#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wim h SER 2 N 0.00 -0.86 -7.18 1.61 0.02 -2.08 -3.45 113.55 101.60 1wim h SER 2 Ca 0.00 0.02 -0.63 0.00 -0.84 0.00 0.00 61.79 60.35 1wim h SER 2 Cb 0.00 0.22 -0.36 0.00 0.14 0.00 0.00 62.40 62.41 1wim h SER 2 CO 0.00 -0.60 -0.92 -0.24 -1.14 0.00 0.00 176.83 173.93 1wim n SER 3 N -5.52 -1.41 0.00 3.07 2.88 -1.26 -4.76 113.62 106.63 1wim n SER 3 Ca -0.14 -1.25 0.00 0.00 -1.33 0.00 0.00 58.87 56.15 1wim n SER 3 Cb 0.41 -1.62 0.00 0.00 -0.75 0.00 0.00 64.21 62.25 1wim n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wim n GLY 4 N -1.31 4.11 3.83 0.46 0.00 -1.26 -5.10 105.19 105.92 1wim n GLY 4 Ca 0.05 -0.41 -0.37 0.00 0.00 0.00 0.00 46.02 45.29 1wim n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wim s SER 5 N 1.31 6.94 -0.06 1.61 0.15 -1.26 -3.99 113.70 118.40 1wim s SER 5 Ca 0.00 1.19 0.18 0.00 0.70 0.00 0.00 55.95 58.02 1wim s SER 5 Cb 0.00 -2.33 -0.28 0.00 -1.71 0.00 0.00 66.02 61.70 1wim s SER 5 CO 0.00 0.15 0.33 -1.54 1.20 0.00 0.00 173.24 173.38 1wim n SER 6 N 1.12 0.63 -1.04 5.45 3.41 -1.23 -5.02 113.62 116.94 1wim n SER 6 Ca -0.07 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.54 1wim n SER 6 Cb 0.51 1.63 0.00 0.00 -0.26 0.00 0.00 64.21 66.10 1wim n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wim n GLY 7 N 1.54 -3.68 3.74 5.00 0.00 -1.26 -5.01 105.19 105.52 1wim n GLY 7 Ca -0.10 -0.99 -0.23 0.00 0.00 0.00 0.00 46.02 44.70 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 -1.14 0.68 0.00 0.00 4.01 -1.26 -3.57 118.16 116.87 1wim n LYS 9 Ca -0.04 0.10 0.00 0.00 -0.51 0.00 0.00 58.31 57.87 1wim n LYS 9 Cb 0.61 -1.48 0.00 0.00 -0.51 0.00 0.00 35.03 33.65 1wim n LYS 9 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57 1wim n LEU 10 N -3.09 0.60 0.22 -0.35 4.77 -1.26 -4.12 117.00 113.78 1wim n LEU 10 Ca -0.40 0.52 0.10 0.00 -0.03 0.00 0.00 56.01 56.20 1wim n LEU 10 Cb 0.99 -0.35 0.48 0.00 -2.33 0.00 0.00 43.42 42.20 1wim n LEU 10 CO 0.28 -0.35 0.81 0.00 -1.33 0.00 0.00 177.39 176.80 1wim n LEU 12 N -3.41 -3.61 0.00 0.00 4.77 -1.23 -5.00 117.00 108.51 1wim n LEU 12 Ca -0.00 -0.67 0.00 0.00 -0.03 0.00 0.00 56.01 55.31 1wim n LEU 12 Cb 0.42 -2.95 0.00 0.00 -2.33 0.00 0.00 43.42 38.55 1wim n LEU 12 CO 0.33 0.43 0.00 0.61 -1.33 0.00 0.00 177.39 177.43 1wim n GLY 13 N -1.41 3.17 2.89 -0.72 0.00 -1.26 -4.83 105.19 103.03 1wim n GLY 13 Ca -0.23 -1.84 -0.15 0.00 0.00 0.00 0.00 46.02 43.80 1wim n GLY 13 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wim s GLU 14 N 3.46 0.19 0.03 1.61 8.01 -1.26 -3.50 118.70 127.24 1wim s GLU 14 Ca 0.00 0.50 -0.01 0.00 0.01 0.00 0.00 54.97 55.47 1wim s GLU 14 Cb 0.00 -0.57 -0.03 0.00 -4.31 0.00 0.00 34.13 29.23 1wim s GLU 14 CO 0.00 -0.48 -0.02 0.71 0.01 0.00 0.00 175.26 175.48 