#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 7.32 0.22 1.61 0.01 -1.26 -5.02 113.70 116.59 1wim s SER 2 Ca 0.00 1.74 -0.22 0.00 1.31 0.00 0.00 55.95 58.78 1wim s SER 2 Cb 0.00 -2.57 0.04 0.00 0.21 0.00 0.00 66.02 63.70 1wim s SER 2 CO 0.00 -0.29 0.74 -0.94 0.41 0.00 0.00 173.24 173.16 1wim s SER 3 N 0.93 -0.32 0.00 2.44 1.04 -1.26 -5.03 113.70 111.51 1wim s SER 3 Ca 0.53 -0.42 0.00 0.00 0.48 0.00 0.00 55.95 56.53 1wim s SER 3 Cb -0.23 0.65 0.00 0.00 0.10 0.00 0.00 66.02 66.54 1wim s SER 3 CO 0.28 -1.17 0.00 0.61 0.98 0.00 0.00 173.24 173.95 1wim n GLY 4 N -0.44 2.90 3.72 7.32 0.00 -1.26 -5.07 105.19 112.36 1wim n GLY 4 Ca -0.07 -0.78 -0.41 0.00 0.00 0.00 0.00 46.02 44.76 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 7.37 -0.01 1.61 0.01 -1.26 -3.76 113.70 117.66 1wim s SER 5 Ca 0.00 1.65 0.16 0.00 1.31 0.00 0.00 55.95 59.07 1wim s SER 5 Cb 0.00 -2.55 -0.20 0.00 0.21 0.00 0.00 66.02 63.48 1wim s SER 5 CO 0.00 -0.12 0.54 -0.24 0.41 0.00 0.00 173.24 173.82 1wim n SER 6 N 3.25 0.97 -0.97 2.44 2.88 -1.25 -5.05 113.62 115.88 1wim n SER 6 Ca 0.03 -0.51 0.12 0.00 -1.33 0.00 0.00 58.87 57.18 1wim n SER 6 Cb 0.50 1.31 -0.06 0.00 -0.75 0.00 0.00 64.21 65.21 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 1.46 -2.79 3.15 0.46 0.00 -1.26 -4.98 105.19 101.23 1wim n GLY 7 Ca 0.01 -1.20 -0.22 0.00 0.00 0.00 0.00 46.02 44.60 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 2.23 2.43 -0.06 0.00 5.02 -1.26 -3.32 118.16 123.19 1wim n LYS 9 Ca -0.16 -2.20 -0.08 0.00 -2.02 0.00 0.00 58.31 53.86 1wim n LYS 9 Cb 0.55 -1.43 -0.03 0.00 -0.02 0.00 0.00 35.03 34.10 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 1.19 1.76 -1.09 -0.35 4.77 -1.26 -4.67 117.00 117.35 1wim n LEU 10 Ca 0.17 0.29 0.12 0.00 -0.03 0.00 0.00 56.01 56.56 1wim n LEU 10 Cb 0.53 -0.65 0.22 0.00 -2.33 0.00 0.00 43.42 41.18 1wim n LEU 10 CO 0.13 -0.35 0.70 0.00 -1.33 0.00 0.00 177.39 176.54 1wim n LEU 12 N 1.40 -2.09 -4.37 0.00 7.99 -1.21 -4.95 117.00 113.76 1wim n LEU 12 Ca 0.19 -0.91 -0.27 0.00 -0.01 0.00 0.00 56.01 55.00 1wim n LEU 12 Cb 0.59 -2.29 -0.13 0.00 -0.11 0.00 0.00 43.42 41.48 1wim n LEU 12 CO 0.16 0.37 -0.54 -0.83 -1.51 0.00 0.00 177.39 175.04 1wim s GLY 13 N -3.37 1.50 -0.01 -0.72 0.00 -1.26 -4.91 107.32 98.56 1wim s GLY 13 Ca 0.66 -1.45 -0.18 0.00 0.00 0.00 0.00 44.72 43.75 1wim s GLY 13 CO 0.89 -1.45 0.50 1.85 0.00 0.00 0.00 173.10 174.89 1wim s GLU 14 N -2.19 4.16 -0.03 2.90 2.56 -1.26 -2.31 118.70 122.53 1wim s GLU 14 Ca 0.13 0.57 -0.19 0.00 0.00 0.00 0.00 54.97 55.48 1wim s GLU 14 Cb -0.09 -3.30 0.04 0.00 2.00 0.00 0.00 34.13 32.78 1wim s GLU 14 CO 0.06 0.50 0.42 0.71 -0.56 0.00 0.00 175.26 176.39 1wim s TYR 15 N -0.55 -0.33 0.56 5.30 2.02 -1.26 -5.01 117.35 118.08 1wim s TYR 