00 0.00 175.22 171.66 1v88 s HIS 73 N -3.83 3.07 0.08 3.49 2.46 -1.21 -2.73 115.29 116.62 1v88 s HIS 73 Ca 0.39 -0.42 -0.14 0.00 0.47 0.00 0.00 55.06 55.36 1v88 s HIS 73 Cb 0.05 -2.15 -0.21 0.00 -0.13 0.00 0.00 32.58 30.14 1v88 s HIS 73 CO 0.18 -0.27 1.22 -1.00 -2.47 0.00 0.00 174.74 172.40 1v88 h PRO 74 N 7.78 0.70 0.00 2.88 0.13 -1.96 -2.98 132.00 138.55 1v88 h PRO 74 Ca -0.37 -0.68 0.00 0.00 -0.87 0.00 0.00 66.00 64.08 1v88 h PRO 74 Cb 1.17 0.18 0.00 0.00 0.13 0.00 0.00 31.00 32.48 1v88 h PRO 74 CO 0.60 1.27 0.00 -0.07 -0.23 0.00 0.00 178.00 179.58 1v88 h LEU 75 N 0.38 0.00 -2.44 1.56 3.38 -1.94 -3.47 115.31 112.78 1v88 h LEU 75 Ca -0.10 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.84 1v88 h LEU 75 Cb 1.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.29 1v88 h LEU 75 CO 0.18 0.00 -0.27 -0.62 0.09 0.00 0.00 178.44 177.81 1v88 n GLU 76 N -2.46 -1.74 0.00 1.13 1.02 -1.13 -5.01 120.64 112.46 1v88 n GLU 76 Ca 0.01 1.69 0.00 0.00 -0.02 0.00 0.00 57.16 58.84 1v88 n GLU 76 Cb 0.21 -5.45 0.00 0.00 -0.02 0.00 0.00 31.44 26.18 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 -1.23 0.00 -3.47 3.49 1.13 -1.26 -5.14 117.38 110.90 1v88 n GLN 77 Ca 0.03 0.00 0.03 0.00 -1.94 0.00 0.00 57.00 55.12 1v88 n GLN 77 Cb 0.50 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.80 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 -0.13 -0.04 -0.56 1.08 0.15 -1.26 -5.00 113.70 107.94 1v88 s SER 78 Ca 0.00 0.06 0.01 0.00 0.70 0.00 0.00 55.95 56.72 1v88 s SER 78 Cb 0.00 1.03 0.55 0.00 -1.71 0.00 0.00 66.02 65.89 1v88 s SER 78 CO 0.00 -0.01 1.98 2.30 1.20 0.00 0.00 173.24 178.71 1v88 n ILE 79 N 3.60 3.41 -4.11 6.45 -5.35 -1.09 -4.69 119.36 117.58 1v88 n ILE 79 Ca -0.13 -2.41 -0.11 0.00 -0.27 0.00 0.00 62.75 59.82 1v88 n ILE 79 Cb 0.56 -0.83 -0.11 0.00 -1.74 0.00 0.00 39.64 37.52 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 -3.53 0.75 0.26 4.28 0.52 -1.26 -2.12 118.94 117.83 1v88 s TRP 80 Ca 0.60 -0.72 -0.06 0.00 0.02 0.00 0.00 56.10 55.95 1v88 s TRP 80 Cb 0.49 -0.45 -0.06 0.00 -1.15 0.00 0.00 33.47 32.31 1v88 s TRP 80 CO 0.05 -0.13 0.53 0.00 0.02 0.00 0.00 176.95 177.41 1v88 s ALA 81 N -2.53 3.63 0.30 0.98 0.00 -0.90 -4.53 121.76 118.71 1v88 s ALA 81 Ca 0.01 -0.49 0.07 0.00 0.00 0.00 0.00 51.96 51.54 1v88 s ALA 81 Cb -0.02 -2.31 0.47 0.00 0.00 0.00 0.00 23.12 21.26 1v88 s ALA 81 CO -0.03 0.36 1.71 -0.39 0.00 0.00 0.00 175.76 177.42 1v88 h VAL 82 N 1.60 1.30 0.00 0.00 -1.51 -1.95 -3.46 116.25 112.24 1v88 h