#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wim n SER 2 N 0.00 -0.67 -3.98 1.61 7.64 -1.26 -4.91 113.62 112.05 1wim n SER 2 Ca 0.00 -0.98 -0.28 0.00 1.01 0.00 0.00 58.87 58.63 1wim n SER 2 Cb 0.00 -3.20 0.18 0.00 -1.01 0.00 0.00 64.21 60.18 1wim n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wim n SER 3 N -2.98 -2.72 0.00 6.43 7.64 -1.26 -4.63 113.62 116.10 1wim n SER 3 Ca -0.28 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.32 1wim n SER 3 Cb 0.67 -0.90 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 1wim n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wim n GLY 4 N 2.14 2.50 3.57 0.23 0.00 -1.26 -5.07 105.19 107.30 1wim n GLY 4 Ca 0.03 -0.51 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 1wim n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wim s SER 5 N 0.00 6.51 1.19 1.61 0.01 -1.26 -3.86 113.70 117.90 1wim s SER 5 Ca 0.00 0.14 -0.13 0.00 1.31 0.00 0.00 55.95 57.27 1wim s SER 5 Cb 0.00 -2.46 0.19 0.00 0.21 0.00 0.00 66.02 63.96 1wim s SER 5 CO 0.00 -1.07 0.59 -0.24 0.41 0.00 0.00 173.24 172.93 1wim n SER 6 N 7.22 -2.20 -3.91 2.44 2.88 0.25 -4.77 113.62 115.52 1wim n SER 6 Ca 0.07 -0.75 -0.11 0.00 -1.33 0.00 0.00 58.87 56.75 1wim n SER 6 Cb 0.49 -0.58 -0.11 0.00 -0.75 0.00 0.00 64.21 63.26 1wim n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1wim s GLY 7 N -3.29 0.10 0.35 0.46 0.00 -1.26 -3.03 107.32 100.64 1wim s GLY 7 Ca 0.40 -0.23 0.07 0.00 0.00 0.00 0.00 44.72 44.96 1wim s GLY 7 CO 0.32 -0.33 0.31 0.00 0.00 0.00 0.00 173.10 173.40 1wim n LYS 9 N -1.41 1.61 0.00 0.00 4.76 -1.26 -3.85 118.16 118.01 1wim n LYS 9 Ca -0.01 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.43 1wim n LYS 9 Cb 0.60 -1.36 0.00 0.00 -1.84 0.00 0.00 35.03 32.43 1wim n LYS 9 CO 0.00 0.00 0.00 1.28 -1.37 0.00 0.00 177.40 177.31 1wim n LEU 10 N -2.56 0.81 0.08 -0.35 4.77 -1.26 -4.34 117.00 114.14 1wim n LEU 10 Ca -0.23 0.29 0.12 0.00 -0.03 0.00 0.00 56.01 56.16 1wim n LEU 10 Cb 0.94 -0.34 0.46 0.00 -2.33 0.00 0.00 43.42 42.15 1wim n LEU 10 CO 0.28 -0.34 0.87 0.00 -1.33 0.00 0.00 177.39 176.88 1wim n LEU 12 N -2.00 -2.33 -4.74 0.00 4.77 -1.25 -4.96 117.00 106.49 1wim n LEU 12 Ca 0.05 -0.97 -0.28 0.00 -0.03 0.00 0.00 56.01 54.78 1wim n LEU 12 Cb 0.32 -2.29 -0.07 0.00 -2.33 0.00 0.00 43.42 39.05 1wim n LEU 12 CO 0.24 0.42 -0.28 -0.83 -1.33 0.00 0.00 177.39 175.62 1wim s GLY 13 N -4.23 1.81 -0.53 -0.72 0.00 -1.26 -4.79 107.32 97.60 1wim s GLY 13 Ca 0.09 -1.20 -0.21 0.00 0.00 0.00 0.00 44.72 43.41 1wim s GLY 13 CO 0.88 -1.20 0.73 -0.54 0.00 0.00 0.00 173.10 172.97 1wim s GLU 14 N -2.79 3.17 0.11 2.90 2.02 -1.26 -2.71 118.70 120.14 1wim s GLU 14 Ca 0.29 -0.75 0.06 0.00 0.02 0.00 0.00 54.97 54.59 1wim s GLU 14 Cb -0.11 -4.11 -0.03 0.00 0.10 0.00 0.00 34.13 29.98 1wim s GLU 14 CO 0.21 -1.35 -0.16 0.71 0.02 0.00 0.00 175.26 174.69 1wim s TYR 15 N 3.07 1.48 0.37 1.61 2.02 -1.17 -4.90 117.35 119.83 1wim s TYR 15 Ca 0.19 -0.48 -0.26 0.00 -0.37 0.00 0.00 57.07 56.14 1wim s TYR 15 Cb -0.18 -0.79 -0.09 0.00 -0.40 0.00 0.00 41.96 40.50 1wim s TYR 15 CO 0.13 0.15 1.20 -1.25 -1.57 0.00 0.00 175.55 174.22 1wim s PRO 16 N -2.22 4.17 0.66 -1.71 0.04 -1.26 0.84 135.00 135.51 1wim s PRO 16 Ca 0.06 1.94 0.19 0.00 0.04 0.00 0.00 61.00 63.23 1wim s PRO 16 Cb -0.08 -2.82 1.02 0.00 0.04 0.00 0.00 34.50 32.67 1wim s PRO 16 CO 0.03 -0.25 1.57 -0.39 0.04 0.00 0.00 177.00 178.00 1wim h VAL 17 N 2.56 0.02 -0.50 -0.36 -1.51 -1.95 0.45 116.25 114.97 1wim h VAL 17 Ca -0.49 0.00 -0.06 0.00 -1.23 0.00 0.00 66.70 64.93 1wim h VAL 17 Cb 1.23 0.40 -0.02 0.00 -2.13 0.00 0.00 31.29 30.77 1wim h VAL 17 CO 0.64 0.00 0.08 -0.33 -1.23 0.00 0.00 177.57 176.73 1wim h GLU 18 N 0.00 0.78 -1.27 5.19 4.39 -1.92 -2.84 114.58 118.91 1wim h GLU 18 Ca 0.03 -0.17 -0.68 0.00 0.34 0.00 0.00 59.36 58.88 1wim h GLU 18 Cb 1.25 -0.11 -0.31 0.00 -0.10 0.00 0.00 28.75 29.47 1wim h GLU 18 CO -0.00 0.73 0.58 1.04 -1.16 0.00 0.00 179.01 180.20 1wim n GLN 19 N -4.26 2.89 -4.15 2.33 6.02 0.16 -4.96 117.38 115.40 1wim n GLN 19 Ca 0.03 -3.56 -0.10 0.00 -0.01 0.00 0.00 57.00 53.37 1wim n GLN 19 Cb 0.24 -2.28 -0.10 0.00 1.02 0.00 0.00 30.24 29.12 1wim n GLN 19 CO 0.00 0.00 0.00 -1.64 -1.01 0.00 0.00 177.06 174.41 1wim s MET 20 N -3.85 0.85 -0.21 -1.09 -1.94 -1.07 -2.94 119.30 109.05 1wim s MET 20 Ca 0.58 -1.38 -0.01 0.00 -1.71 0.00 0.00 55.69 53.18 1wim s MET 20 Cb 0.47 0.10 0.06 0.00 2.01 0.00 0.00 34.83 37.46 1wim s MET 20 CO -0.13 -0.16 -0.02 0.99 -0.01 0.00 0.00 175.02 175.69 1wim s THR 21 N -3.89 1.11 -0.26 2.05 2.01 0.39 -4.81 115.64 112.23 1wim s THR 21 Ca 0.17 -0.92 -0.23 0.00 0.31 0.00 0.00 61.69 61.02 1wim s THR 21 Cb 0.07 -1.46 -0.01 0.00 0.01 0.00 0.00 72.50 71.11 1wim s THR 21 CO -0.02 -0.13 0.74 -0.89 -0.69 0.00 0.00 174.62 173.63 1wim s THR 22 N 1.59 4.89 0.09 -0.82 2.01 -1.26 -2.36 115.64 119.78 1wim s THR 22 Ca -0.04 1.31 -0.30 0.00 0.31 0.00 0.00 61.69 62.98 1wim s THR 22 Cb -0.18 -4.05 -0.06 0.00 0.01 0.00 0.00 72.50 68.23 1wim s THR 22 CO -0.07 -0.07 1.06 -0.63 -0.69 0.00 0.00 174.62 174.23 1wim s ILE 23 N 2.72 4.30 -0.56 1.82 1.01 -0.44 -4.93 121.20 125.13 1wim s ILE 23 Ca 0.31 1.80 0.06 0.00 0.00 0.00 0.00 60.65 62.82 1wim s ILE 23 Cb -0.15 -4.15 0.40 0.00 0.01 0.00 0.00 42.46 38.57 1wim s ILE 23 CO 0.09 0.22 1.18 0.00 0.00 0.00 0.00 174.94 176.43 1wim n ALA 24 N 3.20 3.33 -0.06 9.38 0.00 -1.26 -1.96 120.51 133.15 1wim n ALA 24 Ca 0.05 -1.03 -0.11 0.00 0.00 0.00 0.00 53.44 52.35 1wim n ALA 24 Cb 0.48 -1.09 -0.05 0.00 0.00 0.00 0.00 19.45 18.79 1wim n ALA 24 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1wim n GLN 25 N 0.21 0.26 -0.49 0.00 