15 Ca 0.27 0.54 -0.19 0.00 -0.37 0.00 0.00 57.07 57.32 1wim s TYR 15 Cb -0.17 0.19 -0.05 0.00 -0.40 0.00 0.00 41.96 41.52 1wim s TYR 15 CO 0.15 -0.45 1.13 -1.25 -1.57 0.00 0.00 175.55 173.56 1wim s PRO 16 N -1.23 3.28 0.43 -1.71 0.04 -1.26 -3.85 135.00 130.69 1wim s PRO 16 Ca -0.12 1.58 0.19 0.00 0.04 0.00 0.00 61.00 62.69 1wim s PRO 16 Cb -0.04 -2.00 1.04 0.00 0.04 0.00 0.00 34.50 33.55 1wim s PRO 16 CO 0.06 -0.90 1.52 -0.39 0.04 0.00 0.00 177.00 177.33 1wim h VAL 17 N 1.04 0.00 -0.49 -0.36 -1.51 -1.95 0.08 116.25 113.06 1wim h VAL 17 Ca -0.50 0.00 -0.07 0.00 -1.23 0.00 0.00 66.70 64.91 1wim h VAL 17 Cb 1.26 0.42 -0.02 0.00 -2.13 0.00 0.00 31.29 30.83 1wim h VAL 17 CO 0.56 0.00 0.04 -0.33 -1.23 0.00 0.00 177.57 176.62 1wim h GLU 18 N 0.00 0.84 -1.03 5.19 3.07 -1.93 -3.03 114.58 117.69 1wim h GLU 18 Ca 0.00 -0.25 -0.66 0.00 -0.50 0.00 0.00 59.36 57.95 1wim h GLU 18 Cb 0.56 -0.09 -0.31 0.00 -0.84 0.00 0.00 28.75 28.07 1wim h GLU 18 CO 0.00 0.86 0.58 1.04 -1.40 0.00 0.00 179.01 180.09 1wim n GLN 19 N -4.37 2.86 -4.22 2.33 6.02 0.01 -4.96 117.38 115.05 1wim n GLN 19 Ca 0.01 -3.47 -0.13 0.00 -0.01 0.00 0.00 57.00 53.40 1wim n GLN 19 Cb 0.28 -2.29 -0.10 0.00 1.02 0.00 0.00 30.24 29.16 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 -3.80 1.05 -0.10 -1.09 -1.94 -1.15 -2.09 119.30 110.18 1wim s MET 20 Ca 0.61 -1.49 -0.03 0.00 -1.71 0.00 0.00 55.69 53.08 1wim s MET 20 Cb 0.49 -0.23 0.04 0.00 2.01 0.00 0.00 34.83 37.14 1wim s MET 20 CO -0.03 -0.11 0.05 0.99 -0.01 0.00 0.00 175.02 175.90 1wim s THR 21 N -3.67 0.09 -0.36 2.05 2.01 0.54 -4.77 115.64 111.54 1wim s THR 21 Ca 0.22 0.07 -0.22 0.00 0.31 0.00 0.00 61.69 62.07 1wim s THR 21 Cb 0.06 -0.47 0.01 0.00 0.01 0.00 0.00 72.50 72.11 1wim s THR 21 CO 0.02 0.03 0.71 -0.89 -0.69 0.00 0.00 174.62 173.80 1wim s THR 22 N 2.08 4.81 -0.00 -0.82 2.01 -1.26 -2.20 115.64 120.24 1wim s THR 22 Ca 0.03 0.74 -0.30 0.00 0.31 0.00 0.00 61.69 62.47 1wim s THR 22 Cb -0.14 -4.15 -0.06 0.00 0.01 0.00 0.00 72.50 68.17 1wim s THR 22 CO -0.06 -0.38 1.47 -0.63 -0.69 0.00 0.00 174.62 174.34 1wim s ILE 23 N 2.92 3.60 -0.52 1.82 1.01 0.51 -4.88 121.20 125.65 1wim s ILE 23 Ca 0.28 0.95 0.02 0.00 0.00 0.00 0.00 60.65 61.90 1wim s ILE 23 Cb -0.14 -3.61 0.14 0.00 0.01 0.00 0.00 42.46 38.86 1wim s ILE 23 CO 0.16 -0.02 0.92 0.00 0.00 0.00 0.00 174.94 176.00 1wim n ALA 24 N 5.74 2.89 -0.02 9.38 0.00 -1.26 -1.91 120.51 135.32 1wim n ALA 24 Ca 0.14 -0.43 -0.04 0.00 0.00 0.00 0.00 53.44 53.12 1wim n ALA 24 Cb 0.43 -1.05 -0.02 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 0.15 0.11 -1.68 0.00 3.00 -1.26 -4.82 117.38 112.88 1wim n GLN 25 Ca 0.08 0.03 0.01 0.00 -0.01 0.00 0.00 57.00 57.11 1wim n GLN 25 Cb 0.55 -0.96 0.06 0.00 0.00 0.00 0.00 30.24 29.89 1wim n