VAL 82 Ca -0.47 -1.48 0.00 0.00 -1.23 0.00 0.00 66.70 63.52 1v88 h VAL 82 Cb 1.18 1.65 0.00 0.00 -2.13 0.00 0.00 31.29 31.99 1v88 h VAL 82 CO 0.68 0.44 0.00 2.29 -1.23 0.00 0.00 177.57 179.75 1v88 n LYS 83 N -4.04 0.26 0.00 5.19 2.85 -1.26 -4.78 118.16 116.38 1v88 n LYS 83 Ca -0.01 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.25 1v88 n LYS 83 Cb 0.47 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.85 1v88 n LYS 83 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1v88 n GLY 84 N 3.10 5.14 0.08 2.58 0.00 -0.93 -4.64 105.19 110.51 1v88 n GLY 84 Ca 0.00 -0.97 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 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 -0.04 -1.50 1.61 0.13 -1.96 -3.28 132.00 126.95 1v88 h PRO 85 Ca 0.00 0.00 -0.54 0.00 -0.87 0.00 0.00 66.00 64.59 1v88 h PRO 85 Cb 0.00 0.01 -0.22 0.00 0.13 0.00 0.00 31.00 30.92 1v88 h PRO 85 CO 0.00 0.63 0.67 1.63 -0.23 0.00 0.00 178.00 180.70 1v88 n LYS 86 N -4.76 2.36 -3.67 0.86 5.02 -1.26 -4.88 118.16 111.82 1v88 n LYS 86 Ca -0.09 -2.59 -0.26 0.00 -2.02 0.00 0.00 58.31 53.36 1v88 n LYS 86 Cb 0.34 -2.04 0.01 0.00 -0.02 0.00 0.00 35.03 33.31 1v88 n LYS 86 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1v88 n GLY 87 N -0.12 -1.02 3.03 0.72 0.00 -1.24 -4.96 105.19 101.60 1v88 n GLY 87 Ca 0.48 0.65 -0.20 0.00 0.00 0.00 0.00 46.02 46.96 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 -4.42 0.85 0.22 1.61 2.02 -1.26 -4.84 118.70 112.89 1v88 s GLU 88 Ca 0.06 -0.34 -0.17 0.00 0.02 0.00 0.00 54.97 54.53 1v88 s GLU 88 Cb -0.01 -0.82 0.23 0.00 0.10 0.00 0.00 34.13 33.64 1v88 s GLU 88 CO 0.84 0.19 1.57 0.00 0.02 0.00 0.00 175.26 177.88 1v88 h ALA 89 N 6.03 0.18 -2.19 5.21 0.00 -1.90 -2.48 119.26 124.11 1v88 h ALA 89 Ca -0.32 0.25 0.12 0.00 0.00 0.00 0.00 54.91 54.96 1v88 h ALA 89 Cb 1.17 0.86 -0.16 0.00 0.00 0.00 0.00 17.79 19.66 1v88 h ALA 89 CO 0.49 -0.59 0.52 0.54 0.00 0.00 0.00 179.25 180.21 1v88 s VAL 90 N -6.03 0.00 0.00 0.00 0.11 -1.26 -4.61 120.40 108.61 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 0.20 -1.00 0.00 0.00 -1.53 0.00 0.00 36.38 34.05 1v88 s VAL 90 CO 0.72 0.00 0.00 0.61 -3.33 0.00 0.00 175.10 173.10 1v88 n GLY 91 N -0.21 0.77 3.54 6.54 0.00 -1.26 -5.06 105.19 109.51 1v88 n GLY 91 Ca -0.08 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.69 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 3.76 -0.38 1.61 0.15 -1.22 -5.02 113.70 111.59 1v88 s SER 92 Ca 0.00 -1.15 -0.10 0.00 0.70 0.00 0.00 55.95 