1wim s TYR 15 N 2.40 0.33 0.42 1.61 1.51 -1.26 -5.01 117.35 117.35 1wim s TYR 15 Ca 0.05 -0.69 -0.24 0.00 -1.01 0.00 0.00 57.07 55.18 1wim s TYR 15 Cb -0.14 -0.25 -0.08 0.00 -0.11 0.00 0.00 41.96 41.38 1wim s TYR 15 CO -0.11 -0.27 1.18 -1.25 -1.11 0.00 0.00 175.55 173.99 1wim s PRO 16 N -2.33 3.94 0.65 -1.71 0.04 -1.26 -3.50 135.00 130.83 1wim s PRO 16 Ca -0.08 1.85 0.17 0.00 0.04 0.00 0.00 61.00 62.97 1wim s PRO 16 Cb -0.04 -2.59 0.90 0.00 0.04 0.00 0.00 34.50 32.81 1wim s PRO 16 CO -0.04 -0.42 1.50 -0.39 0.04 0.00 0.00 177.00 177.69 1wim h VAL 17 N 2.18 0.00 -0.50 -0.36 -1.51 -1.96 0.52 116.25 114.63 1wim h VAL 17 Ca -0.49 0.00 -0.12 0.00 -1.23 0.00 0.00 66.70 64.86 1wim h VAL 17 Cb 1.24 0.37 -0.02 0.00 -2.13 0.00 0.00 31.29 30.75 1wim h VAL 17 CO 0.62 0.00 -0.17 -0.33 -1.23 0.00 0.00 177.57 176.46 1wim h GLU 18 N 0.00 0.98 -1.22 5.19 4.39 -1.94 -3.02 114.58 118.96 1wim h GLU 18 Ca 0.00 -0.39 -0.62 0.00 0.34 0.00 0.00 59.36 58.70 1wim h GLU 18 Cb 1.24 -0.05 -0.26 0.00 -0.10 0.00 0.00 28.75 29.59 1wim h GLU 18 CO 0.00 1.06 0.80 1.04 -1.16 0.00 0.00 179.01 180.74 1wim n GLN 19 N -4.13 2.52 -4.13 2.33 6.02 0.18 -4.93 117.38 115.25 1wim n GLN 19 Ca 0.01 -2.96 -0.09 0.00 -0.01 0.00 0.00 57.00 53.95 1wim n GLN 19 Cb 0.43 -2.16 -0.10 0.00 1.02 0.00 0.00 30.24 29.43 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 -3.41 0.80 -0.06 -1.09 -1.94 -1.14 -3.18 119.30 109.28 1wim s MET 20 Ca 0.57 -1.35 0.00 0.00 -1.71 0.00 0.00 55.69 53.21 1wim s MET 20 Cb 0.45 0.17 0.02 0.00 2.01 0.00 0.00 34.83 37.48 1wim s MET 20 CO -0.05 -0.18 -0.04 0.99 -0.01 0.00 0.00 175.02 175.73 1wim s THR 21 N -3.95 0.60 -0.11 2.05 2.01 -0.43 -4.82 115.64 110.98 1wim s THR 21 Ca 0.16 -0.11 -0.09 0.00 0.31 0.00 0.00 61.69 61.96 1wim s THR 21 Cb 0.07 -0.64 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 1wim s THR 21 CO -0.03 0.26 0.19 -0.89 -0.69 0.00 0.00 174.62 173.46 1wim s THR 22 N 1.20 5.40 -0.19 -0.82 2.01 -1.26 -2.04 115.64 119.94 1wim s THR 22 Ca -0.06 0.33 -0.15 0.00 0.31 0.00 0.00 61.69 62.12 1wim s THR 22 Cb -0.14 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 1wim s THR 22 CO -0.02 0.57 0.35 -0.63 -0.69 0.00 0.00 174.62 174.21 1wim s ILE 23 N -0.76 5.24 -0.44 1.82 1.01 0.16 -4.95 121.20 123.28 1wim s ILE 23 Ca 0.16 0.63 0.01 0.00 0.00 0.00 0.00 60.65 61.45 1wim s ILE 23 Cb -0.13 -3.69 0.13 0.00 0.01 0.00 0.00 42.46 38.78 1wim s ILE 23 CO 0.05 0.30 0.96 0.00 0.00 0.00 0.00 174.94 176.24 1wim n ALA 24 N 4.19 2.90 -0.02 9.38 0.00 -1.26 -1.81 120.51 133.89 1wim n ALA 24 Ca -0.10 -0.43 -0.04 0.00 0.00 0.00 0.00 53.44 52.87 1wim n ALA 24 Cb 0.51 -1.05 -0.02 0.00 0.00 0.00 0.00 19.45 18.89 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 0.17 0.11 -1.18 0.00 1.13 -1.26 -4.83 117.38 111.53 1wim n GLN 25 