#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 6.14 -0.14 1.61 0.01 -1.26 -4.96 113.70 115.10 1wim s SER 2 Ca 0.00 2.34 -0.04 0.00 1.31 0.00 0.00 55.95 59.56 1wim s SER 2 Cb 0.00 -2.52 0.06 0.00 0.21 0.00 0.00 66.02 63.77 1wim s SER 2 CO 0.00 -1.35 0.14 -0.94 0.41 0.00 0.00 173.24 171.50 1wim s SER 3 N 5.59 1.56 -0.36 2.44 1.04 -1.26 -5.05 113.70 117.66 1wim s SER 3 Ca 0.90 -0.20 -0.03 0.00 0.48 0.00 0.00 55.95 57.11 1wim s SER 3 Cb -0.38 0.06 0.25 0.00 0.10 0.00 0.00 66.02 66.05 1wim s SER 3 CO 0.38 -0.31 1.14 0.61 0.98 0.00 0.00 173.24 176.04 1wim n GLY 4 N 5.30 -1.54 3.17 7.32 0.00 -1.26 -5.06 105.19 113.13 1wim n GLY 4 Ca -0.06 1.01 0.04 0.00 0.00 0.00 0.00 46.02 47.01 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 0.10 -1.31 0.20 1.61 1.04 -1.26 -3.87 113.70 110.21 1wim s SER 5 Ca 0.26 0.87 0.23 0.00 0.48 0.00 0.00 55.95 57.78 1wim s SER 5 Cb 0.17 2.12 0.05 0.00 0.10 0.00 0.00 66.02 68.46 1wim s SER 5 CO -0.10 -0.25 1.09 -1.28 0.98 0.00 0.00 173.24 173.69 1wim h SER 6 N 8.00 0.00 -3.72 7.02 0.87 -1.85 -3.47 113.55 120.40 1wim h SER 6 Ca -0.22 -0.03 0.25 0.00 -1.23 0.00 0.00 61.79 60.56 1wim h SER 6 Cb 1.16 0.00 -0.13 0.00 -0.44 0.00 0.00 62.40 62.99 1wim h SER 6 CO 0.23 0.01 -0.83 0.61 -0.53 0.00 0.00 176.83 176.32 1wim n GLY 7 N 1.20 -2.98 3.43 5.77 0.00 -1.26 -5.01 105.19 106.34 1wim n GLY 7 Ca 0.01 -1.18 -0.22 0.00 0.00 0.00 0.00 46.02 44.63 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 -0.59 0.94 0.00 0.00 5.02 -1.26 -3.61 118.16 118.66 1wim n LYS 9 Ca -0.06 0.02 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 1wim n LYS 9 Cb 0.63 -1.46 0.00 0.00 -0.02 0.00 0.00 35.03 34.18 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 -2.78 1.36 0.13 -0.35 4.77 -1.26 -4.20 117.00 114.66 1wim n LEU 10 Ca -0.32 0.31 0.12 0.00 -0.03 0.00 0.00 56.01 56.09 1wim n LEU 10 Cb 1.06 -0.23 0.47 0.00 -2.33 0.00 0.00 43.42 42.38 1wim n LEU 10 CO 0.35 -0.23 0.87 0.00 -1.33 0.00 0.00 177.39 177.05 1wim n LEU 12 N -2.29 -2.05 0.00 0.00 4.77 -1.24 -4.96 117.00 111.23 1wim n LEU 12 Ca 0.03 -1.02 0.00 0.00 -0.03 0.00 0.00 56.01 54.99 1wim n LEU 12 Cb 0.30 -2.17 0.00 0.00 -2.33 0.00 0.00 43.42 39.22 1wim n LEU 12 CO 0.24 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.31 1wim n GLY 13 N -1.90 2.79 2.89 -0.72 0.00 -1.26 -4.84 105.19 102.15 1wim n GLY 13 Ca -0.23 -2.06 -0.28 0.00 0.00 0.00 0.00 46.02 43.45 