1.13 -1.26 -4.79 117.38 112.45 1wim n GLN 25 Ca 0.16 0.09 0.05 0.00 -1.94 0.00 0.00 57.00 55.36 1wim n GLN 25 Cb 0.78 -1.05 0.07 0.00 0.11 0.00 0.00 30.24 30.15 1wim n GLN 25 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1wim n GLN 27 N -0.56 -2.19 -3.93 0.00 3.00 -0.83 -4.92 117.38 107.96 1wim n GLN 27 Ca 0.08 0.27 -0.35 0.00 -0.01 0.00 0.00 57.00 56.99 1wim n GLN 27 Cb 0.74 -4.47 -0.13 0.00 0.00 0.00 0.00 30.24 26.37 1wim n GLN 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wim s ILE 29 N 1.38 5.21 -0.11 0.00 2.07 -1.26 -1.33 121.20 127.15 1wim s ILE 29 Ca 0.05 0.20 -0.18 0.00 -1.41 0.00 0.00 60.65 59.30 1wim s ILE 29 Cb -0.15 -3.61 0.04 0.00 0.13 0.00 0.00 42.46 38.88 1wim s ILE 29 CO -0.00 0.25 0.46 -0.36 -1.91 0.00 0.00 174.94 173.38 1wim s PHE 30 N -1.43 -0.45 0.13 3.50 0.08 -0.99 -4.75 117.98 114.08 1wim s PHE 30 Ca 0.33 0.97 -0.31 0.00 0.12 0.00 0.00 56.93 58.04 1wim s PHE 30 Cb -0.13 0.19 -0.09 0.00 -0.57 0.00 0.00 43.02 42.42 1wim s PHE 30 CO 0.19 -0.34 1.52 0.00 -0.10 0.00 0.00 175.22 176.49 1wim n THR 32 N 4.07 -0.32 -0.04 0.00 -1.04 -1.15 -0.91 114.28 114.88 1wim n THR 32 Ca 0.13 1.39 -0.01 0.00 -2.04 0.00 0.00 64.05 63.52 1wim n THR 32 Cb 0.40 -1.74 -0.01 0.00 -1.82 0.00 0.00 70.33 67.16 1wim n THR 32 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1wim n LEU 33 N -4.25 -0.10 0.00 -4.42 4.77 -1.26 0.13 117.00 111.87 1wim n LEU 33 Ca 0.01 0.79 0.00 0.00 -0.03 0.00 0.00 56.01 56.78 1wim n LEU 33 Cb 0.12 -0.34 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1wim n LEU 33 CO -0.08 -0.45 0.48 0.00 -1.33 0.00 0.00 177.39 176.01 1wim n LEU 35 N -1.93 0.00 -0.06 0.00 -0.00 -0.27 0.04 117.00 114.78 1wim n LEU 35 Ca 0.00 0.77 -0.01 0.00 -0.00 0.00 0.00 56.01 56.77 1wim n LEU 35 Cb 0.00 -0.34 -0.00 0.00 -0.00 0.00 0.00 43.42 43.08 1wim n LEU 35 CO 0.00 -0.77 -0.09 0.50 -0.00 0.00 0.00 177.39 177.02 1wim h LYS 36 N 0.00 0.00 -0.30 1.96 3.64 0.16 -3.25 116.57 118.78 1wim h LYS 36 Ca 0.64 0.00 0.09 0.00 -1.27 0.00 0.00 60.65 60.11 1wim h LYS 36 Cb 2.97 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 34.78 1wim h LYS 36 CO -0.01 0.00 0.30 1.96 -2.27 0.00 0.00 179.45 179.43 1wim h GLN 37 N -1.00 0.00 0.00 1.90 7.50 0.27 -1.05 115.11 122.73 1wim h GLN 37 Ca -0.00 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.15 1wim h GLN 37 Cb 0.14 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.67 1wim h GLN 37 CO -0.00 0.00 0.00 0.98 -1.50 0.00 0.00 178.83 178.31 1wim n TYR 38 N -3.90 0.00 -0.14 2.96 9.36 0.11 -0.90 117.16 124.64 1wim n TYR 38 Ca 0.04 0.00 0.16 0.00 3.32 0.00 0.00 57.90 61.43 1wim n TYR 38 Cb 0.45 -0.47 0.54 0.00 -0.63 0.00 0.00 39.34 39.23 1wim n TYR 38 CO 0.00 0.00 0.00 -0.39 0.22 0.00 0.00 176.86 176.69 1wim h VAL 39 N 0.00 0.78 0.57 2.97 -1.51 -1.55 -1.19 116.25 116.31 