Ca 0.08 0.04 0.05 0.00 -1.94 0.00 0.00 57.00 55.22 1wim n GLN 25 Cb 0.57 -0.89 0.08 0.00 0.11 0.00 0.00 30.24 30.11 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 -0.06 -0.90 -4.45 0.00 1.13 -0.75 -4.89 117.38 107.46 1wim n GLN 27 Ca 0.10 0.09 -0.34 0.00 -1.94 0.00 0.00 57.00 54.91 1wim n GLN 27 Cb 0.99 -3.28 -0.12 0.00 0.11 0.00 0.00 30.24 27.94 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 0.12 3.82 -0.07 0.00 2.07 -1.26 -0.66 121.20 125.22 1wim s ILE 29 Ca -0.01 -0.67 -0.18 0.00 -1.41 0.00 0.00 60.65 58.38 1wim s ILE 29 Cb -0.14 -2.66 0.04 0.00 0.13 0.00 0.00 42.46 39.83 1wim s ILE 29 CO 0.03 0.42 0.42 -0.36 -1.91 0.00 0.00 174.94 173.55 1wim s PHE 30 N -0.99 -0.37 0.03 3.50 0.08 -0.87 -4.76 117.98 114.60 1wim s PHE 30 Ca 0.17 0.72 -0.30 0.00 0.12 0.00 0.00 56.93 57.63 1wim s PHE 30 Cb -0.11 0.18 -0.07 0.00 -0.57 0.00 0.00 43.02 42.45 1wim s PHE 30 CO 0.07 -0.39 1.57 0.00 -0.10 0.00 0.00 175.22 176.37 1wim n THR 32 N 4.78 -0.26 -0.04 0.00 -1.04 -1.19 -0.52 114.28 116.01 1wim n THR 32 Ca 0.15 1.40 -0.02 0.00 -2.04 0.00 0.00 64.05 63.54 1wim n THR 32 Cb 0.42 -1.98 -0.01 0.00 -1.82 0.00 0.00 70.33 66.94 1wim n THR 32 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1wim h LEU 33 N 0.00 -0.27 0.04 -4.42 3.38 -1.89 0.44 115.31 112.59 1wim h LEU 33 Ca 0.33 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.35 1wim h LEU 33 Cb 0.60 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.45 1wim h LEU 33 CO -0.61 -0.04 -0.15 0.00 0.09 0.00 0.00 178.44 177.72 1wim n LEU 35 N -3.31 0.04 0.29 0.00 4.77 -1.06 0.18 117.00 117.91 1wim n LEU 35 Ca -0.03 1.54 -0.17 0.00 -0.03 0.00 0.00 56.01 57.32 1wim n LEU 35 Cb 0.12 -0.63 -0.08 0.00 -2.33 0.00 0.00 43.42 40.50 1wim n LEU 35 CO 0.05 -1.61 0.63 0.50 -1.33 0.00 0.00 177.39 175.62 1wim h LYS 36 N 0.00 -0.79 -0.05 3.23 3.64 0.67 0.82 116.57 124.08 1wim h LYS 36 Ca 0.63 0.05 -0.03 0.00 -1.27 0.00 0.00 60.65 60.03 1wim h LYS 36 Cb 1.46 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 33.45 1wim h LYS 36 CO -0.80 -0.53 -0.13 1.96 -2.27 0.00 0.00 179.45 177.68 1wim h GLN 37 N -0.82 0.08 0.30 1.90 7.50 0.46 -0.54 115.11 123.98 1wim h GLN 37 Ca -0.05 -0.01 -0.01 0.00 0.50 0.00 0.00 58.65 59.07 1wim h GLN 37 Cb 0.69 -0.01 0.00 0.00 0.05 0.00 0.00 27.48 28.21 1wim h GLN 37 CO 0.02 0.21 -0.14 -0.92 -1.50 0.00 0.00 178.83 176.50 1wim h TYR 38 N 0.08 -0.37 -0.06 2.96 3.20 0.23 0.17 116.97 123.18 1wim h TYR 38 Ca 0.02 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 61.89 1wim h TYR 38 Cb 0.28 0.12 -0.00 0.00 1.54 0.00 0.00 36.73 38.67 1wim h TYR 38 CO 0.00 -0.23 0.07 -0.39 -1.64 0.00 0.00 178.16 175.97 1wim h VAL 39 N -0.56 0.52 0.28 1.81 -1.51 -0.85 -2.09 116.25 113.85 1wim h VAL 39 Ca -0.04 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.41 