#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 -1.21 -3.72 1.61 7.64 -1.26 -4.88 113.62 111.80 1wim n SER 2 Ca 0.00 -1.09 -0.14 0.00 1.01 0.00 0.00 58.87 58.65 1wim n SER 2 Cb 0.00 -1.39 -0.14 0.00 -1.01 0.00 0.00 64.21 61.67 1wim n SER 2 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 1wim s SER 3 N -3.15 0.02 -0.69 6.43 0.15 -1.26 -5.10 113.70 110.09 1wim s SER 3 Ca 0.62 0.38 -0.27 0.00 0.70 0.00 0.00 55.95 57.37 1wim s SER 3 Cb -0.36 0.28 0.01 0.00 -1.71 0.00 0.00 66.02 64.25 1wim s SER 3 CO 0.89 -0.17 1.47 -0.83 1.20 0.00 0.00 173.24 175.80 1wim s GLY 4 N 1.45 0.66 -0.25 9.45 0.00 -1.26 -4.92 107.32 112.44 1wim s GLY 4 Ca -0.07 -1.11 -0.07 0.00 0.00 0.00 0.00 44.72 43.47 1wim s GLY 4 CO -0.07 2.90 0.53 -0.56 0.00 0.00 0.00 173.10 175.90 1wim s SER 5 N 5.18 -0.69 0.10 1.64 0.01 -1.26 -3.27 113.70 115.41 1wim s SER 5 Ca 0.46 1.12 0.22 0.00 1.31 0.00 0.00 55.95 59.07 1wim s SER 5 Cb -0.10 1.80 -0.07 0.00 0.21 0.00 0.00 66.02 67.86 1wim s SER 5 CO 0.17 -0.24 0.89 -0.24 0.41 0.00 0.00 173.24 174.24 1wim n SER 6 N 5.42 0.57 -0.00 2.44 2.88 -1.18 -4.92 113.62 118.82 1wim n SER 6 Ca -0.08 0.11 0.00 0.00 -1.33 0.00 0.00 58.87 57.57 1wim n SER 6 Cb 0.50 0.94 -0.00 0.00 -0.75 0.00 0.00 64.21 64.89 1wim n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wim n GLY 7 N 1.25 -2.66 3.74 0.46 0.00 -1.26 -5.02 105.19 101.70 1wim n GLY 7 Ca -0.01 -1.42 -0.23 0.00 0.00 0.00 0.00 46.02 44.36 1wim n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wim n LYS 9 N -1.19 0.67 0.00 0.00 4.76 -1.26 -3.64 118.16 117.50 1wim n LYS 9 Ca -0.02 -0.07 0.00 0.00 -2.87 0.00 0.00 58.31 55.34 1wim n LYS 9 Cb 0.62 -1.55 0.00 0.00 -1.84 0.00 0.00 35.03 32.26 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 -2.54 0.50 0.00 -0.35 4.77 -1.26 -4.48 117.00 113.64 1wim n LEU 10 Ca -0.18 0.09 0.08 0.00 -0.03 0.00 0.00 56.01 55.97 1wim n LEU 10 Cb 0.86 -0.26 0.45 0.00 -2.33 0.00 0.00 43.42 42.14 1wim n LEU 10 CO 0.44 -0.26 0.75 0.00 -1.33 0.00 0.00 177.39 176.99 1wim n LEU 12 N -0.77 -0.59 -4.85 0.00 7.99 -1.24 -4.86 117.00 112.69 1wim n LEU 12 Ca 0.11 -0.83 -0.34 0.00 -0.01 0.00 0.00 56.01 54.95 1wim n LEU 12 Cb 0.05 -1.04 -0.06 0.00 -0.11 0.00 0.00 43.42 42.26 1wim n LEU 12 CO 0.09 0.20 -0.20 -0.83 -1.51 0.00 0.00 177.39 175.13 1wim s GLY 13 N -3.24 2.10 -0.65 -0.72 0.00 -1.26 -4.66 107.32 98.89 1wim s GLY 13 Ca 0.26 -0.79 -0.24 0.00 0.00 0.00 0.00 44.72 43.95 1wim s GLY 13 CO 0.66 -0.64 1.04 -0.54 0.00 0.00 0.00 173.10 173.62 1wim s GLU 14 N -1.69 3.20 0.12 2.90 8.01 -1.26 -2.28 118.70 127.69 1wim s GLU 14 Ca 0.23 -0.52 0.09 0.00 0.01 0.00 0.00 54.97 54.79 1wim s GLU 14 Cb -0.12 -4.17 -0.04 0.00 -4.31 0.00 0.00 34.13 25.49 1wim s GLU 14 CO 0.14 -1.81 -0.22 0.71 0.01 0.00 0.00 175.26 174.08 1wim s TYR 