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 1.75 1.44 0.01 1.61 2.12 -1.26 -3.60 118.70 120.77 1wim s GLU 14 Ca 0.00 -0.48 -0.07 0.00 0.36 0.00 0.00 54.97 54.78 1wim s GLU 14 Cb 0.00 -1.95 0.00 0.00 0.26 0.00 0.00 34.13 32.45 1wim s GLU 14 CO 0.00 -0.41 0.14 0.71 -0.54 0.00 0.00 175.26 175.16 1wim s TYR 15 N 1.65 0.05 0.19 5.30 1.51 -1.26 -5.03 117.35 119.75 1wim s TYR 15 Ca 0.01 -0.17 -0.30 0.00 -1.01 0.00 0.00 57.07 55.60 1wim s TYR 15 Cb -0.15 -0.05 -0.09 0.00 -0.11 0.00 0.00 41.96 41.56 1wim s TYR 15 CO -0.08 -0.31 1.31 -1.25 -1.11 0.00 0.00 175.55 174.12 1wim s PRO 16 N -1.56 4.38 0.49 -1.71 0.04 -1.25 -2.81 135.00 132.59 1wim s PRO 16 Ca -0.13 2.04 0.40 0.00 0.04 0.00 0.00 61.00 63.35 1wim s PRO 16 Cb -0.07 -3.21 1.60 0.00 0.04 0.00 0.00 34.50 32.87 1wim s PRO 16 CO 0.01 -0.27 1.58 -0.24 0.04 0.00 0.00 177.00 178.12 1wim h VAL 17 N 3.82 0.00 -0.76 -0.36 3.04 -1.91 0.55 116.25 120.63 1wim h VAL 17 Ca -0.44 -0.00 0.17 0.00 -1.01 0.00 0.00 66.70 65.41 1wim h VAL 17 Cb 1.21 0.00 -0.11 0.00 -2.01 0.00 0.00 31.29 30.38 1wim h VAL 17 CO 0.78 0.00 0.19 -0.33 -1.01 0.00 0.00 177.57 177.20 1wim h GLU 18 N 0.00 0.26 -1.65 4.17 5.08 -1.94 0.11 114.58 120.60 1wim h GLU 18 Ca 0.91 -0.02 -0.65 0.00 -1.00 0.00 0.00 59.36 58.61 1wim h GLU 18 Cb 3.24 -0.06 -0.25 0.00 0.50 0.00 0.00 28.75 32.19 1wim h GLU 18 CO -0.28 0.17 0.83 1.04 -1.00 0.00 0.00 179.01 179.77 1wim n GLN 19 N -5.16 2.57 -4.00 2.33 6.02 0.19 -4.92 117.38 114.41 1wim n GLN 19 Ca 0.15 -3.04 -0.08 0.00 -0.01 0.00 0.00 57.00 54.02 1wim n GLN 19 Cb 0.48 -2.19 -0.09 0.00 1.02 0.00 0.00 30.24 29.46 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 -3.36 0.63 0.05 -1.09 -1.94 0.02 -3.61 119.30 110.01 1wim s MET 20 Ca 0.55 -1.03 0.04 0.00 -1.71 0.00 0.00 55.69 53.54 1wim s MET 20 Cb 0.43 0.24 -0.02 0.00 2.01 0.00 0.00 34.83 37.48 1wim s MET 20 CO -0.22 -0.15 -0.12 0.99 -0.01 0.00 0.00 175.02 175.51 1wim s THR 21 N -3.47 0.93 -0.04 2.05 2.01 -0.97 -4.88 115.64 111.27 1wim s THR 21 Ca 0.03 -1.09 0.06 0.00 0.31 0.00 0.00 61.69 61.00 1wim s THR 21 Cb 0.04 -0.89 -0.02 0.00 0.01 0.00 0.00 72.50 71.64 1wim s THR 21 CO -0.08 -0.17 -0.22 -0.89 -0.69 0.00 0.00 174.62 172.56 1wim s THR 22 N -1.10 2.33 -0.25 -0.82 2.01 -1.26 -1.24 115.64 115.31 1wim s THR 22 Ca -0.03 -0.99 -0.14 0.00 0.31 0.00 0.00 61.69 60.84 1wim s THR 22 Cb -0.09 -1.85 -0.04 0.00 0.01 0.00 0.00 72.50 70.53 1wim s THR 22 CO 0.01 0.58 0.34 -0.63 -0.69 