1wim h VAL 39 Ca 0.00 -0.12 -0.03 0.00 -1.23 0.00 0.00 66.70 65.32 1wim h VAL 39 Cb 0.00 0.40 0.01 0.00 -2.13 0.00 0.00 31.29 29.57 1wim h VAL 39 CO 0.00 0.06 -0.27 -0.33 -1.23 0.00 0.00 177.57 175.80 1wim h GLU 40 N 0.34 -0.73 -0.90 5.19 5.08 -1.21 -2.27 114.58 120.08 1wim h GLU 40 Ca 0.36 0.05 0.17 0.00 -1.00 0.00 0.00 59.36 58.93 1wim h GLU 40 Cb 0.90 0.17 -0.10 0.00 0.50 0.00 0.00 28.75 30.21 1wim h GLU 40 CO -0.10 -0.49 0.48 -0.07 -1.00 0.00 0.00 179.01 177.83 1wim h LEU 41 N -0.95 0.58 -1.00 1.33 4.07 -0.69 0.11 115.31 118.75 1wim h LEU 41 Ca -0.08 0.10 0.05 0.00 0.08 0.00 0.00 57.88 58.03 1wim h LEU 41 Cb 0.58 0.01 -0.06 0.00 1.08 0.00 0.00 40.66 42.27 1wim h LEU 41 CO 0.13 0.21 0.65 -0.07 -1.08 0.00 0.00 178.44 178.28 1wim h LEU 42 N 0.64 1.07 -0.25 1.67 3.38 -1.21 -0.85 115.31 119.74 1wim h LEU 42 Ca 0.51 -0.00 -0.21 0.00 0.09 0.00 0.00 57.88 58.27 1wim h LEU 42 Cb 0.77 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1wim h LEU 42 CO -0.39 0.71 -0.75 0.40 0.09 0.00 0.00 178.44 178.50 1wim h ILE 43 N 1.22 1.31 -0.85 1.22 2.04 -0.27 -3.21 117.51 118.98 1wim h ILE 43 Ca 0.42 -2.01 -0.02 0.00 1.00 0.00 0.00 64.86 64.24 1wim h ILE 43 Cb 0.08 2.00 -0.04 0.00 -0.74 0.00 0.00 36.82 38.12 1wim h ILE 43 CO -0.15 0.63 0.44 0.11 0.00 0.00 0.00 178.15 179.18 1wim h LYS 44 N 0.46 1.20 -0.14 2.37 1.57 -0.39 -3.00 116.57 118.64 1wim h LYS 44 Ca -0.04 -0.16 0.05 0.00 -1.87 0.00 0.00 60.65 58.63 1wim h LYS 44 Cb 1.36 -0.23 -0.06 0.00 0.08 0.00 0.00 32.23 33.38 1wim h LYS 44 CO 0.15 0.90 -0.35 1.49 -0.57 0.00 0.00 179.45 181.07 1wim h GLU 45 N 1.20 -0.40 0.00 3.15 4.81 -1.17 -3.47 114.58 118.69 1wim h GLU 45 Ca 0.30 0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1wim h GLU 45 Cb 0.07 0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.54 1wim h GLU 45 CO -0.04 -0.27 0.00 0.41 -0.73 0.00 0.00 179.01 178.38 1wim n GLY 46 N -1.42 2.30 0.03 1.92 0.00 -1.14 -4.91 105.19 101.97 1wim n GLY 46 Ca -0.03 -0.73 -0.01 0.00 0.00 0.00 0.00 46.02 45.25 1wim n GLY 46 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1wim n LEU 47 N 0.00 -0.06 -4.40 0.99 7.94 -1.26 -4.48 117.00 115.72 1wim n LEU 47 Ca 0.00 0.87 -0.42 0.00 -1.11 0.00 0.00 56.01 55.35 1wim n LEU 47 Cb 0.00 -0.40 0.00 0.00 0.53 0.00 0.00 43.42 43.55 1wim n LEU 47 CO 0.00 -0.47 -0.10 -0.62 -1.11 0.00 0.00 177.39 175.09 1wim n GLU 48 N -2.99 0.35 0.00 1.96 -0.58 -1.26 -4.91 120.64 113.21 1wim n GLU 48 Ca 0.00 0.13 0.00 0.00 -0.42 0.00 0.00 57.16 56.87 1wim n GLU 48 Cb 0.02 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.58 1wim n GLU 48 CO 0.00 0.00 0.00 0.25 -0.48 0.00 0.00 177.13 176.90 1wim n THR 49 N -0.85 0.00 -4.37 2.62 -2.24 -1.26 -4.90 114.28 103.28 1wim n THR 49 Ca 0.12 0.00 -0.24 0.00 -2.27 0.00 0.00 64.05 61.66 1wim n THR 49 Cb 0.39 0.02 -0.08 