15 N 4.47 1.96 0.28 1.61 2.02 -1.26 -4.95 117.35 121.47 1wim s TYR 15 Ca 0.28 -0.41 -0.29 0.00 -0.37 0.00 0.00 57.07 56.28 1wim s TYR 15 Cb -0.13 -1.06 -0.10 0.00 -0.40 0.00 0.00 41.96 40.27 1wim s TYR 15 CO 0.14 0.27 1.25 -1.25 -1.57 0.00 0.00 175.55 174.39 1wim s PRO 16 N -2.09 4.44 0.38 -1.71 0.04 -1.20 -3.12 135.00 131.73 1wim s PRO 16 Ca 0.10 2.05 0.21 0.00 0.04 0.00 0.00 61.00 63.41 1wim s PRO 16 Cb -0.09 -3.14 1.30 0.00 0.04 0.00 0.00 34.50 32.60 1wim s PRO 16 CO 0.05 -0.10 1.61 -0.39 0.04 0.00 0.00 177.00 178.21 1wim h VAL 17 N 3.28 0.10 -0.90 -0.36 -1.51 -1.95 0.53 116.25 115.44 1wim h VAL 17 Ca -0.47 -0.04 0.24 0.00 -1.23 0.00 0.00 66.70 65.21 1wim h VAL 17 Cb 1.22 -0.01 -0.14 0.00 -2.13 0.00 0.00 31.29 30.23 1wim h VAL 17 CO 0.70 0.02 0.35 -0.08 -1.23 0.00 0.00 177.57 177.32 1wim h GLU 18 N 0.11 0.29 -1.11 5.19 4.81 -1.94 0.38 114.58 122.30 1wim h GLU 18 Ca 0.81 -0.02 -0.63 0.00 -0.13 0.00 0.00 59.36 59.39 1wim h GLU 18 Cb 2.17 -0.07 -0.27 0.00 0.63 0.00 0.00 28.75 31.22 1wim h GLU 18 CO -0.65 0.19 0.82 1.04 -0.73 0.00 0.00 179.01 179.68 1wim n GLN 19 N -5.13 2.57 -4.12 1.92 6.02 0.18 -4.93 117.38 113.90 1wim n GLN 19 Ca 0.23 -3.06 -0.10 0.00 -0.01 0.00 0.00 57.00 54.06 1wim n GLN 19 Cb 0.72 -2.20 -0.10 0.00 1.02 0.00 0.00 30.24 29.68 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 -3.55 0.69 -0.10 -1.09 -1.94 0.13 -3.73 119.30 109.72 1wim s MET 20 Ca 0.60 -1.14 0.01 0.00 -1.71 0.00 0.00 55.69 53.45 1wim s MET 20 Cb 0.47 -0.13 0.02 0.00 2.01 0.00 0.00 34.83 37.20 1wim s MET 20 CO -0.02 -0.02 -0.12 0.99 -0.01 0.00 0.00 175.02 175.83 1wim s THR 21 N -3.04 1.25 -0.17 2.05 2.01 -0.49 -4.92 115.64 112.34 1wim s THR 21 Ca 0.04 -0.49 -0.08 0.00 0.31 0.00 0.00 61.69 61.48 1wim s THR 21 Cb 0.01 -1.17 -0.04 0.00 0.01 0.00 0.00 72.50 71.31 1wim s THR 21 CO -0.04 0.39 0.10 -0.89 -0.69 0.00 0.00 174.62 173.49 1wim s THR 22 N 1.11 5.18 -0.08 -0.82 2.01 -1.26 -2.02 115.64 119.76 1wim s THR 22 Ca -0.05 0.10 -0.19 0.00 0.31 0.00 0.00 61.69 61.85 1wim s THR 22 Cb -0.14 -3.32 -0.04 0.00 0.01 0.00 0.00 72.50 69.00 1wim s THR 22 CO -0.02 0.50 0.54 -0.63 -0.69 0.00 0.00 174.62 174.32 1wim s ILE 23 N -0.05 5.10 -0.42 1.82 1.01 0.22 -4.95 121.20 123.93 1wim s ILE 23 Ca 0.09 1.10 0.03 0.00 0.00 0.00 0.00 60.65 61.86 1wim s ILE 23 Cb -0.12 -3.88 0.25 0.00 0.01 0.00 0.00 42.46 38.72 1wim s ILE 23 CO 0.00 0.34 1.14 0.00 0.00 0.00 0.00 174.94 176.42 1wim n ALA 24 N 3.40 3.29 -0.03 9.38 0.00 -1.26 -1.61 120.51 133.67 1wim n ALA 24 Ca -0.06 -0.82 -0.05 0.00 0.00 0.00 0.00 53.44 52.50 1wim n ALA 24 Cb 0.51 -1.10 -0.03 0.00 0.00 0.00 0.00 19.45 18.83 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 0.07 0.15 -0.28 0.00 6.02 -1.26 -4.81 117.38 117.27 1wim n GLN 25 Ca 0.15 0.04 0.03 0.00 -0.01 0.00 