0.00 0.00 174.62 174.23 1wim s ILE 23 N -0.47 5.21 -0.53 1.82 1.01 0.62 -4.94 121.20 123.93 1wim s ILE 23 Ca 0.06 0.51 0.24 0.00 0.00 0.00 0.00 60.65 61.46 1wim s ILE 23 Cb -0.11 -3.67 0.26 0.00 0.01 0.00 0.00 42.46 38.95 1wim s ILE 23 CO 0.01 0.20 1.73 0.00 0.00 0.00 0.00 174.94 176.88 1wim n ALA 24 N 5.04 1.79 0.16 9.38 0.00 -1.26 0.69 120.51 136.31 1wim n ALA 24 Ca -0.10 0.06 -0.13 0.00 0.00 0.00 0.00 53.44 53.27 1wim n ALA 24 Cb 0.51 -1.41 -0.08 0.00 0.00 0.00 0.00 19.45 18.47 1wim n ALA 24 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1wim h GLN 25 N 0.00 -0.40 0.00 0.00 1.08 -1.92 -3.36 115.11 110.51 1wim h GLN 25 Ca 0.00 0.03 -0.05 0.00 -1.45 0.00 0.00 58.65 57.18 1wim h GLN 25 Cb 0.45 0.09 -0.10 0.00 -0.05 0.00 0.00 27.48 27.87 1wim h GLN 25 CO 0.00 -0.09 -0.54 0.00 -0.95 0.00 0.00 178.83 177.25 1wim n GLN 27 N -0.64 -1.21 -3.91 0.00 1.13 0.22 -4.90 117.38 108.07 1wim n GLN 27 Ca 0.13 0.17 -0.35 0.00 -1.94 0.00 0.00 57.00 55.01 1wim n GLN 27 Cb 0.80 -4.50 -0.09 0.00 0.11 0.00 0.00 30.24 26.56 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 0.38 5.27 -0.00 0.00 -1.16 -1.26 -0.28 121.20 124.15 1wim s ILE 29 Ca 0.05 0.14 0.00 0.00 -0.51 0.00 0.00 60.65 60.33 1wim s ILE 29 Cb -0.12 -3.39 0.00 0.00 0.61 0.00 0.00 42.46 39.56 1wim s ILE 29 CO -0.00 0.45 -0.00 -0.36 -2.81 0.00 0.00 174.94 172.22 1wim s PHE 30 N 0.29 0.03 0.18 3.50 0.08 -0.37 -4.60 117.98 117.08 1wim s PHE 30 Ca 0.07 -0.00 -0.31 0.00 0.12 0.00 0.00 56.93 56.81 1wim s PHE 30 Cb -0.11 -0.02 -0.10 0.00 -0.57 0.00 0.00 43.02 42.22 1wim s PHE 30 CO -0.01 -0.00 1.53 0.00 -0.10 0.00 0.00 175.22 176.64 1wim n THR 32 N 3.68 -0.36 -0.18 0.00 -1.04 -1.24 -0.55 114.28 114.59 1wim n THR 32 Ca 0.12 1.51 -0.05 0.00 -2.04 0.00 0.00 64.05 63.60 1wim n THR 32 Cb 0.39 -1.89 -0.04 0.00 -1.82 0.00 0.00 70.33 66.97 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 -4.35 -0.47 0.24 -4.42 4.32 -1.26 0.62 117.00 111.69 1wim n LEU 33 Ca 0.01 1.02 -0.16 0.00 -0.02 0.00 0.00 56.01 56.86 1wim n LEU 33 Cb 0.14 -0.22 -0.09 0.00 -1.62 0.00 0.00 43.42 41.63 1wim n LEU 33 CO -0.08 -0.76 0.52 0.00 -1.22 0.00 0.00 177.39 175.85 1wim h LEU 35 N -0.86 0.12 0.08 0.00 3.38 -0.17 0.29 115.31 118.15 1wim h LEU 35 Ca -0.05 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 1wim h LEU 35 Cb 0.76 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1wim h LEU 35 CO -0.07 -0.01 -0.04 0.50 0.09 0.00 