#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wim s SER 2 N 0.00 4.68 0.08 1.61 0.01 -1.26 -5.03 113.70 113.79 1wim s SER 2 Ca 0.00 -0.11 -0.33 0.00 1.31 0.00 0.00 55.95 56.83 1wim s SER 2 Cb 0.00 -1.56 -0.17 0.00 0.21 0.00 0.00 66.02 64.49 1wim s SER 2 CO 0.00 0.24 1.62 -1.28 0.41 0.00 0.00 173.24 174.22 1wim h SER 3 N 6.19 -0.89 0.00 2.44 0.87 -2.08 -3.48 113.55 116.60 1wim h SER 3 Ca -0.37 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.24 1wim h SER 3 Cb 1.19 0.26 0.00 0.00 -0.44 0.00 0.00 62.40 63.41 1wim h SER 3 CO 0.58 -0.56 0.00 0.61 -0.53 0.00 0.00 176.83 176.94 1wim n GLY 4 N -1.49 3.10 3.39 5.77 0.00 -1.26 -5.11 105.19 109.58 1wim n GLY 4 Ca -0.12 -0.20 -0.20 0.00 0.00 0.00 0.00 46.02 45.50 1wim n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wim s SER 5 N 0.00 2.55 0.00 1.61 1.04 -1.26 -3.82 113.70 113.81 1wim s SER 5 Ca 0.00 -1.14 0.00 0.00 0.48 0.00 0.00 55.95 55.29 1wim s SER 5 Cb 0.00 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 65.99 1wim s SER 5 CO 0.00 -0.32 0.00 -1.20 0.98 0.00 0.00 173.24 172.70 1wim n SER 6 N -0.49 3.27 -0.95 7.02 7.64 -1.23 -4.94 113.62 123.94 1wim n SER 6 Ca -0.06 -0.17 0.07 0.00 1.01 0.00 0.00 58.87 59.72 1wim n SER 6 Cb 0.62 1.00 -0.04 0.00 -1.01 0.00 0.00 64.21 64.78 1wim n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wim n GLY 7 N 1.98 -3.30 3.85 0.23 0.00 -1.26 -5.00 105.19 101.70 1wim n GLY 7 Ca 0.00 -1.13 -0.21 0.00 0.00 0.00 0.00 46.02 44.68 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 -1.42 1.27 0.00 0.00 5.02 -1.26 -3.65 118.16 118.12 1wim n LYS 9 Ca -0.00 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 1wim n LYS 9 Cb 0.60 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 34.22 1wim n LYS 9 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1wim n LEU 10 N -2.68 0.22 0.18 -0.35 4.77 -1.26 -4.35 117.00 113.53 1wim n LEU 10 Ca -0.27 0.50 0.07 0.00 -0.03 0.00 0.00 56.01 56.27 1wim n LEU 10 Cb 0.98 -0.46 0.16 0.00 -2.33 0.00 0.00 43.42 41.77 1wim n LEU 10 CO 0.30 -0.46 0.64 0.00 -1.33 0.00 0.00 177.39 176.54 1wim n LEU 12 N -3.21 -4.14 0.00 0.00 4.77 -1.24 -5.01 117.00 108.17 1wim n LEU 12 Ca 0.02 -0.63 -0.15 0.00 -0.03 0.00 0.00 56.01 55.23 1wim n LEU 12 Cb 0.61 -3.13 0.00 0.00 -2.33 0.00 0.00 43.42 38.58 1wim n LEU 12 CO 0.37 0.36 0.04 0.61 -1.33 0.00 0.00 177.39 177.44 1wim n GLY 13 N -1.15 2.87 3.47 -0.72 0.00 -1.26 -4.78 105.19 103.62 1wim n GLY 13 Ca -0.27 -2.24 -0.34 0.00 0.00 0.00 0.00 46.02 43.17 1wim n GLY 13 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wim s GLU 14 N -3.27 3.62 -0.02 1.61 2.12 -1.26 -2.65 118.70 118.85 1wim s GLU 14 Ca 0.18 -0.54 -0.25 0.00 0.36 0.00 0.00 54.97 54.71 1wim s GLU 14 Cb -0.01 -2.93 0.06 0.00 0.26 0.00 0.00 34.13 31.50 