1wim h VAL 39 Cb 0.31 0.94 0.00 0.00 -2.13 0.00 0.00 31.29 30.42 1wim h VAL 39 CO 0.07 0.00 -0.14 -0.33 -1.23 0.00 0.00 177.57 175.94 1wim h GLU 40 N 0.00 -0.37 -0.82 5.19 5.08 -1.07 -2.69 114.58 119.91 1wim h GLU 40 Ca 0.03 0.03 0.18 0.00 -1.00 0.00 0.00 59.36 58.59 1wim h GLU 40 Cb 0.17 0.08 -0.11 0.00 0.50 0.00 0.00 28.75 29.39 1wim h GLU 40 CO -0.00 -0.25 0.33 -0.07 -1.00 0.00 0.00 179.01 178.03 1wim h LEU 41 N -1.02 0.29 0.80 1.33 -0.00 -0.75 0.49 115.31 116.44 1wim h LEU 41 Ca -0.04 0.13 -0.04 0.00 -0.00 0.00 0.00 57.88 57.93 1wim h LEU 41 Cb 0.29 0.11 0.00 0.00 -0.00 0.00 0.00 40.66 41.07 1wim h LEU 41 CO 0.06 0.06 -0.45 -0.07 -0.00 0.00 0.00 178.44 178.04 1wim h LEU 42 N 0.42 -1.10 -0.80 1.67 3.38 -1.48 -1.99 115.31 115.41 1wim h LEU 42 Ca 0.48 0.05 0.14 0.00 0.09 0.00 0.00 57.88 58.64 1wim h LEU 42 Cb 0.81 0.31 -0.09 0.00 0.09 0.00 0.00 40.66 41.78 1wim h LEU 42 CO -0.47 -0.71 0.37 0.40 0.09 0.00 0.00 178.44 178.12 1wim h ILE 43 N -1.15 0.69 -0.98 1.22 2.04 -1.06 0.06 117.51 118.33 1wim h ILE 43 Ca -0.11 -0.18 0.11 0.00 1.00 0.00 0.00 64.86 65.68 1wim h ILE 43 Cb 0.91 0.12 -0.08 0.00 -0.74 0.00 0.00 36.82 37.02 1wim h ILE 43 CO 0.14 0.10 0.61 0.11 0.00 0.00 0.00 178.15 179.11 1wim h LYS 44 N 0.53 0.97 0.06 2.37 1.57 -0.72 -3.04 116.57 118.30 1wim h LYS 44 Ca 0.44 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 59.16 1wim h LYS 44 Cb 0.64 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.73 1wim h LYS 44 CO -0.38 0.64 -0.05 1.49 -0.57 0.00 0.00 179.45 180.58 1wim h GLU 45 N 1.00 -0.10 0.00 3.15 4.57 -0.21 -3.47 114.58 119.52 1wim h GLU 45 Ca 0.47 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.66 1wim h GLU 45 Cb 0.42 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.03 1wim h GLU 45 CO -0.25 -0.07 0.00 0.41 -1.18 0.00 0.00 179.01 177.92 1wim n GLY 46 N -1.06 1.99 0.29 1.92 0.00 -1.15 -4.97 105.19 102.21 1wim n GLY 46 Ca -0.01 -0.43 -0.10 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.83 -9.13 0.99 6.46 -1.90 -3.40 115.31 107.50 1wim h LEU 47 Ca 0.00 0.07 -0.60 0.00 -0.12 0.00 0.00 57.88 57.23 1wim h LEU 47 Cb 0.00 0.28 -0.11 0.00 -0.73 0.00 0.00 40.66 40.11 1wim h LEU 47 CO 0.00 -0.37 -0.06 -0.70 -0.62 0.00 0.00 178.44 176.69 1wim s GLU 48 N -4.61 4.19 -0.07 1.25 2.12 -1.26 -4.95 118.70 115.37 1wim s GLU 48 Ca -0.10 0.39 0.08 0.00 0.36 0.00 0.00 54.97 55.70 1wim s GLU 48 Cb 0.03 -3.55 -0.24 0.00 0.26 0.00 0.00 34.13 30.62 1wim s GLU 48 CO 0.34 -0.12 0.56 -2.37 -0.54 0.00 0.00 175.26 173.13 1wim n THR 49 N 4.49 1.64 -2.66 -1.70 5.66 -1.26 -4.65 114.28 115.79 1wim n THR 49 Ca -0.05 -0.77 -0.41 0.00 -3.05 0.00 0.00 64.05 59.77 1wim n THR 49 Cb 0.51 -1.17 -0.04 0.00 -1.55 0.00 0.00 70.33 68.07 1wim n THR 49 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1wim