55.40 1v88 s SER 92 Cb 0.00 -0.36 0.05 0.00 -1.71 0.00 0.00 66.02 64.00 1v88 s SER 92 CO 0.00 -0.17 0.21 -0.63 1.20 0.00 0.00 173.24 173.85 1v88 s ILE 93 N -2.58 4.32 0.12 6.45 1.01 -1.26 -4.84 121.20 124.42 1v88 s ILE 93 Ca 0.32 -1.10 0.00 0.00 0.00 0.00 0.00 60.65 59.87 1v88 s ILE 93 Cb 0.01 -3.50 -0.00 0.00 0.01 0.00 0.00 42.46 38.98 1v88 s ILE 93 CO 0.17 -0.32 0.01 0.35 0.00 0.00 0.00 174.94 175.14 1v88 n THR 94 N 4.94 0.00 -0.97 2.92 -2.24 -1.26 -5.12 114.28 112.56 1v88 n THR 94 Ca -0.11 -0.61 -0.36 0.00 -2.27 0.00 0.00 64.05 60.70 1v88 n THR 94 Cb 0.45 0.14 0.05 0.00 -2.10 0.00 0.00 70.33 68.87 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 -0.30 -0.08 -1.57 -0.78 10.64 -1.26 -4.91 117.38 119.11 1v88 n GLN 95 Ca -0.05 -0.02 -0.31 0.00 -1.83 0.00 0.00 57.00 54.80 1v88 n GLN 95 Cb 0.16 -1.13 0.05 0.00 -0.86 0.00 0.00 30.24 28.47 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 -2.24 2.94 0.19 2.61 0.04 -1.26 -5.08 135.00 132.19 1v88 s PRO 96 Ca 0.42 0.96 -0.03 0.00 0.04 0.00 0.00 61.00 62.38 1v88 s PRO 96 Cb -0.14 -1.99 -0.03 0.00 0.04 0.00 0.00 34.50 32.38 1v88 s PRO 96 CO 0.78 -1.10 0.17 -0.48 0.04 0.00 0.00 177.00 176.41 1v88 s LEU 97 N -5.54 1.16 1.12 -3.56 0.05 -1.26 -4.84 118.68 105.81 1v88 s LEU 97 Ca 0.58 -1.25 -0.19 0.00 0.05 0.00 0.00 54.13 53.32 1v88 s LEU 97 Cb -0.14 0.61 0.27 0.00 -2.05 0.00 0.00 46.19 44.88 1v88 s LEU 97 CO 0.55 -0.86 1.24 -2.16 -0.55 0.00 0.00 176.35 174.57 1v88 s PRO 98 N -4.10 -0.64 0.00 1.48 0.04 -1.26 -5.04 135.00 125.48 1v88 s PRO 98 Ca 0.32 -0.38 0.00 0.00 0.04 0.00 0.00 61.00 60.98 1v88 s PRO 98 Cb 0.06 -1.69 0.00 0.00 0.04 0.00 0.00 34.50 32.90 1v88 s PRO 98 CO 0.08 -3.27 0.00 0.45 0.04 0.00 0.00 177.00 174.30 1v88 n SER 99 N -4.38 2.47 -0.08 6.66 2.88 -1.26 -4.88 113.62 115.02 1v88 n SER 99 Ca 0.16 0.00 -0.13 0.00 -1.33 0.00 0.00 58.87 57.57 1v88 n SER 99 Cb 0.60 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.98 1v88 n SER 99 CO 0.00 0.00 0.00 0.77 -1.23 0.00 0.00 175.04 174.58 1v88 h SER 100 N 0.00 0.00 -0.62 -3.46 4.64 -1.96 -2.88 113.55 109.28 1v88 h SER 100 Ca 0.00 -0.37 -0.53 0.00 -0.47 0.00 0.00 61.79 60.43 1v88 h SER 100 Cb 0.62 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.72 1v88 h SER 100 CO 0.00 1.11 -0.14 -0.72 -0.87 0.00 0.00 176.83 176.21 1v88 s TYR 101 N -2.23 1.29 -0.30 4.77 -0.85 -1.26 -3.30 117.35 115.46 1v88 s TYR 101 Ca -0.20 -0.80 -0.12 0.00 -0.52 0.00 0.00 57.07 55.42 1v88 s TYR 101 Cb 0.03 -2.10 0.15 0.00 0.38 0.00 0.00 