1wim s GLU 14 CO 0.11 0.17 0.56 0.71 -0.54 0.00 0.00 175.26 176.27 1wim s TYR 15 N 0.55 -0.50 0.47 5.30 1.51 -1.26 -5.03 117.35 118.39 1wim s TYR 15 Ca -0.03 0.79 -0.23 0.00 -1.01 0.00 0.00 57.07 56.59 1wim s TYR 15 Cb -0.14 0.33 -0.07 0.00 -0.11 0.00 0.00 41.96 41.96 1wim s TYR 15 CO 0.03 -0.57 1.16 -1.25 -1.11 0.00 0.00 175.55 173.81 1wim s PRO 16 N -1.52 3.72 0.30 -1.71 0.04 -1.26 -3.47 135.00 131.10 1wim s PRO 16 Ca -0.10 1.76 0.19 0.00 0.04 0.00 0.00 61.00 62.89 1wim s PRO 16 Cb -0.01 -2.37 1.04 0.00 0.04 0.00 0.00 34.50 33.19 1wim s PRO 16 CO 0.06 -0.58 1.57 1.33 0.04 0.00 0.00 177.00 179.42 1wim n VAL 17 N -0.56 1.04 -0.04 -0.36 0.24 -1.25 -1.74 118.33 115.66 1wim n VAL 17 Ca 0.08 0.72 -0.13 0.00 -2.04 0.00 0.00 64.34 62.97 1wim n VAL 17 Cb 0.48 -1.72 -0.08 0.00 -1.47 0.00 0.00 33.84 31.05 1wim n VAL 17 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1wim h GLU 18 N 0.00 0.28 -0.14 7.34 4.39 -1.91 -3.27 114.58 121.26 1wim h GLU 18 Ca 0.00 -0.16 -0.22 0.00 0.34 0.00 0.00 59.36 59.32 1wim h GLU 18 Cb 0.08 0.01 0.01 0.00 -0.10 0.00 0.00 28.75 28.75 1wim h GLU 18 CO 0.00 0.71 -0.79 1.96 -1.16 0.00 0.00 179.01 179.73 1wim h GLN 19 N -0.13 0.76 -7.01 2.33 1.08 -1.72 -3.45 115.11 106.96 1wim h GLN 19 Ca 0.01 -0.63 -0.48 0.00 -1.45 0.00 0.00 58.65 56.10 1wim h GLN 19 Cb 0.67 0.13 0.22 0.00 -0.05 0.00 0.00 27.48 28.45 1wim h GLN 19 CO 0.03 1.24 -0.26 -1.33 -0.95 0.00 0.00 178.83 177.55 1wim n MET 20 N -3.92 -1.33 -4.02 1.46 2.81 -1.02 -3.99 117.12 107.11 1wim n MET 20 Ca -0.07 -0.35 -0.25 0.00 -1.81 0.00 0.00 57.70 55.22 1wim n MET 20 Cb 0.75 -2.08 -0.17 0.00 -0.71 0.00 0.00 33.22 31.02 1wim n MET 20 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1wim s THR 21 N -2.44 0.89 -0.23 2.03 2.01 -0.79 -4.88 115.64 112.25 1wim s THR 21 Ca 0.63 -0.24 -0.18 0.00 0.31 0.00 0.00 61.69 62.21 1wim s THR 21 Cb -0.21 -0.92 -0.03 0.00 0.01 0.00 0.00 72.50 71.35 1wim s THR 21 CO 0.64 0.34 0.52 -0.89 -0.69 0.00 0.00 174.62 174.54 1wim s THR 22 N 1.50 5.08 0.16 -0.82 2.01 -1.26 -2.83 115.64 119.48 1wim s THR 22 Ca 0.00 0.93 -0.30 0.00 0.31 0.00 0.00 61.69 62.64 1wim s THR 22 Cb -0.13 -3.84 -0.07 0.00 0.01 0.00 0.00 72.50 68.47 1wim s THR 22 CO -0.05 0.13 1.03 -0.63 -0.69 0.00 0.00 174.62 174.41 1wim s ILE 23 N 1.98 4.14 -0.52 1.82 1.01 0.72 -4.91 121.20 125.45 1wim s ILE 23 Ca 0.23 1.85 0.07 0.00 0.00 0.00 0.00 60.65 62.80 1wim s ILE 23 Cb -0.15 -4.18 0.44 0.00 0.01 0.00 0.00 42.46 38.58 1wim s ILE 23 CO 0.09 0.32 1.25 0.00 0.00 0.00 0.00 174.94 176.60 1wim n ALA 24 N 2.45 3.44 -0.01 9.38 0.00 -1.26 -1.98 120.51 132.53 1wim n ALA 24 Ca 0.02 -1.16 -0.02 0.00 0.00 0.00 0.00 53.44 52.27 1wim n ALA 24 Cb 0.47 -1.10 -0.01 0.00 0.00 0.00 0.00 19.45 18.81 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 