0.00 -2.10 0.00 0.00 70.33 68.55 1wim n THR 49 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wim s ALA 50 N -1.70 3.03 -0.84 6.98 0.00 -1.26 -4.40 121.76 123.57 1wim s ALA 50 Ca 0.00 -1.80 -0.01 0.00 0.00 0.00 0.00 51.96 50.15 1wim s ALA 50 Cb 0.00 -0.50 0.21 0.00 0.00 0.00 0.00 23.12 22.83 1wim s ALA 50 CO 0.00 0.22 0.71 0.42 0.00 0.00 0.00 175.76 177.11 1wim s ILE 51 N -2.43 4.11 1.13 0.00 -1.09 -1.26 -5.03 121.20 116.62 1wim s ILE 51 Ca 0.32 -3.83 -0.19 0.00 -2.23 0.00 0.00 60.65 54.72 1wim s ILE 51 Cb -0.04 -3.57 0.28 0.00 -1.58 0.00 0.00 42.46 37.54 1wim s ILE 51 CO 0.18 -1.06 0.95 -1.54 -1.23 0.00 0.00 174.94 172.25 1wim n SER 52 N 2.40 -2.23 -4.74 3.58 3.41 -1.26 -1.11 113.62 113.67 1wim n SER 52 Ca 0.20 -1.06 -0.41 0.00 -0.26 0.00 0.00 58.87 57.34 1wim n SER 52 Cb 0.37 -0.90 -0.04 0.00 -0.26 0.00 0.00 64.21 63.38 1wim n SER 52 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wim n PRO 54 N 2.36 0.49 -4.03 0.00 -0.04 -1.26 -4.70 135.00 127.81 1wim n PRO 54 Ca 0.03 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.14 1wim n PRO 54 Cb 0.45 -1.35 -0.07 0.00 -0.04 0.00 0.00 33.50 32.50 1wim n PRO 54 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1wim s ASP 55 N -1.85 6.01 -0.10 3.54 -1.08 -1.26 -4.94 116.67 116.99 1wim s ASP 55 Ca 0.16 0.32 0.07 0.00 -0.52 0.00 0.00 52.55 52.58 1wim s ASP 55 Cb 0.07 -1.85 -0.24 0.00 -1.46 0.00 0.00 42.92 39.45 1wim s ASP 55 CO 0.13 0.36 0.46 0.00 0.52 0.00 0.00 175.17 176.63 1wim n ALA 56 N 1.71 1.31 -1.18 3.66 0.00 -1.26 -4.21 120.51 120.55 1wim n ALA 56 Ca -0.17 -0.80 -0.27 0.00 0.00 0.00 0.00 53.44 52.20 1wim n ALA 56 Cb 0.54 -0.68 0.05 0.00 0.00 0.00 0.00 19.45 19.36 1wim n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wim n ALA 57 N -2.75 5.83 -2.62 0.00 0.00 -1.26 -4.91 120.51 114.80 1wim n ALA 57 Ca -0.25 -2.69 -0.43 0.00 0.00 0.00 0.00 53.44 50.08 1wim n ALA 57 Cb 1.06 -1.64 -0.06 0.00 0.00 0.00 0.00 19.45 18.81 1wim n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wim n PRO 59 N 6.39 0.11 -0.01 0.00 -0.04 -1.26 -2.21 135.00 137.98 1wim n PRO 59 Ca -0.03 0.20 0.07 0.00 -0.04 0.00 0.00 63.50 63.70 1wim n PRO 59 Cb 0.47 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 1wim n PRO 59 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1wim n LYS 60 N -1.38 0.77 -4.24 0.54 3.00 -1.26 -5.01 118.16 110.57 1wim n LYS 60 Ca 0.05 -0.11 -0.37 0.00 -0.00 0.00 0.00 58.31 57.89 1wim n LYS 60 Cb 0.14 -1.31 -0.06 0.00 0.00 0.00 0.00 35.03 33.81 1wim n LYS 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 1wim n GLN 61 N -1.88 -0.67 -0.06 1.64 6.02 -0.94 -4.92 117.38 116.56 1wim n GLN 61 Ca -0.02 0.07 0.00 0.00 -0.01 0.00 0.00 57.00 57.05 1wim n GLN 61 Cb 0.34 -3.16 0.00 0.00 1.02 0.00 0.00 30.24 28.44 1wim n GLN 61 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1wim