s ALA 50 N -2.58 3.28 -1.12 1.79 0.00 -1.26 -4.89 121.76 116.98 1wim s ALA 50 Ca -0.09 0.65 -0.11 0.00 0.00 0.00 0.00 51.96 52.41 1wim s ALA 50 Cb 0.08 -3.31 0.24 0.00 0.00 0.00 0.00 23.12 20.13 1wim s ALA 50 CO 0.81 -0.10 1.18 0.42 0.00 0.00 0.00 175.76 178.08 1wim s ILE 51 N 0.00 5.68 1.37 0.00 -1.09 -1.26 -5.04 121.20 120.86 1wim s ILE 51 Ca 0.48 -3.10 -0.21 0.00 -2.23 0.00 0.00 60.65 55.59 1wim s ILE 51 Cb -0.25 -4.69 0.35 0.00 -1.58 0.00 0.00 42.46 36.29 1wim s ILE 51 CO 0.31 -1.31 0.95 -0.55 -1.23 0.00 0.00 174.94 173.12 1wim s SER 52 N 1.85 -0.63 0.26 3.58 0.15 -1.26 -1.07 113.70 116.58 1wim s SER 52 Ca 0.33 0.99 -0.30 0.00 0.70 0.00 0.00 55.95 57.68 1wim s SER 52 Cb -0.08 -1.45 -0.11 0.00 -1.71 0.00 0.00 66.02 62.67 1wim s SER 52 CO -0.06 -5.12 1.51 0.00 1.20 0.00 0.00 173.24 170.78 1wim n PRO 54 N 2.34 0.49 -4.02 0.00 -0.04 -1.26 -4.42 135.00 128.08 1wim n PRO 54 Ca 0.08 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.22 1wim n PRO 54 Cb 0.39 -1.36 -0.15 0.00 -0.04 0.00 0.00 33.50 32.34 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 -1.86 4.46 0.27 3.54 2.15 -1.26 -4.96 116.67 119.01 1wim s ASP 55 Ca 0.17 -1.62 -0.04 0.00 0.43 0.00 0.00 52.55 51.49 1wim s ASP 55 Cb 0.08 -1.50 0.34 0.00 -0.30 0.00 0.00 42.92 41.54 1wim s ASP 55 CO 0.13 -0.26 1.94 0.00 -0.17 0.00 0.00 175.17 176.81 1wim h ALA 56 N 7.76 1.33 -0.81 3.66 0.00 -2.02 -2.01 119.26 127.17 1wim h ALA 56 Ca -0.14 -0.07 0.15 0.00 0.00 0.00 0.00 54.91 54.84 1wim h ALA 56 Cb 1.04 -0.37 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 1wim h ALA 56 CO 0.47 0.61 0.53 0.00 0.00 0.00 0.00 179.25 180.87 1wim h ALA 57 N 1.41 2.00 -1.06 0.00 0.00 -1.96 -3.42 119.26 116.23 1wim h ALA 57 Ca 0.33 0.01 -0.79 0.00 0.00 0.00 0.00 54.91 54.45 1wim h ALA 57 Cb -0.12 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1wim h ALA 57 CO -0.07 -0.22 0.93 0.00 0.00 0.00 0.00 179.25 179.89 1wim h PRO 59 N 7.11 0.00 0.04 0.00 0.13 -1.89 -3.09 132.00 134.30 1wim h PRO 59 Ca -0.38 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.39 1wim h PRO 59 Cb 1.35 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.43 1wim h PRO 59 CO 0.99 0.00 -2.17 1.17 -0.23 0.00 0.00 178.00 177.77 1wim n LYS 60 N -2.98 0.69 -3.69 0.86 4.81 -1.26 -5.01 118.16 111.58 1wim n LYS 60 Ca 0.01 0.18 -0.23 0.00 -0.87 0.00 0.00 58.31 57.40 1wim n LYS 60 Cb 0.29 -1.63 0.04 0.00 0.02 0.00 0.00 35.03 33.75 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 -3.20 -5.57 -0.41 1.64 6.02 -1.17 -4.95 117.38 109.75 1wim n GLN 61 Ca -0.34 0.67 -0.29 0.00 -0.01 0.00 0.00 57.00 57.04 1wim n GLN 61 Cb 1.05 -5.41 0.27 0.00 1.02 0.00 0.00 30.24 27.17 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 -1.56 -2.61 3.79 1.08 0.00 -1.26 -4.26 105.19 100.36 1wim