0.22 0.07 -0.71 0.00 1.13 -1.26 -4.82 117.38 112.01 1wim n GLN 25 Ca 0.19 0.02 0.05 0.00 -1.94 0.00 0.00 57.00 55.31 1wim n GLN 25 Cb 0.85 -0.90 0.08 0.00 0.11 0.00 0.00 30.24 30.38 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 -0.43 -0.88 -4.22 0.00 3.00 -0.84 -4.91 117.38 109.11 1wim n GLN 27 Ca 0.09 0.07 -0.31 0.00 -0.01 0.00 0.00 57.00 56.84 1wim n GLN 27 Cb 0.81 -2.97 -0.09 0.00 0.00 0.00 0.00 30.24 27.99 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 -1.21 2.36 -0.10 0.00 2.07 -1.26 -0.20 121.20 122.87 1wim s ILE 29 Ca 0.23 -0.98 -0.16 0.00 -1.41 0.00 0.00 60.65 58.32 1wim s ILE 29 Cb -0.11 -1.86 0.04 0.00 0.13 0.00 0.00 42.46 40.65 1wim s ILE 29 CO 0.14 0.58 0.41 -0.36 -1.91 0.00 0.00 174.94 173.81 1wim s PHE 30 N -0.56 -0.39 0.13 3.50 0.08 -1.13 -4.69 117.98 114.91 1wim s PHE 30 Ca 0.08 0.86 -0.31 0.00 0.12 0.00 0.00 56.93 57.68 1wim s PHE 30 Cb -0.11 0.16 -0.09 0.00 -0.57 0.00 0.00 43.02 42.41 1wim s PHE 30 CO 0.00 -0.31 1.56 0.00 -0.10 0.00 0.00 175.22 176.37 1wim n THR 32 N 4.20 -0.43 -0.09 0.00 -1.04 -1.26 -0.74 114.28 114.93 1wim n THR 32 Ca 0.14 1.54 -0.02 0.00 -2.04 0.00 0.00 64.05 63.67 1wim n THR 32 Cb 0.40 -1.90 -0.02 0.00 -1.82 0.00 0.00 70.33 66.98 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 -4.75 -0.22 0.00 -4.42 4.77 -1.26 0.45 117.00 111.56 1wim n LEU 33 Ca 0.01 0.86 0.00 0.00 -0.03 0.00 0.00 56.01 56.86 1wim n LEU 33 Cb 0.16 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 40.96 1wim n LEU 33 CO -0.10 -0.55 0.45 0.00 -1.33 0.00 0.00 177.39 175.86 1wim n LEU 35 N -2.10 0.17 0.11 0.00 4.77 -0.82 -0.15 117.00 118.97 1wim n LEU 35 Ca 0.00 1.19 -0.04 0.00 -0.03 0.00 0.00 56.01 57.13 1wim n LEU 35 Cb 0.00 -0.59 -0.02 0.00 -2.33 0.00 0.00 43.42 40.48 1wim n LEU 35 CO 0.00 -1.29 0.42 0.50 -1.33 0.00 0.00 177.39 175.69 1wim h LYS 36 N 0.00 -0.27 -0.58 3.23 3.64 0.11 -2.03 116.57 120.67 1wim h LYS 36 Ca 0.78 0.02 0.10 0.00 -1.27 0.00 0.00 60.65 60.28 1wim h LYS 36 Cb 2.57 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 34.42 1wim h LYS 36 CO -0.38 -0.18 0.39 1.96 -2.27 0.00 0.00 179.45 178.97 1wim h GLN 37 N -0.33 0.36 0.00 1.90 4.20 -0.06 0.16 115.11 121.34 1wim h GLN 37 Ca -0.03 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1wim h GLN 37 Cb 0.22 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.91 1wim h GLN 37 CO 0.05 0.24 0.00 0.98 -0.67 0.00 0.00 178.83 179.43 1wim n TYR 38 N -4.47 0.00 -0.33 2.96 9.36 0.78 -1.35 117.16 124.11 1wim n TYR 38 Ca 0.09 0.00 0.05 0.00 3.32 0.00 0.00 57.90 61.37 1wim n TYR 38 Cb 0.38 -0.44 0.24 0.00 -0.63 0.00 0.00 39.34 38.89 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 1.01 0.15 2.97 -1.51 -1.27 -2.67 116.25 114.94 1wim h VAL 39 Ca 0.00 -0.35 0.01 