0.00 178.44 178.91 1wim h LYS 36 N 0.09 -0.10 -0.62 1.13 3.64 0.13 -2.73 116.57 118.10 1wim h LYS 36 Ca 0.67 0.01 0.12 0.00 -1.27 0.00 0.00 60.65 60.17 1wim h LYS 36 Cb 2.41 0.02 -0.09 0.00 -0.41 0.00 0.00 32.23 34.16 1wim h LYS 36 CO -0.12 -0.07 0.12 1.96 -2.27 0.00 0.00 179.45 179.07 1wim h GLN 37 N -0.20 0.24 0.00 1.90 4.20 -0.54 0.37 115.11 121.07 1wim h GLN 37 Ca -0.01 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.69 1wim h GLN 37 Cb 0.08 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 27.81 1wim h GLN 37 CO 0.02 0.16 0.00 0.98 -0.67 0.00 0.00 178.83 179.31 1wim n TYR 38 N -5.15 0.00 -0.11 2.96 9.36 0.96 -0.24 117.16 124.95 1wim n TYR 38 Ca 0.09 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.46 1wim n TYR 38 Cb 0.34 -0.42 0.53 0.00 -0.63 0.00 0.00 39.34 39.16 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 0.82 0.99 2.97 -1.51 -1.33 -1.54 116.25 116.65 1wim h VAL 39 Ca 0.00 -0.12 -0.05 0.00 -1.23 0.00 0.00 66.70 65.30 1wim h VAL 39 Cb 0.00 0.45 0.01 0.00 -2.13 0.00 0.00 31.29 29.62 1wim h VAL 39 CO 0.00 0.06 -0.49 -0.33 -1.23 0.00 0.00 177.57 175.58 1wim h GLU 40 N 0.34 -1.30 -0.16 5.19 5.08 0.35 -1.47 114.58 122.61 1wim h GLU 40 Ca 0.32 0.09 0.03 0.00 -1.00 0.00 0.00 59.36 58.79 1wim h GLU 40 Cb 0.77 0.30 -0.03 0.00 0.50 0.00 0.00 28.75 30.29 1wim h GLU 40 CO -0.08 -0.87 -0.02 -0.07 -1.00 0.00 0.00 179.01 176.97 1wim h LEU 41 N -1.35 -0.10 -0.47 1.33 4.07 -0.19 -0.54 115.31 118.05 1wim h LEU 41 Ca -0.14 0.04 0.09 0.00 0.08 0.00 0.00 57.88 57.96 1wim h LEU 41 Cb 1.04 0.08 -0.10 0.00 1.08 0.00 0.00 40.66 42.76 1wim h LEU 41 CO 0.21 -0.03 -0.27 -0.07 -1.08 0.00 0.00 178.44 177.21 1wim h LEU 42 N 0.03 -0.92 -0.46 1.67 3.38 -1.26 -0.24 115.31 117.51 1wim h LEU 42 Ca 0.07 0.19 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 1wim h LEU 42 Cb 0.10 0.47 -0.02 0.00 0.09 0.00 0.00 40.66 41.30 1wim h LEU 42 CO -0.14 -0.28 0.23 0.40 0.09 0.00 0.00 178.44 178.74 1wim h ILE 43 N -0.16 1.18 -0.09 1.22 2.04 -0.96 -1.90 117.51 118.83 1wim h ILE 43 Ca 0.21 -0.50 0.03 0.00 1.00 0.00 0.00 64.86 65.60 1wim h ILE 43 Cb 0.51 0.67 -0.00 0.00 -0.74 0.00 0.00 36.82 37.25 1wim h ILE 43 CO -0.57 0.20 0.16 0.11 0.00 0.00 0.00 178.15 178.04 1wim h LYS 44 N 0.60 0.00 0.00 2.37 1.57 0.24 -3.02 116.57 118.32 1wim h LYS 44 Ca 0.16 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.94 1wim h LYS 44 Cb 0.10 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.41 