0.00 57.00 57.21 1wim n GLN 25 Cb 0.75 -1.03 0.04 0.00 1.02 0.00 0.00 30.24 31.01 1wim n GLN 25 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1wim n GLN 27 N -0.44 -3.61 -4.15 0.00 1.13 -0.64 -4.93 117.38 104.74 1wim n GLN 27 Ca 0.04 0.42 -0.35 0.00 -1.94 0.00 0.00 57.00 55.17 1wim n GLN 27 Cb 0.62 -5.09 -0.09 0.00 0.11 0.00 0.00 30.24 25.79 1wim n GLN 27 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1wim s ILE 29 N -0.24 3.40 0.06 0.00 2.07 -1.26 -0.61 121.20 124.62 1wim s ILE 29 Ca 0.07 -0.95 -0.16 0.00 -1.41 0.00 0.00 60.65 58.20 1wim s ILE 29 Cb -0.12 -2.48 0.03 0.00 0.13 0.00 0.00 42.46 40.01 1wim s ILE 29 CO 0.02 0.34 0.38 -0.36 -1.91 0.00 0.00 174.94 173.40 1wim s PHE 30 N -1.01 -0.20 -0.06 3.50 0.08 -0.86 -4.68 117.98 114.75 1wim s PHE 30 Ca 0.17 0.06 -0.30 0.00 0.12 0.00 0.00 56.93 56.99 1wim s PHE 30 Cb -0.11 0.19 -0.03 0.00 -0.57 0.00 0.00 43.02 42.50 1wim s PHE 30 CO 0.08 -0.58 1.12 0.00 -0.10 0.00 0.00 175.22 175.73 1wim n THR 32 N 4.47 -0.36 -0.27 0.00 -1.04 -1.24 -0.07 114.28 115.77 1wim n THR 32 Ca 0.10 1.46 -0.07 0.00 -2.04 0.00 0.00 64.05 63.50 1wim n THR 32 Cb 0.47 -1.89 -0.06 0.00 -1.82 0.00 0.00 70.33 67.03 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 -4.87 -0.68 0.00 -4.42 7.99 -1.26 0.70 117.00 114.46 1wim n LEU 33 Ca 0.05 1.35 0.00 0.00 -0.01 0.00 0.00 56.01 57.40 1wim n LEU 33 Cb 0.22 -0.25 0.00 0.00 -0.11 0.00 0.00 43.42 43.28 1wim n LEU 33 CO -0.09 -1.03 0.47 0.00 -1.51 0.00 0.00 177.39 175.23 1wim n LEU 35 N -1.92 0.13 0.07 0.00 4.77 -0.96 0.12 117.00 119.20 1wim n LEU 35 Ca 0.00 1.12 -0.13 0.00 -0.03 0.00 0.00 56.01 56.97 1wim n LEU 35 Cb 0.00 -0.55 -0.09 0.00 -2.33 0.00 0.00 43.42 40.45 1wim n LEU 35 CO 0.00 -1.19 0.60 0.50 -1.33 0.00 0.00 177.39 175.96 1wim h LYS 36 N 0.00 -0.19 0.00 3.23 3.64 0.69 -2.03 116.57 121.92 1wim h LYS 36 Ca 0.80 0.01 -0.06 0.00 -1.27 0.00 0.00 60.65 60.13 1wim h LYS 36 Cb 2.79 0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 34.65 1wim h LYS 36 CO -0.29 0.18 -0.31 1.96 -2.27 0.00 0.00 179.45 178.73 1wim h GLN 37 N -0.59 0.00 0.47 1.90 4.20 0.18 -1.58 115.11 119.69 1wim h GLN 37 Ca -0.02 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.67 1wim h GLN 37 Cb 0.45 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1wim h GLN 37 CO 0.03 0.31 -0.22 -0.92 -0.67 0.00 0.00 178.83 177.36 1wim h TYR 38 N 0.00 -0.58 0.00 2.96 3.20 -0.28 -0.41 116.97 121.86 1wim h TYR 38 Ca -0.00 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.83 1wim h TYR 38 Cb 0.71 0.19 -0.00 0.00 1.54 0.00 0.00 36.73 39.16 1wim h TYR 38 CO 0.00 -0.36 -0.09 -0.39 -1.64 0.00 0.00 178.16 175.67 1wim h VAL 39 N -0.91 0.61 0.31 1.81 -1.51 -1.42 -1.66 116.25 113.48 1wim h VAL 39 Ca -0.06 -0.41 -0.02 0.00 -1.23 0.00 0.00 66.70 64.99 1wim