0.00 -1.23 0.00 0.00 66.70 65.13 1wim h VAL 39 Cb 0.00 -0.10 -0.04 0.00 -2.13 0.00 0.00 31.29 29.01 1wim h VAL 39 CO 0.00 0.19 -0.48 -0.33 -1.23 0.00 0.00 177.57 175.72 1wim h GLU 40 N 1.03 -0.71 -0.95 5.19 5.08 -0.93 0.45 114.58 123.74 1wim h GLU 40 Ca 0.43 0.05 0.16 0.00 -1.00 0.00 0.00 59.36 59.00 1wim h GLU 40 Cb 0.31 0.16 -0.08 0.00 0.50 0.00 0.00 28.75 29.64 1wim h GLU 40 CO -0.19 -0.47 0.60 -0.07 -1.00 0.00 0.00 179.01 177.89 1wim h LEU 41 N -0.73 0.73 0.12 1.33 -0.00 -0.89 0.12 115.31 115.98 1wim h LEU 41 Ca 0.00 0.06 -0.01 0.00 -0.00 0.00 0.00 57.88 57.94 1wim h LEU 41 Cb 0.74 -0.08 0.00 0.00 -0.00 0.00 0.00 40.66 41.32 1wim h LEU 41 CO -0.25 0.33 -0.06 -0.07 -0.00 0.00 0.00 178.44 178.40 1wim h LEU 42 N 0.75 -0.13 -1.80 1.67 3.38 -0.96 0.40 115.31 118.62 1wim h LEU 42 Ca 0.50 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.48 1wim h LEU 42 Cb 0.78 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1wim h LEU 42 CO -0.27 -0.08 0.40 0.40 0.09 0.00 0.00 178.44 178.99 1wim h ILE 43 N -0.19 0.01 0.00 1.22 2.04 -0.78 0.62 117.51 120.43 1wim h ILE 43 Ca -0.02 0.00 -0.24 0.00 1.00 0.00 0.00 64.86 65.60 1wim h ILE 43 Cb 0.12 0.60 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 1wim h ILE 43 CO 0.03 0.00 -1.55 0.50 0.00 0.00 0.00 178.15 177.12 1wim h LYS 44 N 0.00 0.00 0.81 2.37 1.63 -0.77 -3.39 116.57 117.23 1wim h LYS 44 Ca 0.01 0.00 -0.04 0.00 -0.85 0.00 0.00 60.65 59.77 1wim h LYS 44 Cb 0.81 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 32.45 1wim h LYS 44 CO -0.00 0.44 -0.39 1.49 -3.45 0.00 0.00 179.45 177.54 1wim h GLU 45 N 0.00 -1.05 0.00 1.90 4.57 0.48 -3.48 114.58 116.99 1wim h GLU 45 Ca -0.23 0.07 0.00 0.00 -1.18 0.00 0.00 59.36 58.03 1wim h GLU 45 Cb 1.84 0.24 0.00 0.00 -0.16 0.00 0.00 28.75 30.67 1wim h GLU 45 CO 0.07 -0.70 0.00 0.41 -1.18 0.00 0.00 179.01 177.61 1wim n GLY 46 N -1.01 2.34 0.05 1.92 0.00 -1.09 -4.94 105.19 102.46 1wim n GLY 46 Ca -0.14 -0.24 -0.02 0.00 0.00 0.00 0.00 46.02 45.62 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 -0.11 -8.53 0.99 5.85 -1.92 -3.40 115.31 108.19 1wim h LEU 47 Ca 0.00 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 58.16 1wim h LEU 47 Cb 0.00 0.03 -0.08 0.00 0.37 0.00 0.00 40.66 40.98 1wim h LEU 47 CO 0.00 -0.07 0.92 -0.70 -0.34 0.00 0.00 178.44 178.26 1wim s GLU 48 N -2.91 3.44 0.12 1.25 2.12 -1.26 -4.88 118.70 116.58 1wim s GLU 48 Ca -0.02 0.09 -0.10 0.00 0.36 0.00 0.00 54.97 55.30 1wim s GLU 48 Cb 0.00 -4.05 -0.09 0.00 0.26 0.00 0.00 34.13 30.25 1wim s GLU 48 CO 0.06 -1.72 1.35 1.15 -0.54 0.00 0.00 175.26 175.56 1wim h THR 49 N 6.12 1.30 -3.77 -1.70 2.02 -1.92 -3.43 112.91 111.52 1wim h THR 49 Ca -0.26 -1.97 -0.49 0.00 0.77 0.00 0.00 66.41 64.47 1wim h THR 49 Cb 1.06 1.95 -0.02 