n GLY 62 Ca -0.21 -1.32 -0.22 0.00 0.00 0.00 0.00 46.02 44.27 1wim n GLY 62 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1wim s HIS 63 N -2.31 2.81 -0.34 1.61 2.46 -1.26 0.26 115.29 118.52 1wim s HIS 63 Ca 0.68 -0.33 -0.16 0.00 0.47 0.00 0.00 55.06 55.72 1wim s HIS 63 Cb -0.22 -1.69 -0.01 0.00 -0.13 0.00 0.00 32.58 30.53 1wim s HIS 63 CO 0.64 0.29 0.39 -0.51 -2.47 0.00 0.00 174.74 173.07 1wim s LEU 64 N -3.91 4.39 0.55 8.88 2.01 -0.23 -4.65 118.68 125.72 1wim s LEU 64 Ca 0.39 -0.16 -0.20 0.00 0.01 0.00 0.00 54.13 54.16 1wim s LEU 64 Cb -0.04 -2.38 -0.06 0.00 0.01 0.00 0.00 46.19 43.71 1wim s LEU 64 CO 0.24 -0.35 0.99 0.00 1.01 0.00 0.00 176.35 178.24 1wim n GLN 65 N 5.44 1.07 0.03 1.70 1.13 -1.26 -4.78 117.38 120.70 1wim n GLN 65 Ca -0.08 0.40 -0.11 0.00 -1.94 0.00 0.00 57.00 55.27 1wim n GLN 65 Cb 0.49 -2.15 -0.04 0.00 0.11 0.00 0.00 30.24 28.65 1wim n GLN 65 CO 0.00 0.00 0.00 1.49 -1.44 0.00 0.00 177.06 177.11 1wim h GLU 66 N 0.82 -0.37 -0.97 -1.09 4.22 -2.00 -1.82 114.58 113.37 1wim h GLU 66 Ca -0.48 0.03 0.28 0.00 0.08 0.00 0.00 59.36 59.27 1wim h GLU 66 Cb 1.35 0.09 -0.18 0.00 0.50 0.00 0.00 28.75 30.51 1wim h GLU 66 CO 0.53 -0.25 0.10 -2.95 -2.18 0.00 0.00 179.01 174.25 1wim h ASN 67 N -0.39 -0.36 0.35 1.04 -1.07 -2.00 0.21 115.58 113.36 1wim h ASN 67 Ca 0.08 0.27 -0.00 0.00 0.07 0.00 0.00 56.30 56.72 1wim h ASN 67 Cb 0.51 0.44 -0.03 0.00 -2.07 0.00 0.00 38.32 37.17 1wim h ASN 67 CO -0.28 -0.34 -0.39 -0.33 0.07 0.00 0.00 177.43 176.16 1wim h GLU 68 N 0.03 -0.74 -0.32 4.14 4.39 -1.68 -2.85 114.58 117.55 1wim h GLU 68 Ca 0.61 0.05 0.03 0.00 0.34 0.00 0.00 59.36 60.39 1wim h GLU 68 Cb 1.31 0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 30.10 1wim h GLU 68 CO -0.88 -0.49 0.14 0.82 -1.16 0.00 0.00 179.01 177.44 1wim h ILE 69 N -0.77 0.96 -0.73 3.13 2.04 -0.62 0.12 117.51 121.64 1wim h ILE 69 Ca -0.02 -0.10 0.08 0.00 1.00 0.00 0.00 64.86 65.81 1wim h ILE 69 Cb 0.70 0.63 -0.10 0.00 -0.74 0.00 0.00 36.82 37.32 1wim h ILE 69 CO -0.09 0.06 -0.39 1.21 0.00 0.00 0.00 178.15 178.93 1wim n GLU 70 N -4.98 -0.28 0.01 2.37 2.13 0.38 -0.41 120.64 119.86 1wim n GLU 70 Ca 0.00 1.11 -0.18 0.00 0.66 0.00 0.00 57.16 58.75 1wim n GLU 70 Cb 0.09 -1.63 -0.14 0.00 0.27 0.00 0.00 31.44 30.03 1wim n GLU 70 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wim n MET 72 N -4.29 -0.08 -4.09 0.00 1.56 0.40 -4.45 117.12 106.17 1wim n MET 72 Ca -0.13 1.47 -0.22 0.00 -0.27 0.00 0.00 57.70 58.55 1wim n MET 72 Cb 0.71 -2.25 -0.06 0.00 2.15 0.00 0.00 33.22 33.77 1wim n MET 72 CO 0.00 0.00 0.00 0.14 -0.73 0.00 0.00 175.97 175.38 1wim s VAL 73 N -6.11 3.52 0.83 1.12 -7.23 0.45 -4.86 120.40 108.12 1wim s VAL 73 Ca -0.14 -1.62 -0.09 0.00 -1.81 0.00 0.00 61.98 58.32 1wim s VAL 73 Cb 0.27 -3.08 0.14 0.00 0.56 