1wim h LYS 44 CO -0.02 0.00 0.00 -1.91 -0.57 0.00 0.00 179.45 176.95 1wim n GLU 45 N -3.47 0.00 0.00 3.15 4.07 -0.23 -5.00 120.64 119.16 1wim n GLU 45 Ca -0.01 0.49 0.00 0.00 -0.06 0.00 0.00 57.16 57.58 1wim n GLU 45 Cb 0.25 -1.27 0.00 0.00 -0.06 0.00 0.00 31.44 30.36 1wim n GLU 45 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1wim n GLY 46 N 0.29 2.78 0.32 8.31 0.00 -1.14 -4.92 105.19 110.82 1wim n GLY 46 Ca 0.00 -0.82 0.00 0.00 0.00 0.00 0.00 46.02 45.20 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 -0.49 -4.73 0.99 7.94 -1.26 -4.20 117.00 115.26 1wim n LEU 47 Ca 0.00 1.45 -0.41 0.00 -1.11 0.00 0.00 56.01 55.93 1wim n LEU 47 Cb 0.00 -0.36 -0.03 0.00 0.53 0.00 0.00 43.42 43.56 1wim n LEU 47 CO 0.00 -1.32 0.88 -1.61 -1.11 0.00 0.00 177.39 174.22 1wim s GLU 48 N -5.85 4.48 -0.21 1.96 0.41 -1.26 -4.94 118.70 113.29 1wim s GLU 48 Ca -0.12 1.82 0.15 0.00 -0.41 0.00 0.00 54.97 56.41 1wim s GLU 48 Cb 0.18 -3.28 -0.23 0.00 -1.78 0.00 0.00 34.13 29.02 1wim s GLU 48 CO 0.61 -0.13 0.01 2.41 -0.49 0.00 0.00 175.26 177.66 1wim n THR 49 N 2.99 1.41 -3.98 3.63 -1.04 -1.26 -4.89 114.28 111.15 1wim n THR 49 Ca 0.06 -0.80 -0.22 0.00 -2.04 0.00 0.00 64.05 61.05 1wim n THR 49 Cb 0.45 -0.67 -0.05 0.00 -1.82 0.00 0.00 70.33 68.25 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 -2.50 3.65 -0.70 2.41 0.00 -1.26 -4.60 121.76 118.76 1wim s ALA 50 Ca -0.15 -1.68 -0.01 0.00 0.00 0.00 0.00 51.96 50.11 1wim s ALA 50 Cb 0.07 -1.02 0.18 0.00 0.00 0.00 0.00 23.12 22.34 1wim s ALA 50 CO 0.78 0.06 0.53 0.42 0.00 0.00 0.00 175.76 177.55 1wim s ILE 51 N -2.32 3.75 1.11 0.00 -1.09 -1.26 -5.03 121.20 116.35 1wim s ILE 51 Ca 0.38 -3.35 -0.13 0.00 -2.23 0.00 0.00 60.65 55.32 1wim s ILE 51 Cb -0.05 -3.42 0.25 0.00 -1.58 0.00 0.00 42.46 37.66 1wim s ILE 51 CO 0.25 -0.94 1.05 -0.55 -1.23 0.00 0.00 174.94 173.52 1wim s SER 52 N 0.20 1.57 0.25 3.58 0.15 -1.26 -0.66 113.70 117.53 1wim s SER 52 Ca 0.20 1.29 -0.31 0.00 0.70 0.00 0.00 55.95 57.84 1wim s SER 52 Cb -0.16 -2.02 -0.13 0.00 -1.71 0.00 0.00 66.02 62.01 1wim s SER 52 CO -0.07 -3.80 1.48 0.00 1.20 0.00 0.00 173.24 172.05 1wim n PRO 54 N 2.23 0.49 -3.95 0.00 -0.04 -1.26 -4.56 135.00 127.91 1wim n PRO 54 Ca 0.11 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.23 1wim n PRO 54 Cb 0.33 -1.35 -0.14 0.00 -0.04 0.00 0.00 33.50 32.29 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 