GLN 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1wim n GLN 27 N -0.17 -0.84 -3.81 0.00 1.13 -0.80 -4.87 117.38 108.01 1wim n GLN 27 Ca 0.12 0.10 -0.36 0.00 -1.94 0.00 0.00 57.00 54.92 1wim n GLN 27 Cb 0.97 -3.43 -0.13 0.00 0.11 0.00 0.00 30.24 27.75 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 1.55 5.21 0.02 0.00 2.07 -1.26 -0.36 121.20 128.43 1wim s ILE 29 Ca 0.06 -0.09 -0.18 0.00 -1.41 0.00 0.00 60.65 59.02 1wim s ILE 29 Cb -0.15 -3.35 0.03 0.00 0.13 0.00 0.00 42.46 39.13 1wim s ILE 29 CO 0.01 0.46 0.40 -0.36 -1.91 0.00 0.00 174.94 173.54 1wim s PHE 30 N -1.16 -0.27 0.01 3.50 0.08 -0.94 -4.72 117.98 114.49 1wim s PHE 30 Ca 0.21 0.31 -0.30 0.00 0.12 0.00 0.00 56.93 57.27 1wim s PHE 30 Cb -0.12 0.19 -0.06 0.00 -0.57 0.00 0.00 43.02 42.47 1wim s PHE 30 CO 0.11 -0.52 1.37 0.00 -0.10 0.00 0.00 175.22 176.08 1wim n THR 32 N 4.55 -0.40 -0.03 0.00 -1.04 -0.89 -0.78 114.28 115.69 1wim n THR 32 Ca 0.13 1.48 -0.01 0.00 -2.04 0.00 0.00 64.05 63.61 1wim n THR 32 Cb 0.44 -1.86 -0.01 0.00 -1.82 0.00 0.00 70.33 67.08 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 -4.80 -0.08 0.00 -4.42 4.77 -1.26 0.36 117.00 111.56 1wim n LEU 33 Ca 0.02 0.86 -0.02 0.00 -0.03 0.00 0.00 56.01 56.84 1wim n LEU 33 Cb 0.18 -0.38 -0.01 0.00 -2.33 0.00 0.00 43.42 40.88 1wim n LEU 33 CO -0.10 -0.47 0.50 0.00 -1.33 0.00 0.00 177.39 175.99 1wim n LEU 35 N -2.95 0.31 0.11 0.00 4.77 -0.83 0.74 117.00 119.16 1wim n LEU 35 Ca -0.01 1.55 -0.13 0.00 -0.03 0.00 0.00 56.01 57.39 1wim n LEU 35 Cb 0.05 -0.75 -0.08 0.00 -2.33 0.00 0.00 43.42 40.31 1wim n LEU 35 CO 0.01 -1.73 0.71 0.50 -1.33 0.00 0.00 177.39 175.55 1wim h LYS 36 N 0.00 -0.25 0.00 3.23 3.64 0.13 -1.08 116.57 122.24 1wim h LYS 36 Ca 0.79 0.02 -0.04 0.00 -1.27 0.00 0.00 60.65 60.14 1wim h LYS 36 Cb 2.07 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 33.94 1wim h LYS 36 CO -0.73 -0.02 -0.21 1.96 -2.27 0.00 0.00 179.45 178.18 1wim h GLN 37 N -0.43 0.00 0.37 1.90 7.50 0.16 -0.77 115.11 123.84 1wim h GLN 37 Ca -0.03 0.00 -0.02 0.00 0.50 0.00 0.00 58.65 59.11 1wim h GLN 37 Cb 0.33 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.87 1wim h GLN 37 CO 0.04 0.21 -0.18 -0.92 -1.50 0.00 0.00 178.83 176.48 1wim h TYR 38 N 0.00 -0.46 -0.62 2.96 3.20 -0.24 -0.82 116.97 120.99 1wim h TYR 38 Ca -0.00 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.91 1wim h TYR 38 Cb 0.39 0.15 -0.04 0.00 1.54 0.00 0.00 36.73 38.77 1wim h TYR 38 CO 0.00 -0.29 0.41 -0.39 -1.64 0.00 0.00 178.16 176.26 1wim h VAL 39 N -0.79 1.02 0.65 1.81 -1.51 -1.20 -2.39 116.25 113.84 1wim h VAL 39 Ca -0.05 -0.22 -0.03 0.00 -1.23 0.00 0.00 66.70 65.17 1wim h VAL 39 Cb 0.38 0.32 0.01 0.00 -2.13 0.00 0.00 31.29 29.87 1wim h VAL 39 CO 0.08 0.12 -0.31 -0.33 -1.23 0.00 0.00 