0.00 0.00 36.38 34.27 1wim s VAL 73 CO 0.75 -0.26 1.15 0.00 -0.31 0.00 0.00 175.10 176.43 1wim s ALA 74 N -2.32 2.89 0.09 1.32 0.00 -1.26 -4.75 121.76 117.73 1wim s ALA 74 Ca 0.36 -1.28 -0.30 0.00 0.00 0.00 0.00 51.96 50.75 1wim s ALA 74 Cb -0.05 -2.52 -0.14 0.00 0.00 0.00 0.00 23.12 20.42 1wim s ALA 74 CO 0.23 -1.87 1.64 0.00 0.00 0.00 0.00 175.76 175.76 1wim h ALA 75 N -1.06 -0.63 -1.11 0.00 0.00 -1.97 0.22 119.26 114.71 1wim h ALA 75 Ca -0.42 -0.11 0.40 0.00 0.00 0.00 0.00 54.91 54.78 1wim h ALA 75 Cb 1.27 0.38 -0.15 0.00 0.00 0.00 0.00 17.79 19.28 1wim h ALA 75 CO 0.45 -0.88 0.66 1.05 0.00 0.00 0.00 179.25 180.52 1wim h GLU 76 N -0.63 0.12 0.00 0.00 4.11 -2.01 -0.70 114.58 115.46 1wim h GLU 76 Ca -0.03 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.40 1wim h GLU 76 Cb 0.56 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.78 1wim h GLU 76 CO -0.02 0.08 -0.11 0.82 0.07 0.00 0.00 179.01 179.85 1wim h ILE 77 N 0.12 0.00 -0.75 -1.06 1.08 -1.78 -3.37 117.51 111.75 1wim h ILE 77 Ca 0.81 -0.88 0.15 0.00 -0.39 0.00 0.00 64.86 64.54 1wim h ILE 77 Cb 2.20 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 35.81 1wim h ILE 77 CO -0.60 0.00 -0.20 0.80 -0.69 0.00 0.00 178.15 177.46 1wim n MET 78 N -4.43 -0.08 -0.32 2.37 1.56 0.71 0.96 117.12 117.89 1wim n MET 78 Ca -0.02 1.17 0.02 0.00 -0.27 0.00 0.00 57.70 58.61 1wim n MET 78 Cb 0.06 -1.75 0.10 0.00 2.15 0.00 0.00 33.22 33.77 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 -0.01 -0.30 2.12 5.75 -1.32 0.28 115.11 121.63 1wim h GLN 79 Ca 0.35 0.00 0.05 0.00 -0.15 0.00 0.00 58.65 58.91 1wim h GLN 79 Cb 0.54 0.00 -0.05 0.00 1.07 0.00 0.00 27.48 29.04 1wim h GLN 79 CO -0.77 -0.01 -0.02 0.00 -2.65 0.00 0.00 178.83 175.38 1wim h ARG 80 N -0.01 0.06 -0.21 1.69 3.08 0.42 -1.96 114.38 117.45 1wim h ARG 80 Ca 0.40 -0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.50 1wim h ARG 80 Cb 0.64 -0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.62 1wim h ARG 80 CO -0.92 0.04 -0.15 -0.92 -1.07 0.00 0.00 179.97 176.95 1wim h TYR 81 N 0.06 -0.38 -0.91 3.04 3.20 -0.40 -1.38 116.97 120.21 1wim h TYR 81 Ca 0.14 0.03 0.14 0.00 3.14 0.00 0.00 58.73 62.17 1wim h TYR 81 Cb 0.20 0.20 -0.09 0.00 1.54 0.00 0.00 36.73 38.58 1wim h TYR 81 CO -0.24 -0.22 0.52 0.87 -1.64 0.00 0.00 178.16 177.46 1wim h LYS 82 N -0.15 0.76 -0.51 1.82 1.57 -0.80 -0.91 116.57 118.35 1wim h LYS 82 Ca 0.12 -0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.89 1wim h LYS 82 Cb 0.33 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.43 1wim h LYS 82 CO -0.30 0.50 0.29 0.87 -0.57 0.00 0.00 179.45 180.24 1wim h LYS 83 N 0.78 0.55 0.26 3.15 1.79 -0.52 -2.54 116.57 120.04 1wim h LYS 83 Ca 0.48 -0.03 -0.01 0.00 -2.18 0.00 0.00 60.65 58.90 1wim h LYS 83 Cb 0.59 