4.17 0.00 3.54 2.15 -1.26 -4.97 116.67 118.45 1wim s ASP 55 Ca 0.16 -0.61 0.10 0.00 0.43 0.00 0.00 52.55 52.64 1wim s ASP 55 Cb 0.07 -1.68 0.62 0.00 -0.30 0.00 0.00 42.92 41.63 1wim s ASP 55 CO 0.13 -0.06 1.28 0.00 -0.17 0.00 0.00 175.17 176.35 1wim n ALA 56 N 4.73 2.42 -1.22 3.66 0.00 -1.26 -2.81 120.51 126.03 1wim n ALA 56 Ca -0.18 -0.06 0.07 0.00 0.00 0.00 0.00 53.44 53.27 1wim n ALA 56 Cb 0.49 -1.17 0.19 0.00 0.00 0.00 0.00 19.45 18.96 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 -0.69 2.98 -2.61 0.00 0.00 -1.26 -4.99 120.51 113.95 1wim n ALA 57 Ca 0.08 -2.78 -0.39 0.00 0.00 0.00 0.00 53.44 50.35 1wim n ALA 57 Cb 0.04 -0.49 -0.10 0.00 0.00 0.00 0.00 19.45 18.90 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 5.19 0.20 -0.00 0.00 -0.04 -1.26 -2.50 135.00 136.59 1wim n PRO 59 Ca -0.10 0.43 0.05 0.00 -0.04 0.00 0.00 63.50 63.84 1wim n PRO 59 Cb 0.51 -1.89 -0.07 0.00 -0.04 0.00 0.00 33.50 32.02 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 -2.27 2.61 -3.97 0.54 4.81 -1.26 -5.01 118.16 113.61 1wim n LYS 60 Ca 0.02 -0.03 -0.28 0.00 -0.87 0.00 0.00 58.31 57.15 1wim n LYS 60 Cb 0.23 -1.07 -0.05 0.00 0.02 0.00 0.00 35.03 34.16 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 -1.43 -0.79 -2.20 1.64 6.02 -1.04 -4.79 117.38 114.78 1wim n GLN 61 Ca 0.01 0.03 -0.42 0.00 -0.01 0.00 0.00 57.00 56.61 1wim n GLN 61 Cb 0.20 -2.56 -0.03 0.00 1.02 0.00 0.00 30.24 28.87 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 -4.03 1.96 0.73 1.08 0.00 -1.26 -4.08 107.32 101.71 1wim s GLY 62 Ca 0.11 1.02 -0.12 0.00 0.00 0.00 0.00 44.72 45.72 1wim s GLY 62 CO 0.79 2.39 0.83 1.42 0.00 0.00 0.00 173.10 178.53 1wim n HIS 63 N 4.48 -3.83 -3.99 1.90 -0.00 -1.26 -1.96 115.22 110.56 1wim n HIS 63 Ca 0.12 -0.74 -0.36 0.00 -0.00 0.00 0.00 57.72 56.74 1wim n HIS 63 Cb 0.43 -0.72 -0.07 0.00 -0.00 0.00 0.00 29.99 29.63 1wim n HIS 63 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1wim s LEU 64 N 0.00 4.15 0.44 2.41 2.01 0.17 -4.63 118.68 123.24 1wim s LEU 64 Ca 0.49 0.35 -0.24 0.00 0.01 0.00 0.00 54.13 54.74 1wim s LEU 64 Cb -0.03 -2.01 -0.08 0.00 0.01 0.00 0.00 46.19 44.09 1wim s LEU 64 CO 0.36 0.37 1.26 -1.10 1.01 0.00 0.00 176.35 178.25 1wim s GLN 65 N -0.80 3.77 0.25 1.70 -1.52 -1.26 -4.80 119.66 117.00 1wim s GLN 65 Ca 0.13 2.04 -0.04 0.00 -1.95 0.00 0.00 55.36 55.54 1wim s GLN 65 Cb -0.12 -2.56 0.39 0.00 -0.22 0.00 0.00 33.01 30.50 1wim s