h VAL 39 Cb 0.48 1.26 0.00 0.00 -2.13 0.00 0.00 31.29 30.90 1wim h VAL 39 CO 0.10 0.09 -0.15 -0.33 -1.23 0.00 0.00 177.57 176.06 1wim h GLU 40 N 0.00 -0.40 -0.97 5.19 5.08 -1.28 -1.99 114.58 120.21 1wim h GLU 40 Ca -0.00 0.03 0.11 0.00 -1.00 0.00 0.00 59.36 58.50 1wim h GLU 40 Cb 0.25 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 29.51 1wim h GLU 40 CO 0.01 -0.27 0.60 -0.07 -1.00 0.00 0.00 179.01 178.29 1wim h LEU 41 N -0.96 0.89 0.35 1.33 -0.00 -1.02 0.13 115.31 116.02 1wim h LEU 41 Ca -0.04 0.05 -0.02 0.00 -0.00 0.00 0.00 57.88 57.87 1wim h LEU 41 Cb 0.32 -0.13 0.00 0.00 -0.00 0.00 0.00 40.66 40.85 1wim h LEU 41 CO 0.07 0.48 -0.17 -0.07 -0.00 0.00 0.00 178.44 178.76 1wim h LEU 42 N 0.97 -0.39 0.01 1.67 3.38 -1.40 -1.92 115.31 117.62 1wim h LEU 42 Ca 0.47 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.39 1wim h LEU 42 Cb 0.44 0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 1wim h LEU 42 CO -0.26 -0.19 -0.04 0.40 0.09 0.00 0.00 178.44 178.45 1wim h ILE 43 N -0.59 0.91 -0.95 1.22 2.04 -0.86 -2.28 117.51 117.00 1wim h ILE 43 Ca -0.05 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.01 1wim h ILE 43 Cb 0.43 0.91 -0.08 0.00 -0.74 0.00 0.00 36.82 37.33 1wim h ILE 43 CO 0.08 0.00 0.61 0.11 0.00 0.00 0.00 178.15 178.95 1wim h LYS 44 N -0.07 0.54 -0.36 2.37 1.57 -0.75 -1.09 116.57 118.78 1wim h LYS 44 Ca 0.01 -0.03 0.07 0.00 -1.87 0.00 0.00 60.65 58.83 1wim h LYS 44 Cb 0.08 -0.12 -0.07 0.00 0.08 0.00 0.00 32.23 32.20 1wim h LYS 44 CO -0.03 0.36 -0.09 1.49 -0.57 0.00 0.00 179.45 180.60 1wim h GLU 45 N 0.55 -0.00 0.00 3.15 4.81 -0.73 -3.46 114.58 118.90 1wim h GLU 45 Ca 0.52 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.75 1wim h GLU 45 Cb 1.07 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.45 1wim h GLU 45 CO -0.26 -0.00 0.00 0.41 -0.73 0.00 0.00 179.01 178.43 1wim n GLY 46 N -1.29 3.04 0.28 1.92 0.00 -0.41 -4.88 105.19 103.84 1wim n GLY 46 Ca 0.01 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 45.09 1wim n GLY 46 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1wim h LEU 47 N 0.00 -0.68 -9.11 0.99 5.85 -1.86 -3.41 115.31 107.10 1wim h LEU 47 Ca 0.00 0.04 -0.61 0.00 0.84 0.00 0.00 57.88 58.15 1wim h LEU 47 Cb 0.00 0.20 0.01 0.00 0.37 0.00 0.00 40.66 41.24 1wim h LEU 47 CO 0.00 -0.40 1.26 -0.62 -0.34 0.00 0.00 178.44 178.34 1wim n GLU 48 N -3.97 2.06 -0.03 1.25 4.71 -1.26 -4.84 120.64 118.57 1wim n GLU 48 Ca -0.08 0.70 -0.02 0.00 -0.01 0.00 0.00 57.16 57.75 1wim n GLU 48 Cb 0.27 -2.80 -0.13 0.00 -1.01 0.00 0.00 31.44 27.77 1wim n GLU 48 CO 0.00 0.00 0.00 2.41 0.09 0.00 0.00 177.13 179.63 1wim n THR 49 N 6.11 1.10 -4.73 2.62 -1.04 -1.26 -4.71 114.28 112.37 1wim n THR 49 Ca 0.27 -0.73 -0.33 0.00 -2.04 0.00 0.00 64.05 61.22 1wim n THR 49 Cb 0.33 -0.55 -0.13 0.00 -1.82 0.00 0.00 70.33 68.16 1wim n THR 49 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wim s ALA 50 N -2.85 2.74 -1.10 2.41 0.00 -1.26 -4.67 121.76 117.03 1wim s ALA 50 Ca -0.06 -0.90 -0.15 0.00 0.00 0.00 0.00 51.96 50.84 1wim s ALA 50 Cb 0.09 -1.21 0.16 0.00 0.00 0.00 0.00 23.12 22.16 1wim s ALA 50 CO 0.84 0.37 1.31 0.42 0.00 0.00 0.00 175.76 178.69 1wim s ILE 51 N -0.08 4.96 1.16 0.00 -1.09 -1.26 -5.01 121.20 119.88 1wim s ILE 51 Ca -0.01 -2.29 -0.20 0.00 -2.23 0.00 0.00 60.65 55.92 1wim s ILE 51 Cb -0.14 -4.85 0.29 0.00 -1.58 0.00 0.00 42.46 36.18 1wim s ILE 51 CO 0.03 -1.56 1.01 -0.24 -1.23 0.00 0.00 174.94 172.96 1wim n SER 52 N 5.85 -2.13 -4.74 3.58 2.88 -1.26 -2.12 113.62 115.68 1wim n SER 52 Ca 0.32 -1.11 -0.41 0.00 -1.33 0.00 0.00 58.87 56.33 1wim n SER 52 Cb 0.45 -0.94 -0.03 0.00 -0.75 0.00 0.00 64.21 62.94 1wim n SER 52 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1wim n PRO 54 N 2.30 0.22 -3.72 0.00 -0.04 -1.26 -4.57 135.00 127.92 1wim n PRO 54 Ca 0.05 0.14 -0.37 0.00 -0.04 0.00 0.00 63.50 63.28 1wim n PRO 54 Cb 0.42 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.26 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 -2.56 5.27 0.01 3.54 2.15 -1.26 -4.99 116.67 118.83 1wim s ASP 55 Ca 0.14 -0.32 -0.23 0.00 0.43 0.00 0.00 52.55 52.57 1wim s ASP 55 Cb 0.10 -1.95 -0.18 0.00 -0.30 0.00 0.00 42.92 40.60 1wim s ASP 55 CO 0.23 -0.09 1.30 0.00 -0.17 0.00 0.00 175.17 176.44 1wim h ALA 56 N 8.27 0.10 -0.97 3.66 0.00 -2.01 -3.12 119.26 125.19 1wim h ALA 56 Ca -0.36 -0.28 0.23 0.00 0.00 0.00 0.00 54.91 54.49 1wim h ALA 56 Cb 1.16 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 18.85 1wim h ALA 56 CO 0.59 -0.09 0.64 0.00 0.00 0.00 0.00 179.25 180.38 1wim h ALA 57 N 0.55 2.20 -0.12 0.00 0.00 -1.98 -3.41 119.26 116.50 1wim h ALA 57 Ca 0.01 0.04 -0.67 0.00 0.00 0.00 0.00 54.91 54.29 1wim h ALA 57 Cb 0.58 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.31 1wim h ALA 57 CO 0.02 -0.54 1.48 0.00 0.00 0.00 0.00 179.25 180.21 1wim n PRO 59 N 7.91 0.12 -0.03 0.00 -0.04 -1.26 -2.88 135.00 138.82 1wim n PRO 59 Ca 0.57 0.36 -0.20 0.00 -0.04 0.00 0.00 63.50 64.20 1wim n PRO 59 Cb 0.02 -1.73 -0.14 0.00 -0.04 0.00 0.00 33.50 31.61 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 -1.96 0.73 -3.45 0.54 3.00 -1.26 -5.02 118.16 110.74 1wim n LYS 60 Ca 0.03 0.23 -0.19 0.00 -0.00 0.00 0.00 58.31 58.38 1wim n LYS 60 Cb 0.20 -1.67 0.07 0.00 0.00 0.00 0.00 35.03 33.63 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 -3.40 -3.98 -2.83 1.64 6.02 -1.14 -4.96 117.38 108.74 1wim n GLN 61 Ca -0.35 0.76 -0.39 0.00 -0.01 0.00 0.00 57.00 57.02 1wim n GLN 61 Cb 1.04 -5.51 -0.06 0.00 1.02 0.00 0.00 30.24 26.73 1wim n GLN 61 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1wim