0.00 -1.74 0.00 0.00 68.15 69.40 1wim h THR 49 CO 1.19 0.62 0.34 0.00 0.37 0.00 0.00 175.52 178.04 1wim s ALA 50 N -3.78 3.31 -1.02 6.16 0.00 -1.26 -4.91 121.76 120.27 1wim s ALA 50 Ca -0.09 0.59 -0.09 0.00 0.00 0.00 0.00 51.96 52.36 1wim s ALA 50 Cb 0.09 -3.20 0.26 0.00 0.00 0.00 0.00 23.12 20.27 1wim s ALA 50 CO 0.89 0.20 0.99 0.42 0.00 0.00 0.00 175.76 178.26 1wim s ILE 51 N -1.28 5.71 1.36 0.00 -1.09 -1.26 -5.04 121.20 119.60 1wim s ILE 51 Ca 0.43 -3.25 -0.22 0.00 -2.23 0.00 0.00 60.65 55.37 1wim s ILE 51 Cb -0.24 -4.46 0.35 0.00 -1.58 0.00 0.00 42.46 36.52 1wim s ILE 51 CO 0.30 -1.14 1.00 -0.55 -1.23 0.00 0.00 174.94 173.32 1wim s SER 52 N 1.35 -0.50 0.22 3.58 0.15 -1.26 -0.66 113.70 116.57 1wim s SER 52 Ca 0.27 0.71 -0.30 0.00 0.70 0.00 0.00 55.95 57.34 1wim s SER 52 Cb -0.10 -0.98 -0.09 0.00 -1.71 0.00 0.00 66.02 63.15 1wim s SER 52 CO -0.09 -5.01 1.18 0.00 1.20 0.00 0.00 173.24 170.53 1wim n PRO 54 N 2.01 0.49 -3.79 0.00 -0.04 -1.26 -4.56 135.00 127.85 1wim n PRO 54 Ca 0.03 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.12 1wim n PRO 54 Cb 0.44 -1.31 -0.13 0.00 -0.04 0.00 0.00 33.50 32.47 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 -1.81 5.01 0.00 3.54 2.15 -1.26 -4.95 116.67 119.35 1wim s ASP 55 Ca 0.14 -0.66 0.17 0.00 0.43 0.00 0.00 52.55 52.64 1wim s ASP 55 Cb 0.07 -1.86 0.77 0.00 -0.30 0.00 0.00 42.92 41.60 1wim s ASP 55 CO 0.11 -0.16 1.55 0.00 -0.17 0.00 0.00 175.17 176.50 1wim n ALA 56 N 4.85 1.83 -1.29 3.66 0.00 -1.26 -2.50 120.51 125.79 1wim n ALA 56 Ca -0.15 -0.06 -0.11 0.00 0.00 0.00 0.00 53.44 53.11 1wim n ALA 56 Cb 0.48 -1.28 0.21 0.00 0.00 0.00 0.00 19.45 18.86 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 -1.46 4.76 -2.64 0.00 0.00 -1.26 -4.94 120.51 114.97 1wim n ALA 57 Ca 0.05 -2.90 -0.43 0.00 0.00 0.00 0.00 53.44 50.16 1wim n ALA 57 Cb 0.19 -1.07 -0.06 0.00 0.00 0.00 0.00 19.45 18.51 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 6.42 0.17 -0.04 0.00 -0.04 -1.26 -2.54 135.00 137.72 1wim n PRO 59 Ca -0.03 0.41 -0.08 0.00 -0.04 0.00 0.00 63.50 63.76 1wim n PRO 59 Cb 0.47 -1.84 -0.14 0.00 -0.04 0.00 0.00 33.50 31.95 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 -2.16 0.64 -3.68 0.54 3.00 -1.26 -4.99 118.16 110.25 1wim n LYS 60 Ca 0.02 0.22 -0.23 0.00 -0.00 0.00 0.00 58.31 58.32 1wim n LYS 60 Cb 0.22 -1.73 0.05 0.00 0.00 0.00 0.00 35.03 33.57 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 -2.95 -6.00 -3.12 1.64 6.02 -1.05 -4.95 117.38 106.96 1wim n GLN 61 Ca -0.20 0.70 -0.39 0.00 -0.01 0.00 0.00 57.00 57.11 1wim n GLN 61 Cb 1.05 -5.53 -0.06 0.00 1.02 0.00 0.00 30.24 26.72 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 -3.91 2.78 0.70 1.08 0.00 -1.26 -4.80 107.32 101.91 1wim s GLY 62 Ca 0.28 0.20 0.03 