177.57 175.90 1wim h GLU 40 N 0.64 -0.84 -0.96 5.19 5.08 -1.19 -1.72 114.58 120.77 1wim h GLU 40 Ca 0.27 0.06 0.28 0.00 -1.00 0.00 0.00 59.36 58.97 1wim h GLU 40 Cb 0.24 0.19 -0.14 0.00 0.50 0.00 0.00 28.75 29.54 1wim h GLU 40 CO -0.08 -0.56 0.47 -0.07 -1.00 0.00 0.00 179.01 177.77 1wim h LEU 41 N -1.16 0.39 0.62 1.33 -0.00 -0.97 0.29 115.31 115.81 1wim h LEU 41 Ca -0.09 0.18 -0.03 0.00 -0.00 0.00 0.00 57.88 57.94 1wim h LEU 41 Cb 0.67 0.16 0.01 0.00 -0.00 0.00 0.00 40.66 41.49 1wim h LEU 41 CO 0.15 -0.10 -0.30 -0.07 -0.00 0.00 0.00 178.44 178.12 1wim h LEU 42 N 0.33 -0.71 -0.06 1.67 3.38 -1.40 -3.13 115.31 115.39 1wim h LEU 42 Ca 0.66 0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.70 1wim h LEU 42 Cb 1.43 0.18 -0.06 0.00 0.09 0.00 0.00 40.66 42.30 1wim h LEU 42 CO -0.60 -0.41 -0.35 0.40 0.09 0.00 0.00 178.44 177.57 1wim h ILE 43 N -1.03 0.25 -0.82 1.22 2.04 -0.35 -1.64 117.51 117.18 1wim h ILE 43 Ca -0.09 0.00 0.26 0.00 1.00 0.00 0.00 64.86 66.03 1wim h ILE 43 Cb 0.64 0.25 -0.15 0.00 -0.74 0.00 0.00 36.82 36.82 1wim h ILE 43 CO 0.14 0.00 0.13 0.29 0.00 0.00 0.00 178.15 178.71 1wim n LYS 44 N -5.42 -0.06 0.11 2.37 5.02 0.92 -0.36 118.16 120.74 1wim n LYS 44 Ca -0.04 1.20 -0.10 0.00 -2.02 0.00 0.00 58.31 57.35 1wim n LYS 44 Cb 0.34 -1.98 -0.06 0.00 -0.02 0.00 0.00 35.03 33.31 1wim n LYS 44 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 1wim h GLU 45 N 0.00 -0.48 -0.16 1.97 4.57 -1.23 -3.48 114.58 115.77 1wim h GLU 45 Ca 0.55 0.03 0.00 0.00 -1.18 0.00 0.00 59.36 58.76 1wim h GLU 45 Cb 1.24 0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.94 1wim h GLU 45 CO -0.74 -0.32 0.00 0.41 -1.18 0.00 0.00 179.01 177.18 1wim n GLY 46 N -1.30 1.04 0.00 1.92 0.00 0.52 -5.01 105.19 102.36 1wim n GLY 46 Ca -0.06 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1wim n GLY 46 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 1wim n LEU 47 N -0.08 0.57 -3.85 0.99 -0.00 -1.26 -5.05 117.00 108.31 1wim n LEU 47 Ca 0.00 0.00 -0.15 0.00 -0.00 0.00 0.00 56.01 55.86 1wim n LEU 47 Cb 0.09 0.00 -0.15 0.00 -0.00 0.00 0.00 43.42 43.36 1wim n LEU 47 CO 0.00 0.09 -0.37 -1.83 -0.00 0.00 0.00 177.39 175.28 1wim s GLU 48 N -1.90 0.16 -0.14 1.47 -1.05 -1.26 -5.05 118.70 110.93 1wim s GLU 48 Ca 0.00 0.03 -0.11 0.00 -0.15 0.00 0.00 54.97 54.74 1wim s GLU 48 Cb 0.00 -0.27 -0.24 0.00 -0.44 0.00 0.00 34.13 33.17 1wim s GLU 48 CO 0.00 -0.06 0.33 -2.37 0.95 0.00 0.00 175.26 174.11 1wim n THR 49 N 3.61 1.72 -1.68 1.83 5.66 -1.26 -4.62 114.28 119.53 1wim n THR 49 Ca -0.20 -0.47 -0.49 0.00 -3.05 0.00 0.00 64.05 59.84 1wim n THR 49 Cb 0.55 -1.83 -0.05 0.00 -1.55 0.00 0.00 70.33 67.45 1wim n THR 49 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1wim n ALA 50 N -3.12 0.85 -3.18 1.79 0.00 -1.26 -4.90 120.51 110.69 1wim n ALA 50 Ca -0.32 0.29 -0.45 0.00 0.00 0.00 0.00 53.44 52.96 1wim n ALA 50 Cb 0.94 -2.49 -0.01 0.00 0.00 0.00 0.00 19.45 17.89 1wim n ALA 50 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1wim s ILE 51 N 4.07 5.49 1.37 0.00 -1.09 -1.26 -5.02 121.20 124.75 1wim s ILE 51 Ca 0.93 -2.76 -0.21 0.00 -2.23 0.00 0.00 60.65 56.38 1wim s ILE 51 Cb -0.70 -4.68 0.34 0.00 -1.58 0.00 0.00 42.46 35.84 1wim s ILE 51 CO 0.52 -1.31 0.86 -0.24 -1.23 0.00 0.00 174.94 173.54 1wim n SER 52 N 4.28 -3.45 -4.74 3.58 2.88 -1.26 0.24 113.62 115.15 1wim n SER 52 Ca 0.25 -0.64 -0.41 0.00 -1.33 0.00 0.00 58.87 56.74 1wim n SER 52 Cb 0.43 -1.06 -0.03 0.00 -0.75 0.00 0.00 64.21 62.80 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 2.20 0.49 -3.78 0.00 -0.04 -1.26 -4.60 135.00 128.02 1wim n PRO 54 Ca 0.04 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.14 1wim n PRO 54 Cb 0.43 -1.31 -0.13 0.00 -0.04 0.00 0.00 33.50 32.45 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 -1.82 5.01 0.42 3.54 -1.08 -1.26 -4.96 116.67 116.51 1wim s ASP 55 Ca 0.15 -0.28 0.23 0.00 -0.52 0.00 0.00 52.55 52.13 1wim s ASP 55 Cb 0.07 -1.89 0.75 0.00 -1.46 0.00 0.00 42.92 40.38 1wim s ASP 55 CO 0.11 -0.05 1.75 0.00 0.52 0.00 0.00 175.17 177.51 1wim h ALA 56 N 8.22 0.96 -1.00 3.66 0.00 -1.98 -3.17 119.26 125.96 1wim h ALA 56 Ca -0.38 -0.23 -0.71 0.00 0.00 0.00 0.00 54.91 53.59 1wim h ALA 56 Cb 1.17 -0.04 -0.28 0.00 0.00 0.00 0.00 17.79 18.63 1wim h ALA 56 CO 0.58 0.32 0.94 0.00 0.00 0.00 0.00 179.25 181.09 1wim n ALA 57 N -2.21 6.41 -2.51 0.00 0.00 -1.26 -4.94 120.51 116.00 1wim n ALA 57 Ca 0.01 -3.69 -0.42 0.00 0.00 0.00 0.00 53.44 49.34 1wim n ALA 57 Cb 0.49 -1.85 -0.10 0.00 0.00 0.00 0.00 19.45 17.99 1wim n ALA 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1wim h PRO 59 N 8.56 0.00 0.00 0.00 0.13 -1.93 -2.83 132.00 135.92 1wim h PRO 59 Ca -0.29 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.83 1wim h PRO 59 Cb 1.14 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.26 1wim h PRO 59 CO 0.71 0.00 -1.90 1.17 -0.23 0.00 0.00 178.00 177.75 1wim n LYS 60 N -2.70 0.60 -4.03 0.86 4.81 -1.26 -5.01 118.16 111.43 1wim n LYS 60 Ca 0.01 -0.17 -0.30 0.00 -0.87 0.00 0.00 58.31 56.98 1wim n LYS 60 Cb 0.26 -1.46 -0.03 0.00 0.02 0.00 0.00 35.03 33.82 1wim n LYS 60 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1wim n GLN 61 N -2.19 -2.15 -1.13 1.64 6.02 -1.07 -4.92 117.38 113.58 1wim n GLN 61 Ca -0.04 0.30 -0.29 0.00 -0.01 0.00 0.00 57.00 56.96 1wim n GLN 61 Cb 0.53 -4.04 0.19 0.00 1.02 0.00 0.00 30.24 27.93 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 -4.20 1.56 0.32 1.08 0.00 -1.26 -4.75 107.32 100.06 1wim s GLY 62 Ca 0.10 -0.41 0.09 0.00 0.00 0.00 0.00 44.72 44.50 