s GLY 62 N -3.89 2.95 0.74 1.08 0.00 -1.26 -4.63 107.32 102.32 1wim s GLY 62 Ca 0.23 0.51 -0.08 0.00 0.00 0.00 0.00 44.72 45.38 1wim s GLY 62 CO 0.77 1.01 1.06 0.30 0.00 0.00 0.00 173.10 176.24 1wim s HIS 63 N -1.32 2.77 0.03 1.90 3.76 -1.26 -2.12 115.29 119.05 1wim s HIS 63 Ca 0.43 0.44 -0.15 0.00 -0.15 0.00 0.00 55.06 55.63 1wim s HIS 63 Cb -0.23 -3.30 -0.06 0.00 1.11 0.00 0.00 32.58 30.11 1wim s HIS 63 CO 0.28 -1.57 0.44 -0.51 -0.85 0.00 0.00 174.74 172.53 1wim s LEU 64 N -5.34 4.46 0.22 0.89 2.01 -0.90 -4.70 118.68 115.32 1wim s LEU 64 Ca 0.62 1.00 -0.30 0.00 0.01 0.00 0.00 54.13 55.46 1wim s LEU 64 Cb -0.10 -2.73 -0.09 0.00 0.01 0.00 0.00 46.19 43.28 1wim s LEU 64 CO 0.46 0.28 1.17 -1.10 1.01 0.00 0.00 176.35 178.17 1wim s GLN 65 N -1.25 4.53 0.32 1.70 -1.52 -1.26 -4.88 119.66 117.30 1wim s GLN 65 Ca 0.27 1.86 0.11 0.00 -1.95 0.00 0.00 55.36 55.65 1wim s GLN 65 Cb -0.17 -3.22 0.95 0.00 -0.22 0.00 0.00 33.01 30.35 1wim s GLN 65 CO 0.15 -0.00 1.70 1.49 -0.25 0.00 0.00 175.29 178.37 1wim h GLU 66 N 4.76 0.43 -0.88 2.91 4.81 -1.99 0.52 114.58 125.15 1wim h GLU 66 Ca -0.45 -0.03 0.02 0.00 -0.13 0.00 0.00 59.36 58.77 1wim h GLU 66 Cb 1.21 -0.10 -0.05 0.00 0.63 0.00 0.00 28.75 30.45 1wim h GLU 66 CO 0.72 0.29 0.58 -2.95 -0.73 0.00 0.00 179.01 176.91 1wim h ASN 67 N 0.44 0.97 0.53 1.04 -1.07 -2.00 -0.80 115.58 114.69 1wim h ASN 67 Ca 0.67 -0.02 -0.03 0.00 0.07 0.00 0.00 56.30 57.00 1wim h ASN 67 Cb 1.39 -0.23 0.01 0.00 -2.07 0.00 0.00 38.32 37.41 1wim h ASN 67 CO -0.54 0.68 -0.25 -0.33 0.07 0.00 0.00 177.43 177.06 1wim h GLU 68 N 1.14 -0.68 -0.95 4.14 4.39 -0.34 -2.97 114.58 119.30 1wim h GLU 68 Ca 0.34 0.05 0.18 0.00 0.34 0.00 0.00 59.36 60.27 1wim h GLU 68 Cb -0.05 0.15 -0.08 0.00 -0.10 0.00 0.00 28.75 28.67 1wim h GLU 68 CO -0.09 -0.39 0.61 0.82 -1.16 0.00 0.00 179.01 178.80 1wim h ILE 69 N -1.08 0.73 0.54 3.13 2.04 -1.28 0.23 117.51 121.82 1wim h ILE 69 Ca -0.07 -0.22 -0.02 0.00 1.00 0.00 0.00 64.86 65.55 1wim h ILE 69 Cb 0.61 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1wim h ILE 69 CO 0.12 0.12 -0.48 -0.08 0.00 0.00 0.00 178.15 177.82 1wim h GLU 70 N 0.63 -0.98 -0.55 2.37 4.57 -1.11 -1.19 114.58 118.32 1wim h GLU 70 Ca 0.51 0.07 -0.09 0.00 -1.18 0.00 0.00 59.36 58.67 1wim h GLU 70 Cb 0.96 0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 29.75 1wim h GLU 70 CO -0.27 -0.65 -0.03 0.00 -1.18 0.00 0.00 179.01 176.89 1wim h MET 72 N 0.88 -0.36 -6.95 0.00 1.85 -0.35 -3.43 114.93 106.56 1wim h MET 72 Ca 0.16 0.02 -0.44 0.00 -0.61 0.00 0.00 59.70 58.83 1wim h MET 72 Cb 0.55 0.08 0.06 0.00 0.43 0.00 0.00 31.60 32.72 1wim h MET 72 CO 0.03 -0.24 0.03 0.14 -0.40 0.00 0.00 176.91 176.47 1wim s VAL 73 N -4.33 2.56 0.24 -5.77 -7.23 -0.47 -4.98 120.40 100.42 1wim