0.00 0.00 0.00 0.00 44.72 45.22 1wim s GLY 62 CO 0.78 0.65 0.96 0.30 0.00 0.00 0.00 173.10 175.80 1wim s HIS 63 N -1.17 1.24 0.24 1.90 0.09 -1.26 -2.03 115.29 114.31 1wim s HIS 63 Ca 0.33 -0.51 -0.05 0.00 -0.00 0.00 0.00 55.06 54.83 1wim s HIS 63 Cb -0.21 -2.72 -0.06 0.00 -0.00 0.00 0.00 32.58 29.60 1wim s HIS 63 CO 0.23 -1.66 0.50 -0.51 -0.00 0.00 0.00 174.74 173.29 1wim s LEU 64 N -5.03 4.14 0.58 0.89 2.01 0.17 -4.55 118.68 116.89 1wim s LEU 64 Ca 0.66 0.69 -0.04 0.00 0.01 0.00 0.00 54.13 55.45 1wim s LEU 64 Cb -0.04 -3.47 0.02 0.00 0.01 0.00 0.00 46.19 42.70 1wim s LEU 64 CO 0.43 -0.11 0.86 -1.10 1.01 0.00 0.00 176.35 177.45 1wim s GLN 65 N -3.21 2.80 0.02 1.70 -1.52 -1.26 -4.82 119.66 113.37 1wim s GLN 65 Ca 0.43 -0.20 -0.20 0.00 -1.95 0.00 0.00 55.36 53.43 1wim s GLN 65 Cb -0.11 -2.33 -0.11 0.00 -0.22 0.00 0.00 33.01 30.24 1wim s GLN 65 CO 0.27 -0.70 1.10 0.93 -0.25 0.00 0.00 175.29 176.63 1wim h GLU 66 N -0.11 -0.71 -0.94 2.91 5.08 -1.99 -2.36 114.58 116.46 1wim h GLU 66 Ca -0.45 0.05 0.27 0.00 -1.00 0.00 0.00 59.36 58.23 1wim h GLU 66 Cb 1.27 0.16 -0.14 0.00 0.50 0.00 0.00 28.75 30.54 1wim h GLU 66 CO 0.59 -0.47 0.41 -2.95 -1.00 0.00 0.00 179.01 175.59 1wim h ASN 67 N -0.88 0.28 -0.92 1.42 -1.07 -1.99 0.57 115.58 113.00 1wim h ASN 67 Ca -0.08 0.19 0.00 0.00 0.07 0.00 0.00 56.30 56.48 1wim h ASN 67 Cb 0.57 0.19 -0.04 0.00 -2.07 0.00 0.00 38.32 36.96 1wim h ASN 67 CO 0.12 -0.11 0.58 -0.33 0.07 0.00 0.00 177.43 177.76 1wim h GLU 68 N 0.30 1.22 0.15 4.14 4.39 -1.95 -3.04 114.58 119.79 1wim h GLU 68 Ca 0.63 -0.09 -0.01 0.00 0.34 0.00 0.00 59.36 60.23 1wim h GLU 68 Cb 1.34 -0.27 0.00 0.00 -0.10 0.00 0.00 28.75 29.72 1wim h GLU 68 CO -0.61 0.83 -0.07 0.82 -1.16 0.00 0.00 179.01 178.82 1wim h ILE 69 N 1.25 0.87 -0.59 3.13 2.04 0.54 -2.64 117.51 122.10 1wim h ILE 69 Ca 0.33 -1.17 0.05 0.00 1.00 0.00 0.00 64.86 65.08 1wim h ILE 69 Cb -0.10 1.47 -0.07 0.00 -0.74 0.00 0.00 36.82 37.38 1wim h ILE 69 CO -0.07 0.23 -0.35 1.21 0.00 0.00 0.00 178.15 179.17 1wim n GLU 70 N -4.91 -0.26 -0.21 2.37 2.13 0.53 0.13 120.64 120.43 1wim n GLU 70 Ca -0.08 1.01 -0.05 0.00 0.66 0.00 0.00 57.16 58.70 1wim n GLU 70 Cb 0.26 -1.49 0.11 0.00 0.27 0.00 0.00 31.44 30.60 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 0.98 -0.31 -7.31 0.00 4.05 0.15 -3.44 114.93 109.05 1wim h MET 72 Ca 0.21 0.02 -0.46 0.00 -0.28 0.00 0.00 59.70 59.20 1wim h MET 72 Cb 0.32 0.07 0.09 0.00 -0.80 0.00 0.00 31.60 31.29 1wim h MET 72 CO -0.00 -0.21 0.21 0.14 0.23 0.00 0.00 176.91 177.28 1wim s VAL 73 N -3.89 2.21 0.64 -5.77 -7.23 0.77 -4.97 120.40 102.15 1wim s VAL 73 Ca -0.06 -0.35 0.02 0.00 -1.81 0.00 0.00 61.98 59.79 1wim s VAL 73 Cb 0.01 -2.86 0.09 0.00 0.56 0.00 0.00 36.38 34.18 1wim s VAL 73 CO 0.19 0.00 0.88 