1wim s GLY 62 CO 0.92 0.23 -0.10 -1.58 0.00 0.00 0.00 173.10 172.58 1wim s HIS 63 N -2.95 2.25 -0.42 1.90 2.46 -1.26 -1.02 115.29 116.25 1wim s HIS 63 Ca 0.66 -0.54 -0.15 0.00 0.47 0.00 0.00 55.06 55.50 1wim s HIS 63 Cb -0.19 -1.25 0.03 0.00 -0.13 0.00 0.00 32.58 31.04 1wim s HIS 63 CO 0.58 0.51 0.33 -0.51 -2.47 0.00 0.00 174.74 173.17 1wim s LEU 64 N -3.54 5.16 1.14 8.88 2.01 0.14 -4.75 118.68 127.72 1wim s LEU 64 Ca 0.31 -0.94 -0.15 0.00 0.01 0.00 0.00 54.13 53.36 1wim s LEU 64 Cb 0.02 -2.18 0.21 0.00 0.01 0.00 0.00 46.19 44.24 1wim s LEU 64 CO 0.15 -0.49 0.60 0.00 1.01 0.00 0.00 176.35 177.62 1wim n GLN 65 N 5.21 -2.01 0.04 1.70 6.02 -1.26 -4.47 117.38 122.60 1wim n GLN 65 Ca -0.11 -0.56 -0.13 0.00 -0.01 0.00 0.00 57.00 56.19 1wim n GLN 65 Cb 0.47 -1.98 -0.09 0.00 1.02 0.00 0.00 30.24 29.66 1wim n GLN 65 CO 0.00 0.00 0.00 1.49 -1.01 0.00 0.00 177.06 177.54 1wim h GLU 66 N -2.39 -0.09 -0.90 -1.09 4.81 -2.00 -3.02 114.58 109.90 1wim h GLU 66 Ca -0.57 0.01 0.23 0.00 -0.13 0.00 0.00 59.36 58.89 1wim h GLU 66 Cb 1.34 0.02 -0.16 0.00 0.63 0.00 0.00 28.75 30.58 1wim h GLU 66 CO 0.44 0.21 0.06 -2.95 -0.73 0.00 0.00 179.01 176.04 1wim h ASN 67 N -0.40 -0.35 0.58 1.04 7.08 -2.00 0.24 115.58 121.77 1wim h ASN 67 Ca -0.01 0.24 -0.02 0.00 -3.08 0.00 0.00 56.30 53.42 1wim h ASN 67 Cb 0.35 0.40 -0.00 0.00 -2.08 0.00 0.00 38.32 36.99 1wim h ASN 67 CO 0.02 -0.26 -0.33 -0.33 -2.08 0.00 0.00 177.43 174.44 1wim h GLU 68 N 0.08 -0.83 0.07 4.14 5.08 -1.90 -3.07 114.58 118.15 1wim h GLU 68 Ca 0.53 0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.97 1wim h GLU 68 Cb 1.05 0.19 -0.04 0.00 0.50 0.00 0.00 28.75 30.45 1wim h GLU 68 CO -0.79 -0.55 -0.24 0.82 -1.00 0.00 0.00 179.01 177.24 1wim h ILE 69 N -0.86 0.45 -0.73 3.13 2.04 -0.88 0.61 117.51 121.27 1wim h ILE 69 Ca -0.07 0.00 0.11 0.00 1.00 0.00 0.00 64.86 65.90 1wim h ILE 69 Cb 0.68 0.45 -0.12 0.00 -0.74 0.00 0.00 36.82 37.10 1wim h ILE 69 CO 0.09 0.00 -0.29 1.21 0.00 0.00 0.00 178.15 179.16 1wim n GLU 70 N -5.36 -0.18 -0.03 2.37 2.13 0.64 0.00 120.64 120.22 1wim n GLU 70 Ca -0.06 1.13 -0.15 0.00 0.66 0.00 0.00 57.16 58.74 1wim n GLU 70 Cb 0.28 -1.67 -0.10 0.00 0.27 0.00 0.00 31.44 30.21 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 -0.32 -0.11 -6.38 0.00 4.05 0.20 -3.41 114.93 108.95 1wim h MET 72 Ca -0.03 0.01 -0.45 0.00 -0.28 0.00 0.00 59.70 58.95 1wim h MET 72 Cb 0.97 0.03 0.01 0.00 -0.80 0.00 0.00 31.60 31.80 1wim h MET 72 CO 0.06 -0.07 -0.27 0.14 0.23 0.00 0.00 176.91 176.99 1wim s VAL 73 N -5.97 2.75 0.38 -5.77 -7.23 0.49 -4.87 120.40 100.18 1wim s VAL 73 Ca -0.14 -1.10 -0.02 0.00 -1.81 0.00 0.00 61.98 58.91 1wim s VAL 73 Cb 0.17 -2.86 -0.04 0.00 0.56 0.00 0.00 36.38 34.22 1wim s VAL 73 CO 0.70 0.00 0.61 0.00 -0.31 0.00 