s VAL 73 Ca -0.08 -0.57 -0.05 0.00 -1.81 0.00 0.00 61.98 59.47 1wim s VAL 73 Cb 0.03 -2.99 -0.05 0.00 0.56 0.00 0.00 36.38 33.92 1wim s VAL 73 CO 0.29 0.00 0.50 0.00 -0.31 0.00 0.00 175.10 175.58 1wim s ALA 74 N -2.89 3.67 0.27 1.32 0.00 -1.26 -4.76 121.76 118.11 1wim s ALA 74 Ca 0.58 -0.54 -0.09 0.00 0.00 0.00 0.00 51.96 51.91 1wim s ALA 74 Cb -0.10 -2.25 0.43 0.00 0.00 0.00 0.00 23.12 21.19 1wim s ALA 74 CO 0.40 0.39 1.52 0.00 0.00 0.00 0.00 175.76 178.07 1wim n ALA 75 N -0.58 0.20 -0.33 0.00 0.00 -1.26 0.11 120.51 118.65 1wim n ALA 75 Ca -0.02 1.06 0.21 0.00 0.00 0.00 0.00 53.44 54.70 1wim n ALA 75 Cb 0.53 -0.62 0.43 0.00 0.00 0.00 0.00 19.45 19.79 1wim n ALA 75 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1wim h GLU 76 N 0.00 0.28 0.00 0.00 4.57 -2.00 -0.56 114.58 116.87 1wim h GLU 76 Ca 0.46 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.58 1wim h GLU 76 Cb 0.70 -0.06 -0.01 0.00 -0.16 0.00 0.00 28.75 29.22 1wim h GLU 76 CO -1.00 0.18 -0.52 0.82 -1.18 0.00 0.00 179.01 177.31 1wim h ILE 77 N 0.29 0.19 -0.77 2.32 1.08 0.41 -3.38 117.51 117.65 1wim h ILE 77 Ca 0.69 -1.21 0.30 0.00 -0.39 0.00 0.00 64.86 64.25 1wim h ILE 77 Cb 1.54 0.43 -0.14 0.00 -3.07 0.00 0.00 36.82 35.58 1wim h ILE 77 CO -0.63 0.06 0.33 0.80 -0.69 0.00 0.00 178.15 178.02 1wim n MET 78 N -4.62 -0.05 -0.19 2.37 1.56 0.88 0.15 117.12 117.22 1wim n MET 78 Ca -0.10 1.08 -0.00 0.00 -0.27 0.00 0.00 57.70 58.41 1wim n MET 78 Cb 0.29 -1.89 0.08 0.00 2.15 0.00 0.00 33.22 33.85 1wim n MET 78 CO 0.00 0.00 0.00 0.37 -0.73 0.00 0.00 175.97 175.61 1wim h GLN 79 N 0.00 0.08 0.07 2.12 5.75 -1.28 -1.26 115.11 120.60 1wim h GLN 79 Ca 0.61 -0.00 0.02 0.00 -0.15 0.00 0.00 58.65 59.13 1wim h GLN 79 Cb 1.56 -0.02 -0.05 0.00 1.07 0.00 0.00 27.48 30.05 1wim h GLN 79 CO -0.62 0.05 -0.35 0.00 -2.65 0.00 0.00 178.83 175.27 1wim h ARG 80 N 0.08 -0.52 -0.11 1.69 3.08 0.11 0.12 114.38 118.84 1wim h ARG 80 Ca 0.30 0.04 0.04 0.00 0.07 0.00 0.00 59.98 60.43 1wim h ARG 80 Cb 0.48 0.12 -0.06 0.00 0.08 0.00 0.00 29.97 30.58 1wim h ARG 80 CO -0.53 -0.35 -0.36 -0.92 -1.07 0.00 0.00 179.97 176.74 1wim h TYR 81 N -0.54 -1.00 -0.71 3.04 3.20 -1.35 0.18 116.97 119.78 1wim h TYR 81 Ca 0.04 0.04 0.10 0.00 3.14 0.00 0.00 58.73 62.05 1wim h TYR 81 Cb 0.60 0.46 -0.07 0.00 1.54 0.00 0.00 36.73 39.25 1wim h TYR 81 CO -0.33 -0.43 0.34 0.87 -1.64 0.00 0.00 178.16 176.97 1wim h LYS 82 N -0.45 0.56 0.14 1.82 1.57 -0.98 -2.23 116.57 117.01 1wim h LYS 82 Ca 0.08 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1wim h LYS 82 Cb 0.58 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.77 1wim h LYS 82 CO -0.36 0.37 -0.07 -0.22 -0.57 0.00 0.00 179.45 178.61 1wim h LYS 83 N 0.58 -0.18 -0.71 3.15 3.64 0.25 -1.68 116.57 121.62 1wim h LYS 83 Ca 0.35 0.01 0.16 