n GLY 62 N -2.42 -0.83 3.48 1.08 0.00 -1.26 -4.86 105.19 100.37 1wim n GLY 62 Ca -0.25 -1.70 -0.15 0.00 0.00 0.00 0.00 46.02 43.92 1wim n GLY 62 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1wim s HIS 63 N -0.66 1.10 -0.29 1.61 0.09 -1.26 -1.93 115.29 113.95 1wim s HIS 63 Ca 0.00 -1.32 -0.10 0.00 -0.00 0.00 0.00 55.06 53.65 1wim s HIS 63 Cb 0.00 -0.12 -0.03 0.00 -0.00 0.00 0.00 32.58 32.44 1wim s HIS 63 CO 0.00 -1.12 0.15 -0.51 -0.00 0.00 0.00 174.74 173.25 1wim s LEU 64 N -3.25 3.95 0.36 0.89 2.01 -0.27 -4.66 118.68 117.71 1wim s LEU 64 Ca 0.31 -0.29 -0.27 0.00 0.01 0.00 0.00 54.13 53.88 1wim s LEU 64 Cb -0.00 -2.02 -0.10 0.00 0.01 0.00 0.00 46.19 44.08 1wim s LEU 64 CO 0.21 -0.12 1.28 0.00 1.01 0.00 0.00 176.35 178.73 1wim s GLN 65 N 1.66 4.21 0.61 1.70 -2.07 -1.26 -4.76 119.66 119.75 1wim s GLN 65 Ca 0.06 2.13 0.26 0.00 -1.82 0.00 0.00 55.36 55.99 1wim s GLN 65 Cb -0.16 -2.93 1.19 0.00 -1.09 0.00 0.00 33.01 30.02 1wim s GLN 65 CO 0.07 -0.28 1.61 1.49 -1.32 0.00 0.00 175.29 176.87 1wim h GLU 66 N 3.09 0.00 -0.74 9.60 4.22 -1.99 0.38 114.58 129.13 1wim h GLU 66 Ca -0.49 0.00 0.01 0.00 0.08 0.00 0.00 59.36 58.96 1wim h GLU 66 Cb 1.23 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.45 1wim h GLU 66 CO 0.64 0.00 0.49 -0.97 -2.18 0.00 0.00 179.01 176.99 1wim h ASN 67 N 0.00 0.85 0.20 1.04 -1.24 -2.00 -0.83 115.58 113.60 1wim h ASN 67 Ca 0.29 -0.02 -0.01 0.00 0.71 0.00 0.00 56.30 57.27 1wim h ASN 67 Cb 1.87 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 40.71 1wim h ASN 67 CO -0.00 0.61 -0.10 -0.33 -1.29 0.00 0.00 177.43 176.32 1wim h GLU 68 N 1.00 -0.26 -0.94 6.67 5.08 -0.60 -3.30 114.58 122.23 1wim h GLU 68 Ca 0.27 0.02 0.28 0.00 -1.00 0.00 0.00 59.36 58.93 1wim h GLU 68 Cb -0.12 0.06 -0.16 0.00 0.50 0.00 0.00 28.75 29.03 1wim h GLU 68 CO -0.06 -0.18 0.24 0.82 -1.00 0.00 0.00 179.01 178.83 1wim h ILE 69 N -0.53 0.16 -0.35 3.13 2.04 -1.59 0.86 117.51 121.22 1wim h ILE 69 Ca -0.03 -0.04 0.03 0.00 1.00 0.00 0.00 64.86 65.83 1wim h ILE 69 Cb 0.21 0.04 -0.04 0.00 -0.74 0.00 0.00 36.82 36.29 1wim h ILE 69 CO 0.05 0.02 -0.21 1.21 0.00 0.00 0.00 178.15 179.22 1wim n GLU 70 N -5.31 -0.15 0.07 2.37 2.13 -0.32 -0.55 120.64 118.87 1wim n GLU 70 Ca 0.25 1.00 -0.19 0.00 0.66 0.00 0.00 57.16 58.88 1wim n GLU 70 Cb 0.83 -1.49 -0.10 0.00 0.27 0.00 0.00 31.44 30.95 1wim n GLU 70 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wim h MET 72 N 0.30 0.01 -6.02 0.00 4.05 0.44 -3.41 114.93 110.31 1wim h MET 72 Ca -0.14 -0.00 -0.57 0.00 -0.28 0.00 0.00 59.70 58.71 1wim h MET 72 Cb 1.76 -0.00 -0.09 0.00 -0.80 0.00 0.00 31.60 32.47 1wim h MET 72 CO 0.21 0.01 -0.56 0.14 0.23 0.00 0.00 176.91 176.93 1wim s VAL 73 N -6.20 2.71 0.82 -5.77 -7.23 0.28 -5.02 120.40 99.98 1wim s VAL 73 Ca -0.14 -1.81 -0.14 0.00 -1.81 0.00 0.00 61.98 58.08 1wim s VAL 73 Cb 0.25 -2.91 0.19 0.00 0.56 0.00 0.00 36.38 34.47 1wim s VAL 73 CO 0.77 -0.15 1.11 0.00 -0.31 0.00 0.00 175.10 176.51 1wim n ALA 74 N -1.09 -1.27 0.23 1.32 0.00 -1.26 -4.76 120.51 113.68 1wim n ALA 74 Ca -0.03 -1.45 -0.13 0.00 0.00 0.00 0.00 53.44 51.83 1wim n ALA 74 Cb 0.62 -0.07 -0.07 0.00 0.00 0.00 0.00 19.45 19.93 1wim n ALA 74 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wim h ALA 75 N -1.82 -0.61 -1.11 0.00 0.00 -1.98 0.18 119.26 113.92 1wim h ALA 75 Ca -0.36 -0.19 0.32 0.00 0.00 0.00 0.00 54.91 54.69 1wim h ALA 75 Cb 0.99 0.24 -0.04 0.00 0.00 0.00 0.00 17.79 18.97 1wim h ALA 75 CO 0.25 -0.65 1.07 1.05 0.00 0.00 0.00 179.25 180.97 1wim h GLU 76 N -1.00 0.00 0.00 0.00 9.09 -2.01 0.08 114.58 120.75 1wim h GLU 76 Ca -0.06 0.00 -0.21 0.00 0.05 0.00 0.00 59.36 59.13 1wim h GLU 76 Cb 0.57 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.64 1wim h GLU 76 CO 0.10 0.00 -1.38 -0.89 0.05 0.00 0.00 179.01 176.89 1wim n ILE 77 N -3.57 1.50 -0.30 -1.06 2.08 -1.13 -4.33 119.36 112.55 1wim n ILE 77 Ca 0.25 -0.04 0.14 0.00 0.56 0.00 0.00 62.75 63.65 1wim n ILE 77 Cb 1.42 -2.11 0.30 0.00 -0.75 0.00 0.00 39.64 38.49 1wim n ILE 77 CO 0.00 0.00 0.00 -0.03 0.56 0.00 0.00 176.55 177.08 1wim h MET 78 N -1.00 0.19 -0.49 0.38 4.05 0.12 0.34 114.93 118.51 1wim h MET 78 Ca -0.32 -0.01 0.10 0.00 -0.28 0.00 0.00 59.70 59.18 1wim h MET 78 Cb 1.18 -0.04 -0.10 0.00 -0.80 0.00 0.00 31.60 31.83 1wim h MET 78 CO -0.20 0.12 -0.28 0.37 0.23 0.00 0.00 176.91 177.16 1wim h GLN 79 N 0.19 -0.16 -0.41 0.39 5.75 -1.31 -1.49 115.11 118.07 1wim h GLN 79 Ca 0.56 0.01 0.06 0.00 -0.15 0.00 0.00 58.65 59.13 1wim h GLN 79 Cb 1.15 0.04 -0.09 0.00 1.07 0.00 0.00 27.48 29.65 1wim h GLN 79 CO -0.67 -0.11 -0.49 0.00 -2.65 0.00 0.00 178.83 174.91 1wim h ARG 80 N -0.17 -0.35 -0.16 1.69 3.08 -1.12 0.37 114.38 117.73 1wim h ARG 80 Ca 0.21 0.02 0.05 0.00 0.07 0.00 0.00 59.98 60.34 1wim h ARG 80 Cb 0.52 0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.58 1wim h ARG 80 CO -0.59 -0.23 -0.34 -0.92 -1.07 0.00 0.00 179.97 176.82 1wim h TYR 81 N -0.36 -0.94 -0.83 3.04 3.20 -1.32 -0.10 116.97 119.66 1wim h TYR 81 Ca 0.11 0.04 0.11 0.00 3.14 0.00 0.00 58.73 62.13 1wim h TYR 81 Cb 0.59 0.43 -0.06 0.00 1.54 0.00 0.00 36.73 39.24 1wim h TYR 81 CO -0.68 -0.41 0.54 0.87 -1.64 0.00 0.00 178.16 176.84 1wim h LYS 82 N -0.40 0.71 -0.68 1.82 1.57 -0.46 -0.53 116.57 118.61 1wim h LYS 82 Ca 0.10 -0.04 -0.06 0.00 -1.87 0.00 0.00 60.65 58.77 1wim h LYS 82 Cb 0.56 -0.16 -0.03 0.00 0.08 0.00 0.00 32.23 32.68 1wim h LYS 82 CO -0.38 0.47 0.17 -0.22 -0.57 0.00 0.00 179.45 178.92 1wim h LYS 83 N 0.73 1.07 0.26 3.15 3.64 0.14 -0.25 116.57 125.31 1wim h LYS 83 Ca 0.39 -0.24 -0.01 0.00 -1.27 0.00 0.00 60.65 59.52 1wim h LYS 