41.96 40.42 1v88 s TYR 101 CO 0.43 -1.05 0.81 -0.51 -1.52 0.00 0.00 175.55 173.71 1v88 s LEU 102 N -4.60 -0.88 -0.04 -3.49 1.43 -0.49 -4.48 118.68 106.13 1v88 s LEU 102 Ca 0.54 1.22 -0.16 0.00 -1.03 0.00 0.00 54.13 54.69 1v88 s LEU 102 Cb -0.04 2.01 -0.05 0.00 0.03 0.00 0.00 46.19 48.13 1v88 s LEU 102 CO 0.34 -0.17 0.45 -0.63 0.23 0.00 0.00 176.35 176.57 1v88 s ILE 103 N 2.67 5.05 0.10 -0.59 -1.09 -1.26 -3.02 121.20 123.06 1v88 s ILE 103 Ca -0.04 0.92 0.02 0.00 -2.23 0.00 0.00 60.65 59.31 1v88 s ILE 103 Cb -0.09 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.98 1v88 s ILE 103 CO -0.18 0.48 -0.07 -0.63 -1.23 0.00 0.00 174.94 173.31 1v88 s ILE 104 N -0.45 0.70 0.02 2.92 1.01 -1.23 -4.17 121.20 120.00 1v88 s ILE 104 Ca 0.25 -1.90 0.00 0.00 0.00 0.00 0.00 60.65 59.00 1v88 s ILE 104 Cb -0.16 -1.64 -0.02 0.00 0.01 0.00 0.00 42.46 40.65 1v88 s ILE 104 CO 0.13 -0.85 -0.03 -0.60 0.00 0.00 0.00 174.94 173.59 1v88 s ARG 105 N -3.73 0.30 0.39 2.79 3.52 0.16 -3.52 118.95 118.85 1v88 s ARG 105 Ca 0.11 -0.54 0.08 0.00 -0.13 0.00 0.00 55.73 55.25 1v88 s ARG 105 Cb 0.05 0.04 -0.07 0.00 -1.56 0.00 0.00 34.95 33.41 1v88 s ARG 105 CO -0.04 -0.03 0.02 0.00 -0.81 0.00 0.00 175.30 174.44 1v88 s ALA 106 N -1.25 3.21 0.06 6.12 0.00 -1.26 -1.44 121.76 127.21 1v88 s ALA 106 Ca -0.13 -2.18 -0.27 0.00 0.00 0.00 0.00 51.96 49.38 1v88 s ALA 106 Cb -0.09 -0.06 -0.17 0.00 0.00 0.00 0.00 23.12 22.81 1v88 s ALA 106 CO -0.01 -0.06 1.59 1.15 0.00 0.00 0.00 175.76 178.44 1v88 h THR 107 N 1.77 0.72 -3.48 0.00 2.02 -1.93 -3.46 112.91 108.55 1v88 h THR 107 Ca -0.43 -0.16 -0.42 0.00 0.77 0.00 0.00 66.41 66.17 1v88 h THR 107 Cb 1.25 0.81 -0.14 0.00 -1.74 0.00 0.00 68.15 68.33 1v88 h THR 107 CO 0.75 0.03 -0.58 -0.55 0.37 0.00 0.00 175.52 175.54 1v88 s SER 108 N -4.90 1.75 0.09 4.18 0.15 -1.26 -4.97 113.70 108.74 1v88 s SER 108 Ca -0.15 -1.48 -0.33 0.00 0.70 0.00 0.00 55.95 54.69 1v88 s SER 108 Cb 0.04 0.23 -0.16 0.00 -1.71 0.00 0.00 66.02 64.43 1v88 s SER 108 CO 0.63 -0.78 1.59 -0.08 1.20 0.00 0.00 173.24 175.80 1v88 h GLU 109 N 2.20 -0.86 -0.72 5.44 4.81 -1.89 0.12 114.58 123.68 1v88 h GLU 109 Ca -0.37 0.06 0.11 0.00 -0.13 0.00 0.00 59.36 59.03 1v88 h GLU 109 Cb 1.25 0.20 -0.13 0.00 0.63 0.00 0.00 28.75 30.70 1v88 h GLU 109 CO 0.59 -0.57 -0.39 0.66 -0.73 0.00 0.00 179.01 178.57 1v88 h SER 110 N -0.89 -1.37 0.42 1.04 4.64 -1.97 1.40 113.55 116.82 1v88 h SER 110 Ca -0.05 0.26 -0.01 0.00 -0.47 0.00 0.00 61.79 61.52 1v88 h SER 110 Cb 0.77 0.67 -0.02 0.00 -0.31 0.00 0.00 62.40 63.51 1v88 h SER 110 CO -0.02 -0.31 -0.43 0.44 -0.87 0.00 0.00 176.83 175.64 1v88 h ASP 111 N -0.13 -1.19 -0.48 4.97 5.19 -1.90 -0.59 116.42 122.29 1v88 h ASP 111 Ca 0.25 0.10 0.10 0.00 -0.62 0.00 0.00 57.03 56.85 1v88 h ASP 111 Cb 0.56 0.39 -0.10 0.00 0.18 0.00 0.00 39.33 40.36 1v88 h ASP 111 CO -0.78 -0.57 -0.23 1.23 -3.12 0.00 0.00 179.24 175.77 1v88 h GLY 112 N -0.86 0.09 0.47 2.75 0.00 0.60 0.68 103.07 106.81 1v88 h GLY 112 Ca -0.05 0.30 0.22 0.00 0.00 0.00 0.00 47.33 47.79 1v88 h GLY 112 CO -0.06 -0.21 0.55 3.21 0.00 0.00 0.00 176.54 180.03 1v88 h ARG 113 N -0.13 0.04 0.11 4.80 3.08 0.21 1.22 114.38 123.72 1v88 h ARG 113 Ca 0.22 -0.00 -0.28 0.00 0.07 0.00 0.00 59.98 59.99 1v88 h ARG 113 Cb 0.48 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.51 1v88 h ARG 113 CO -0.56 0.03 -1.36 0.00 -1.07 0.00 0.00 179.97 177.01 1v88 h TRP 115 N 0.06 -0.45 -0.12 0.00 4.06 0.52 1.52 115.95 121.54 1v88 h TRP 115 Ca -0.17 -0.01 -0.01 0.00 2.06 0.00 0.00 58.89 60.76 1v88 h TRP 115 Cb 1.98 0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 30.28 1v88 h TRP 115 CO 0.06 -0.12 0.04 0.00 -3.56 0.00 0.00 178.44 174.86 1v88 h MET 116 N -0.86 0.16 0.03 0.49 -0.00 0.10 -0.06 114.93 114.79 1v88 h MET 116 Ca -0.05 -0.01 -0.00 0.00 -0.00 0.00 0.00 59.70 59.64 1v88 h MET 116 Cb 0.54 -0.03 0.00 0.00 -0.00 0.00 0.00 31.60 32.10 1v88 h MET 116 CO 0.08 0.14 -0.02 -0.44 -0.00 0.00 0.00 176.91 176.68 1v88 h ASP 117 N 0.16 -0.04 -0.83 -0.10 3.32 -1.18 -2.97 116.42 114.80 1v88 h ASP 117 Ca 0.04 -0.57 0.19 0.00 0.02 0.00 0.00 57.03 56.71 1v88 h ASP 117 Cb 0.04 0.01 -0.12 0.00 0.22 0.00 0.00 39.33 39.48 1v88 h ASP 117 CO -0.00 0.72 0.29 0.00 -1.72 0.00 0.00 179.24 178.52 1v88 h ALA 118 N -0.33 1.21 0.15 3.45 0.00 0.24 -1.23 119.26 122.74 1v88 h ALA 118 Ca -0.00 0.17 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 1v88 h ALA 118 Cb 0.61 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 1v88 h ALA 118 CO 0.01 -0.34 -0.13 -0.07 0.00 0.00 0.00 179.25 178.72 1v88 h LEU 119 N 0.34 -0.34 -0.83 0.00 3.38 -1.09 1.15 115.31 117.91 1v88 h LEU 119 Ca 0.49 0.03 0.16 0.00 0.09 0.00 0.00 57.88 58.64 1v88 h LEU 119 Cb 0.89 0.11 -0.15 0.00 0.09 0.00 0.00 40.66 41.60 1v88 h LEU 119 CO -0.53 -0.17 -0.24 1.21 0.09 0.00 0.00 178.44 178.80 1v88 n GLU 120 N -3.05 -0.10 0.07 1.13 2.13 -0.73 0.11 120.64 120.19 1v88 n GLU 120 Ca -0.03 1.29 -0.13 0.00 0.66 0.00 0.00 57.16 58.95 1v88 n GLU 120 Cb 0.12 -1.93 -0.08 0.00 0.27 0.00 0.00 31.44 