0.00 -1.27 0.00 0.00 60.65 59.90 1wim h LYS 83 Cb 0.40 0.04 -0.12 0.00 -0.41 0.00 0.00 32.23 32.14 1wim h LYS 83 CO -0.28 -0.09 0.04 -0.07 -2.27 0.00 0.00 179.45 176.78 1wim h LEU 84 N -0.22 -0.26 0.15 5.20 3.38 -0.12 -1.25 115.31 122.19 1wim h LEU 84 Ca -0.02 0.17 -0.01 0.00 0.09 0.00 0.00 57.88 58.12 1wim h LEU 84 Cb 0.18 0.29 0.00 0.00 0.09 0.00 0.00 40.66 41.22 1wim h LEU 84 CO 0.03 -0.13 -0.07 1.56 0.09 0.00 0.00 178.44 179.92 1wim h GLN 85 N 0.14 -0.19 -0.94 1.13 4.20 -1.21 -3.03 115.11 115.20 1wim h GLN 85 Ca 0.39 0.01 0.20 0.00 0.06 0.00 0.00 58.65 59.31 1wim h GLN 85 Cb 0.67 0.04 -0.18 0.00 0.30 0.00 0.00 27.48 28.31 1wim h GLN 85 CO -0.60 -0.01 -0.18 0.35 -0.67 0.00 0.00 178.83 177.72 1wim h PHE 86 N -0.34 -0.41 -0.47 2.96 3.57 -0.28 0.46 116.94 122.43 1wim h PHE 86 Ca -0.02 0.08 0.08 0.00 3.53 0.00 0.00 57.97 61.64 1wim h PHE 86 Cb 0.27 0.33 -0.07 0.00 2.79 0.00 0.00 35.95 39.27 1wim h PHE 86 CO -0.02 -0.40 0.07 0.93 -2.23 0.00 0.00 178.31 176.65 1wim h GLU 87 N 0.01 0.19 -3.35 1.11 5.08 -1.32 -3.29 114.58 113.00 1wim h GLU 87 Ca 0.47 -0.01 -0.66 0.00 -1.00 0.00 0.00 59.36 58.16 1wim h GLU 87 Cb 0.78 -0.04 -0.39 0.00 0.50 0.00 0.00 28.75 29.59 1wim h GLU 87 CO -0.95 0.12 -0.48 1.03 -1.00 0.00 0.00 179.01 177.73 1wim s ARG 88 N -6.15 2.40 -0.21 2.33 0.52 0.16 -5.02 118.95 112.98 1wim s ARG 88 Ca -0.13 -2.85 -0.04 0.00 -0.52 0.00 0.00 55.73 52.19 1wim s ARG 88 Cb 0.15 -3.53 0.10 0.00 0.52 0.00 0.00 34.95 32.20 1wim s ARG 88 CO 0.72 -1.18 0.26 0.45 0.02 0.00 0.00 175.30 175.57 1wim s SER 89 N -0.30 1.06 0.00 0.23 0.15 -1.08 -4.76 113.70 109.00 1wim s SER 89 Ca 0.20 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 56.77 1wim s SER 89 Cb -0.17 0.58 0.00 0.00 -1.71 0.00 0.00 66.02 64.71 1wim s SER 89 CO -0.06 -0.32 0.00 0.61 1.20 0.00 0.00 173.24 174.67 1wim n GLY 90 N 5.33 -1.05 3.75 9.45 0.00 -1.26 -5.05 105.19 116.36 1wim n GLY 90 Ca -0.05 0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 4.42 -0.24 1.61 0.04 -1.26 -5.03 135.00 134.54 1wim s PRO 91 Ca 0.00 2.05 -0.04 0.00 0.04 0.00 0.00 61.00 63.05 1wim s PRO 91 Cb 0.00 -3.17 0.08 0.00 0.04 0.00 0.00 34.50 31.45 1wim s PRO 91 CO 0.00 -0.17 0.09 -1.54 0.04 0.00 0.00 177.00 175.42 1wim s SER 92 N 0.01 3.11 0.12 6.66 1.04 -1.26 -5.02 113.70 118.36 1wim s SER 92 Ca 0.53 -1.03 -0.19 0.00 0.48 0.00 0.00 55.95 55.74 1wim s SER 92 Cb -0.36 -0.44 -0.06 0.00 0.10 0.00 0.00 66.02 65.26 1wim s SER 92 CO 0.42 -0.38 1.75 0.28 0.98 0.00 0.00 173.24 176.29 1wim h SER 93 N 8.34 0.27 0.00 7.02 0.02 -2.08 -3.57 113.55 123.55 1wim h SER 93 Ca -0.17 -0.04 0.00 0.00 -0.84 0.00 0.00 61.79 60.74 1wim h SER 93 Cb 1.08 -0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.55 1wim h SER 93 CO 0.38 0.23 0.00 0.61 -1.14 0.00 0.00 176.83 176.91