83 Cb 0.52 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1wim h LYS 83 CO -0.16 0.94 -0.12 -0.07 -2.27 0.00 0.00 179.45 177.77 1wim h LEU 84 N 1.02 -0.29 -0.11 5.20 3.38 0.35 -3.13 115.31 121.73 1wim h LEU 84 Ca 0.22 -0.24 0.03 0.00 0.09 0.00 0.00 57.88 57.99 1wim h LEU 84 Cb 0.34 0.08 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 1wim h LEU 84 CO -0.00 0.15 -0.12 1.56 0.09 0.00 0.00 178.44 180.12 1wim h GLN 85 N -0.81 -0.14 -0.86 1.13 1.08 -1.20 -2.70 115.11 111.61 1wim h GLN 85 Ca -0.04 0.01 0.13 0.00 -1.45 0.00 0.00 58.65 57.31 1wim h GLN 85 Cb 0.51 0.03 -0.14 0.00 -0.05 0.00 0.00 27.48 27.83 1wim h GLN 85 CO 0.06 -0.09 -0.38 0.35 -0.95 0.00 0.00 178.83 177.81 1wim h PHE 86 N -0.15 -1.08 -0.88 2.96 3.57 -1.12 0.98 116.94 121.23 1wim h PHE 86 Ca 0.08 0.10 0.16 0.00 3.53 0.00 0.00 57.97 61.83 1wim h PHE 86 Cb 0.26 0.60 -0.16 0.00 2.79 0.00 0.00 35.95 39.44 1wim h PHE 86 CO -0.23 -0.40 -0.28 0.39 -2.23 0.00 0.00 178.31 175.57 1wim n GLU 87 N -5.45 -0.14 -3.26 1.11 1.02 -1.02 -2.01 120.64 110.89 1wim n GLU 87 Ca 0.08 1.37 -0.45 0.00 -0.02 0.00 0.00 57.16 58.14 1wim n GLU 87 Cb 0.38 -2.04 0.00 0.00 -0.02 0.00 0.00 31.44 29.76 1wim n GLU 87 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1wim n ARG 88 N -5.38 3.64 -3.15 3.49 1.74 0.34 -4.88 116.66 112.47 1wim n ARG 88 Ca 0.12 -4.42 0.05 0.00 -0.77 0.00 0.00 57.85 52.84 1wim n ARG 88 Cb 0.40 -2.59 -0.02 0.00 -1.02 0.00 0.00 32.46 29.24 1wim n ARG 88 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1wim s SER 89 N 1.07 -0.36 0.31 0.55 0.01 -0.85 -4.95 113.70 109.48 1wim s SER 89 Ca 0.32 0.20 -0.26 0.00 1.31 0.00 0.00 55.95 57.52 1wim s SER 89 Cb -0.08 1.29 -0.15 0.00 0.21 0.00 0.00 66.02 67.30 1wim s SER 89 CO -0.05 -0.07 0.61 0.61 0.41 0.00 0.00 173.24 174.75 1wim n GLY 90 N 5.43 -1.38 3.77 3.44 0.00 -1.26 -4.90 105.19 110.30 1wim n GLY 90 Ca -0.05 0.21 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1wim n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wim s PRO 91 N -1.32 3.72 -0.02 1.61 0.04 -1.26 -5.06 135.00 132.71 1wim s PRO 91 Ca 0.62 1.75 0.03 0.00 0.04 0.00 0.00 61.00 63.44 1wim s PRO 91 Cb -0.74 -2.36 -0.00 0.00 0.04 0.00 0.00 34.50 31.43 1wim s PRO 91 CO 0.58 -0.58 -0.11 0.45 0.04 0.00 0.00 177.00 177.38 1wim s SER 92 N -1.41 1.40 0.49 6.66 0.15 -1.26 -5.15 113.70 114.57 1wim s SER 92 Ca 0.65 -0.22 0.03 0.00 0.70 0.00 0.00 55.95 57.10 1wim s SER 92 Cb -0.28 -0.30 -0.03 0.00 -1.71 0.00 0.00 66.02 63.70 1wim s SER 92 CO 0.34 0.11 0.02 -0.44 1.20 0.00 0.00 173.24 174.47 1wim s SER 93 N 0.01 4.10 0.00 5.45 0.01 -1.26 -5.33 113.70 116.68 1wim s SER 93 Ca -0.00 -1.56 0.00 0.00 1.31 0.00 0.00 55.95 55.69 1wim s SER 93 Cb -0.08 0.30 0.00 0.00 0.21 0.00 0.00 66.02 66.45 1wim s SER 93 CO 0.00 -0.77 0.00 0.61 0.41 0.00 0.00 173.24 173.50