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 31.11 1wim h LYS 83 CO -0.31 0.36 -0.12 -0.07 -1.08 0.00 0.00 179.45 178.23 1wim h LEU 84 N 0.56 -0.29 -0.83 2.94 3.38 -0.65 -0.53 115.31 119.89 1wim h LEU 84 Ca 0.21 -0.11 0.17 0.00 0.09 0.00 0.00 57.88 58.24 1wim h LEU 84 Cb 0.07 0.08 -0.16 0.00 0.09 0.00 0.00 40.66 40.74 1wim h LEU 84 CO -0.12 -0.06 -0.21 1.56 0.09 0.00 0.00 178.44 179.70 1wim h GLN 85 N -0.52 0.00 0.17 1.13 4.20 -1.07 -1.03 115.11 118.00 1wim h GLN 85 Ca -0.04 -0.00 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 1wim h GLN 85 Cb 0.38 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.17 1wim h GLN 85 CO 0.06 0.00 -0.08 0.35 -0.67 0.00 0.00 178.83 178.49 1wim h PHE 86 N 0.00 -0.21 -0.74 2.96 3.57 -1.37 -2.12 116.94 119.03 1wim h PHE 86 Ca 0.40 -0.00 0.23 0.00 3.53 0.00 0.00 57.97 62.13 1wim h PHE 86 Cb 0.60 0.07 -0.14 0.00 2.79 0.00 0.00 35.95 39.28 1wim h PHE 86 CO -0.65 0.16 0.12 0.39 -2.23 0.00 0.00 178.31 176.11 1wim n GLU 87 N -5.01 -0.05 -0.01 1.11 1.02 -0.22 0.77 120.64 118.25 1wim n GLU 87 Ca -0.09 1.08 -0.17 0.00 -0.02 0.00 0.00 57.16 57.97 1wim n GLU 87 Cb 0.24 -1.78 -0.13 0.00 -0.02 0.00 0.00 31.44 29.75 1wim n GLU 87 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wim h ARG 88 N 0.00 0.17 -0.71 3.49 3.08 -1.41 -3.33 114.38 115.66 1wim h ARG 88 Ca 0.50 -0.27 0.20 0.00 0.07 0.00 0.00 59.98 60.48 1wim h ARG 88 Cb 1.14 0.10 -0.13 0.00 0.08 0.00 0.00 29.97 31.15 1wim h ARG 88 CO -0.66 1.11 0.02 0.43 -1.07 0.00 0.00 179.97 179.80 1wim n SER 89 N -4.36 -0.08 -4.31 7.04 7.64 0.23 -4.45 113.62 115.33 1wim n SER 89 Ca -0.12 1.21 -0.33 0.00 1.01 0.00 0.00 58.87 60.65 1wim n SER 89 Cb 0.65 -0.44 0.14 0.00 -1.01 0.00 0.00 64.21 63.54 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 -1.36 -2.42 0.12 0.23 0.00 -0.95 -4.93 105.19 95.88 1wim n GLY 90 Ca 0.17 -0.74 -0.13 0.00 0.00 0.00 0.00 46.02 45.32 1wim n GLY 90 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wim h PRO 91 N -1.74 0.29 -4.25 1.61 0.13 -1.91 -3.44 132.00 122.68 1wim h PRO 91 Ca -0.48 -0.15 -0.42 0.00 -0.87 0.00 0.00 66.00 64.08 1wim h PRO 91 Cb 1.32 0.00 -0.33 0.00 0.13 0.00 0.00 31.00 32.13 1wim h PRO 91 CO 0.35 0.69 -0.78 -1.12 -0.23 0.00 0.00 178.00 176.91 1wim s SER 92 N -6.03 1.10 -0.68 1.44 0.01 -1.26 -5.09 113.70 103.18 1wim s SER 92 Ca -0.14 -0.17 0.05 0.00 1.31 0.00 0.00 55.95 57.00 1wim s SER 92 Cb 0.05 -0.46 0.17 0.00 0.21 0.00 0.00 66.02 65.98 1wim s SER 92 CO 0.74 -0.01 0.47 -0.55 0.41 0.00 0.00 173.24 174.30 1wim s SER 93 N 0.64 4.68 0.00 2.44 0.15 -1.26 -5.09 113.70 115.27 1wim s SER 93 Ca -0.10 -3.75 0.00 0.00 0.70 0.00 0.00 55.95 52.80 1wim s SER 93 Cb -0.13 -1.60 0.00 0.00 -1.71 0.00 0.00 66.02 62.58 1wim s SER 93 CO 0.01 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 174.96