0.00 -0.31 0.00 0.00 175.10 175.86 1wim s ALA 74 N -3.30 4.01 0.22 1.32 0.00 -1.26 -4.74 121.76 118.00 1wim s ALA 74 Ca 0.65 -1.73 -0.09 0.00 0.00 0.00 0.00 51.96 50.78 1wim s ALA 74 Cb -0.08 -1.88 0.19 0.00 0.00 0.00 0.00 23.12 21.36 1wim s ALA 74 CO 0.46 -1.11 1.88 0.00 0.00 0.00 0.00 175.76 176.98 1wim h ALA 75 N -0.18 1.00 -0.79 0.00 0.00 -1.98 0.31 119.26 117.63 1wim h ALA 75 Ca -0.36 -0.04 0.13 0.00 0.00 0.00 0.00 54.91 54.63 1wim h ALA 75 Cb 1.28 -0.29 -0.09 0.00 0.00 0.00 0.00 17.79 18.69 1wim h ALA 75 CO 0.43 0.36 0.38 1.05 0.00 0.00 0.00 179.25 181.47 1wim h GLU 76 N 1.02 0.56 0.00 0.00 4.11 -2.01 -1.74 114.58 116.52 1wim h GLU 76 Ca 0.30 -0.03 -0.01 0.00 0.07 0.00 0.00 59.36 59.69 1wim h GLU 76 Cb -0.06 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.06 1wim h GLU 76 CO -0.08 0.37 -0.08 0.82 0.07 0.00 0.00 179.01 180.11 1wim h ILE 77 N 0.57 0.41 -0.80 -1.06 1.08 -1.81 -3.35 117.51 112.54 1wim h ILE 77 Ca 0.42 -1.32 0.23 0.00 -0.39 0.00 0.00 64.86 63.80 1wim h ILE 77 Cb 0.56 0.78 -0.15 0.00 -3.07 0.00 0.00 36.82 34.94 1wim h ILE 77 CO -0.35 0.14 0.06 0.80 -0.69 0.00 0.00 178.15 178.11 1wim n MET 78 N -4.72 -0.06 -0.09 2.37 1.56 0.11 0.12 117.12 116.40 1wim n MET 78 Ca -0.04 1.19 -0.06 0.00 -0.27 0.00 0.00 57.70 58.53 1wim n MET 78 Cb 0.14 -1.92 0.00 0.00 2.15 0.00 0.00 33.22 33.60 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 -0.07 -0.29 2.12 4.15 -1.45 0.22 115.11 119.78 1wim h GLN 79 Ca 0.51 0.00 0.08 0.00 0.77 0.00 0.00 58.65 60.02 1wim h GLN 79 Cb 1.08 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.78 1wim h GLN 79 CO -0.74 -0.05 0.34 0.00 -1.93 0.00 0.00 178.83 176.45 1wim h ARG 80 N -0.08 0.00 0.15 1.69 3.08 0.82 -0.81 114.38 119.23 1wim h ARG 80 Ca 0.17 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 60.02 1wim h ARG 80 Cb 0.34 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.41 1wim h ARG 80 CO -0.39 0.00 -0.90 -0.92 -1.07 0.00 0.00 179.97 176.69 1wim h TYR 81 N 0.00 0.58 0.06 3.04 3.20 -0.40 -2.53 116.97 120.91 1wim h TYR 81 Ca 0.14 -0.42 0.02 0.00 3.14 0.00 0.00 58.73 61.61 1wim h TYR 81 Cb 0.81 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 39.02 1wim h TYR 81 CO 0.00 1.34 -0.27 0.87 -1.64 0.00 0.00 178.16 178.47 1wim h LYS 82 N -0.33 -0.43 -0.38 1.82 1.79 -0.04 -0.03 116.57 118.98 1wim h LYS 82 Ca -0.16 0.03 -0.08 0.00 -2.18 0.00 0.00 60.65 58.26 1wim h LYS 82 Cb 1.69 0.10 -0.02 0.00 -1.58 0.00 0.00 32.23 32.42 1wim h LYS 82 CO 0.16 -0.29 -0.10 1.57 -1.08 0.00 0.00 179.45 179.71 1wim h LYS 83 N -0.44 0.65 -0.93 3.15 2.10 -1.59 -2.78 116.57 116.72 1wim h LYS 83 Ca 0.05 -0.20 0.01 0.00 -2.00 0.00 0.00 60.65 58.51 1wim h LYS 83 Cb 0.50 -0.06 -0.05 0.00 -0.90 0.00 0.00 32.23 31.72 1wim h LYS 83 CO -0.20 0.74 0.61 -0.07 -2.00 0.00 0.00 179.45 178.54 1wim h LEU 84 N 0.60 1.08 -1.50 7.07 3.38 -0.94 -1.38 115.31 123.61 1wim h LEU 84 Ca 0.11 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.99 1wim h LEU 84 Cb 0.53 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 41.00 1wim h LEU 84 CO 0.03 0.79 -0.26 1.56 0.09 0.00 0.00 178.44 180.65 1wim h GLN 85 N 1.27 0.00 0.00 1.13 1.08 -0.74 -1.87 115.11 115.98 1wim h GLN 85 Ca 0.34 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.54 1wim h GLN 85 Cb -0.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.29 1wim h GLN 85 CO -0.07 0.26 0.00 0.35 -0.95 0.00 0.00 178.83 178.41 1wim h PHE 86 N 0.00 0.00 -0.04 2.96 3.04 -1.17 -3.21 116.94 118.52 1wim h PHE 86 Ca -0.00 0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.93 1wim h PHE 86 Cb 0.50 0.00 -0.00 0.00 2.56 0.00 0.00 35.95 39.01 1wim h PHE 86 CO 0.00 0.00 -0.04 0.93 -2.02 0.00 0.00 178.31 177.18 1wim h GLU 87 N 0.00 0.10 -0.25 1.11 4.39 -1.00 -2.67 114.58 116.27 1wim h GLU 87 Ca 0.00 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.65 1wim h GLU 87 Cb 0.76 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.41 1wim h GLU 87 CO 0.00 0.57 0.00 2.89 -1.16 0.00 0.00 179.01 181.31 1wim n ARG 88 N -4.77 1.11 -0.09 2.33 -4.01 -1.22 -3.70 116.66 106.30 1wim n ARG 88 Ca -0.08 -0.14 -0.19 0.00 -1.04 0.00 0.00 57.85 56.41 1wim n ARG 88 Cb 0.29 -1.14 -0.06 0.00 -3.04 0.00 0.00 32.46 28.50 1wim n ARG 88 CO 0.00 0.00 0.00 0.43 -3.04 0.00 0.00 177.63 175.02 1wim n SER 89 N -0.30 1.55 0.00 2.89 7.64 -1.11 -5.12 113.62 119.17 1wim n SER 89 Ca 0.01 0.26 0.00 0.00 1.01 0.00 0.00 58.87 60.16 1wim n SER 89 Cb 0.09 -0.63 0.00 0.00 -1.01 0.00 0.00 64.21 62.67 1wim n SER 89 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wim n GLY 90 N 1.75 1.72 3.77 0.23 0.00 -1.02 -5.04 105.19 106.60 1wim n GLY 90 Ca -0.34 -2.02 -0.34 0.00 0.00 0.00 0.00 46.02 43.32 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 -2.11 3.03 0.31 1.61 0.04 -1.26 -4.98 135.00 131.65 1wim s PRO 91 Ca 0.00 1.48 -0.06 0.00 0.04 0.00 0.00 61.00 62.46 1wim s PRO 91 Cb 0.00 -1.97 0.00 0.00 0.04 0.00 0.00 34.50 32.57 1wim s PRO 91 CO 0.00 -1.08 0.48 -1.12 0.04 0.00 0.00 177.00 175.32 1wim s SER 92 N -2.24 0.55 -0.78 6.66 0.01 -1.26 -5.07 113.70 111.57 1wim s SER 92 Ca 0.69 -1.31 -0.24 0.00 1.31 0.00 0.00 55.95 56.40 1wim s SER 92 Cb -0.22 0.64 -0.17 0.00 0.21 0.00 0.00 66.02 66.48 1wim s SER 92 CO 0.35 -1.27 2.43 -0.24 0.41 0.00 0.00 173.24 174.93 1wim n SER 93 N -1.09 1.05 0.00 2.44 2.88 -1.26 -5.34 113.62 112.31 1wim n SER 93 Ca -0.00 -0.65 0.00 0.00 -1.33 0.00 0.00 58.87 56.89 1wim n SER 93 Cb 0.62 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 1wim n SER 93 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42