0.00 175.10 176.10 1wim s ALA 74 N -2.44 3.61 0.18 1.32 0.00 -1.26 -4.75 121.76 118.42 1wim s ALA 74 Ca 0.53 -0.75 -0.26 0.00 0.00 0.00 0.00 51.96 51.48 1wim s ALA 74 Cb -0.07 -2.27 0.04 0.00 0.00 0.00 0.00 23.12 20.81 1wim s ALA 74 CO 0.32 -0.08 1.55 0.00 0.00 0.00 0.00 175.76 177.55 1wim h ALA 75 N 0.73 -0.32 -0.91 0.00 0.00 -1.97 0.36 119.26 117.15 1wim h ALA 75 Ca -0.49 0.15 0.22 0.00 0.00 0.00 0.00 54.91 54.80 1wim h ALA 75 Cb 1.21 1.17 -0.17 0.00 0.00 0.00 0.00 17.79 20.01 1wim h ALA 75 CO 0.62 -0.85 -0.05 1.05 0.00 0.00 0.00 179.25 180.02 1wim h GLU 76 N -0.08 0.03 0.33 0.00 4.11 -2.00 -1.25 114.58 115.73 1wim h GLU 76 Ca 0.21 -0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.62 1wim h GLU 76 Cb 0.51 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.75 1wim h GLU 76 CO -0.88 0.02 -0.16 0.82 0.07 0.00 0.00 179.01 178.88 1wim h ILE 77 N 0.04 0.25 -0.71 -1.06 1.08 -0.89 -3.31 117.51 112.90 1wim h ILE 77 Ca 0.50 -0.74 0.12 0.00 -0.39 0.00 0.00 64.86 64.35 1wim h ILE 77 Cb 0.93 0.41 -0.12 0.00 -3.07 0.00 0.00 36.82 34.98 1wim h ILE 77 CO -0.86 0.06 -0.25 0.80 -0.69 0.00 0.00 178.15 177.21 1wim n MET 78 N -5.08 -0.14 -0.35 2.37 1.56 0.89 0.10 117.12 116.47 1wim n MET 78 Ca -0.07 1.09 0.05 0.00 -0.27 0.00 0.00 57.70 58.51 1wim n MET 78 Cb 0.23 -1.63 0.13 0.00 2.15 0.00 0.00 33.22 34.10 1wim n MET 78 CO 0.00 0.00 0.00 0.94 -0.73 0.00 0.00 175.97 176.18 1wim n GLN 79 N -5.07 -0.10 -0.22 2.12 -0.06 -0.56 0.91 117.38 114.41 1wim n GLN 79 Ca 0.08 1.52 0.02 0.00 -2.00 0.00 0.00 57.00 56.62 1wim n GLN 79 Cb 0.30 -2.26 0.13 0.00 -4.06 0.00 0.00 30.24 24.35 1wim n GLN 79 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1wim h ARG 80 N 0.00 0.31 -0.27 3.69 3.08 0.54 -0.22 114.38 121.50 1wim h ARG 80 Ca 0.46 -0.02 -0.17 0.00 0.07 0.00 0.00 59.98 60.32 1wim h ARG 80 Cb 0.70 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 1wim h ARG 80 CO -1.00 0.20 -0.51 -0.92 -1.07 0.00 0.00 179.97 176.67 1wim h TYR 81 N 0.32 0.96 -0.47 3.04 5.03 0.54 -2.52 116.97 123.87 1wim h TYR 81 Ca 0.35 -0.33 0.04 0.00 2.58 0.00 0.00 58.73 61.37 1wim h TYR 81 Cb 0.52 -0.19 -0.04 0.00 1.55 0.00 0.00 36.73 38.57 1wim h TYR 81 CO -0.22 1.12 0.23 0.87 -1.32 0.00 0.00 178.16 178.84 1wim h LYS 82 N 0.60 0.44 -0.04 1.82 1.57 0.72 -1.48 116.57 120.20 1wim h LYS 82 Ca 0.02 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 1wim h LYS 82 Cb 1.09 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.29 1wim h LYS 82 CO 0.11 0.29 -0.45 1.57 -0.57 0.00 0.00 179.45 180.41 1wim h LYS 83 N 0.46 0.08 -0.38 3.15 2.10 -1.08 -2.90 116.57 118.00 1wim h LYS 83 Ca 0.21 -0.04 -0.08 0.00 -2.00 0.00 0.00 60.65 58.74 1wim h LYS 83 Cb 0.13 -0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.44 1wim h LYS 83 CO -0.16 0.51 -0.08 -0.07 -2.00 0.00 0.00 179.45 177.65 1wim h LEU 84 N 0.07 0.62 0.33 7.07 3.38 -0.85 -2.92 115.31 123.01 1wim h LEU 84 Ca 0.00 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1wim h LEU 84 Cb 0.82 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.39 1wim h LEU 84 CO 0.06 0.75 -0.25 1.56 0.09 0.00 0.00 178.44 180.65 1wim h GLN 85 N 0.59 -0.56 -0.18 1.13 1.08 -1.09 -2.98 115.11 113.10 1wim h GLN 85 Ca 0.11 0.04 0.05 0.00 -1.45 0.00 0.00 58.65 57.40 1wim h GLN 85 Cb 0.50 0.13 -0.06 0.00 -0.05 0.00 0.00 27.48 28.00 1wim h GLN 85 CO 0.03 -0.37 -0.21 0.35 -0.95 0.00 0.00 178.83 177.67 1wim h PHE 86 N -0.58 -0.56 -0.96 2.96 3.04 -1.59 -1.52 116.94 117.73 1wim h PHE 86 Ca -0.03 0.03 0.34 0.00 3.98 0.00 0.00 57.97 62.30 1wim h PHE 86 Cb 0.50 0.28 -0.18 0.00 2.56 0.00 0.00 35.95 39.11 1wim h PHE 86 CO -0.13 -0.29 0.30 0.39 -2.02 0.00 0.00 178.31 176.55 1wim n GLU 87 N -5.35 -0.07 -3.57 1.11 1.02 -1.11 -2.19 120.64 110.47 1wim n GLU 87 Ca -0.02 1.37 -0.38 0.00 -0.02 0.00 0.00 57.16 58.11 1wim n GLU 87 Cb 0.27 -2.34 -0.05 0.00 -0.02 0.00 0.00 31.44 29.30 1wim n GLU 87 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1wim s ARG 88 N -5.68 3.41 -0.04 3.49 1.81 -0.57 -5.01 118.95 116.36 1wim s ARG 88 Ca -0.10 -3.16 -0.01 0.00 -1.72 0.00 0.00 55.73 50.73 1wim s ARG 88 Cb 0.31 -4.08 0.03 0.00 -0.45 0.00 0.00 34.95 30.76 1wim s ARG 88 CO 0.75 -1.25 0.08 -1.54 -0.68 0.00 0.00 175.30 172.66 1wim s SER 89 N 0.33 -0.02 -0.81 0.23 1.04 -0.93 -4.91 113.70 108.63 1wim s SER 89 Ca 0.27 0.16 -0.01 0.00 0.48 0.00 0.00 55.95 56.85 1wim s SER 89 Cb -0.09 0.06 0.00 0.00 0.10 0.00 0.00 66.02 66.09 1wim s SER 89 CO -0.11 -0.13 0.64 0.61 0.98 0.00 0.00 173.24 175.23 1wim n GLY 90 N 4.12 -1.28 0.00 7.32 0.00 -1.26 -4.81 105.19 109.27 1wim n GLY 90 Ca -0.26 0.56 0.07 0.00 0.00 0.00 0.00 46.02 46.39 1wim n GLY 90 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wim n PRO 91 N -2.42 0.25 0.00 1.61 -0.04 -1.26 -3.66 135.00 129.48 1wim n PRO 91 Ca -0.22 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 1wim n PRO 91 Cb 0.63 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 1wim n PRO 91 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1wim n SER 92 N -1.24 1.04 -4.69 3.54 2.88 -1.26 -5.04 113.62 108.85 1wim n SER 92 Ca 0.08 0.00 -0.40 0.00 -1.33 0.00 0.00 58.87 57.21 1wim n SER 92 Cb 0.11 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.52 1wim n SER 92 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 1wim s SER 93 N -4.54 6.95 0.00 -3.46 0.01 -1.24 -5.28 113.70 106.14 1wim s SER 93 Ca 0.00 1.15 0.17 0.00 1.31 0.00 0.00 55.95 58.58 1wim s SER 93 Cb 0.00 -2.42 0.13 0.00 0.21 0.00 0.00 66.02 63.94 1wim s SER 93 CO 0.00 -0.23 1.04 0.61 0.41 0.00 0.00 173.24 175.07