29.82 1v88 n GLU 120 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1v88 h LEU 121 N 0.00 -0.13 -0.30 4.31 3.38 -0.90 -0.72 115.31 120.94 1v88 h LEU 121 Ca 0.37 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 58.17 1v88 h LEU 121 Cb 0.58 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 1v88 h LEU 121 CO -0.85 0.13 -0.20 0.00 0.09 0.00 0.00 178.44 177.61 1v88 h ALA 122 N 0.46 -0.26 -0.69 1.53 0.00 0.89 1.74 119.26 122.93 1v88 h ALA 122 Ca -0.02 0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.07 1v88 h ALA 122 Cb 0.32 1.07 -0.04 0.00 0.00 0.00 0.00 17.79 19.14 1v88 h ALA 122 CO 0.03 -0.39 0.47 1.37 0.00 0.00 0.00 179.25 180.73 1v88 h LEU 123 N -0.03 0.29 -0.65 0.00 8.10 -0.93 1.56 115.31 123.65 1v88 h LEU 123 Ca 0.05 0.02 0.00 0.00 0.11 0.00 0.00 57.88 58.05 1v88 h LEU 123 Cb 0.16 -0.04 0.00 0.00 -0.44 0.00 0.00 40.66 40.34 1v88 h LEU 123 CO -0.30 0.15 0.00 0.29 -4.11 0.00 0.00 178.44 174.47 1v88 n LYS 124 N -4.45 1.41 -1.74 0.17 4.76 0.37 -4.84 118.16 113.84 1v88 n LYS 124 Ca 0.13 -0.64 0.00 0.00 -2.87 0.00 0.00 58.31 54.93 1v88 n LYS 124 Cb 0.54 -1.15 0.00 0.00 -1.84 0.00 0.00 35.03 32.58 1v88 n LYS 124 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1v88 n SER 125 N 0.00 -7.54 0.00 4.39 3.41 0.53 -4.96 113.62 109.46 1v88 n SER 125 Ca 0.07 1.09 0.00 0.00 -0.26 0.00 0.00 58.87 59.77 1v88 n SER 125 Cb 0.15 -4.22 0.00 0.00 -0.26 0.00 0.00 64.21 59.88 1v88 n SER 125 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1v88 n GLY 126 N 1.49 3.58 3.77 5.00 0.00 -1.23 -4.76 105.19 113.04 1v88 n GLY 126 Ca 0.00 -1.37 -0.30 0.00 0.00 0.00 0.00 46.02 44.35 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 -2.43 0.16 0.22 1.61 0.04 -1.26 -4.14 135.00 129.20 1v88 s PRO 127 Ca 0.00 -0.08 -0.14 0.00 0.04 0.00 0.00 61.00 60.82 1v88 s PRO 127 Cb 0.00 -1.76 0.26 0.00 0.04 0.00 0.00 34.50 33.04 1v88 s PRO 127 CO 0.00 -2.79 1.61 1.03 0.04 0.00 0.00 177.00 176.88 1v88 h SER 128 N -1.92 -0.76 -3.74 6.66 0.87 -1.89 -3.32 113.55 109.45 1v88 h SER 128 Ca -0.46 0.22 -0.65 0.00 -1.23 0.00 0.00 61.79 59.66 1v88 h SER 128 Cb 1.28 0.47 -0.38 0.00 -0.44 0.00 0.00 62.40 63.33 1v88 h SER 128 CO 0.44 -0.25 -0.77 -0.44 -0.53 0.00 0.00 176.83 175.28 1v88 s SER 129 N -5.23 4.42 0.00 6.23 0.01 -1.26 -4.36 113.70 113.51 1v88 s SER 129 Ca -0.14 -1.61 0.28 0.00 1.31 0.00 0.00 55.95 55.79 1v88 s SER 129 Cb 0.20 -1.47 1.02 0.00 0.21 0.00 0.00 66.02 65.98 1v88 s SER 129 CO 0.74 -0.27 1.73 0.61 0.41 0.00 0.00 173.24 176.45