GLN 65 CO 0.03 -0.62 1.85 1.49 -0.25 0.00 0.00 175.29 177.79 1wim h GLU 66 N 2.28 0.95 -0.37 2.91 4.22 -2.00 -2.07 114.58 120.50 1wim h GLU 66 Ca -0.50 -0.06 0.00 0.00 0.08 0.00 0.00 59.36 58.89 1wim h GLU 66 Cb 1.25 -0.21 -0.02 0.00 0.50 0.00 0.00 28.75 30.27 1wim h GLU 66 CO 0.61 0.63 0.24 -2.95 -2.18 0.00 0.00 179.01 175.36 1wim h ASN 67 N 0.98 0.42 0.04 1.04 -1.07 -2.00 -2.16 115.58 112.83 1wim h ASN 67 Ca 0.41 -0.02 0.03 0.00 0.07 0.00 0.00 56.30 56.79 1wim h ASN 67 Cb 0.25 -0.11 -0.05 0.00 -2.07 0.00 0.00 38.32 36.34 1wim h ASN 67 CO -0.20 0.31 -0.41 -0.33 0.07 0.00 0.00 177.43 176.87 1wim h GLU 68 N 0.50 -0.57 -0.26 4.14 4.39 -1.76 -2.53 114.58 118.49 1wim h GLU 68 Ca 0.13 0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.94 1wim h GLU 68 Cb -0.05 0.13 -0.07 0.00 -0.10 0.00 0.00 28.75 28.66 1wim h GLU 68 CO -0.03 -0.38 -0.18 0.82 -1.16 0.00 0.00 179.01 178.08 1wim h ILE 69 N -0.59 0.50 -0.39 3.13 2.04 -1.38 0.23 117.51 121.05 1wim h ILE 69 Ca 0.04 0.00 0.04 0.00 1.00 0.00 0.00 64.86 65.93 1wim h ILE 69 Cb 0.65 0.50 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 1wim h ILE 69 CO -0.29 0.00 -0.23 1.21 0.00 0.00 0.00 178.15 178.84 1wim n GLU 70 N -5.34 -0.17 -0.04 2.37 4.07 -0.82 -0.02 120.64 120.69 1wim n GLU 70 Ca -0.00 0.98 -0.09 0.00 -0.06 0.00 0.00 57.16 57.98 1wim n GLU 70 Cb 0.25 -1.45 0.06 0.00 -0.06 0.00 0.00 31.44 30.25 1wim n GLU 70 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1wim h MET 72 N 0.54 -0.44 -6.58 0.00 1.85 0.30 -3.43 114.93 107.18 1wim h MET 72 Ca 0.04 0.03 -0.44 0.00 -0.61 0.00 0.00 59.70 58.72 1wim h MET 72 Cb 0.95 0.10 0.03 0.00 0.43 0.00 0.00 31.60 33.11 1wim h MET 72 CO 0.09 -0.29 -0.17 0.14 -0.40 0.00 0.00 176.91 176.27 1wim s VAL 73 N -5.31 2.74 0.27 -5.77 -7.23 0.41 -4.97 120.40 100.54 1wim s VAL 73 Ca -0.13 -0.92 -0.13 0.00 -1.81 0.00 0.00 61.98 58.99 1wim s VAL 73 Cb 0.06 -2.82 -0.08 0.00 0.56 0.00 0.00 36.38 34.10 1wim s VAL 73 CO 0.53 0.00 0.65 0.00 -0.31 0.00 0.00 175.10 175.97 1wim s ALA 74 N -2.52 3.44 0.27 1.32 0.00 -1.26 -4.74 121.76 118.27 1wim s ALA 74 Ca 0.57 -0.08 -0.03 0.00 0.00 0.00 0.00 51.96 52.42 1wim s ALA 74 Cb -0.09 -2.63 0.55 0.00 0.00 0.00 0.00 23.12 20.95 1wim s ALA 74 CO 0.36 0.41 1.43 0.00 0.00 0.00 0.00 175.76 177.95 1wim n ALA 75 N -0.12 0.34 -0.31 0.00 0.00 -1.26 0.14 120.51 119.29 1wim n ALA 75 Ca 0.01 0.99 0.15 0.00 0.00 0.00 0.00 53.44 54.60 1wim n ALA 75 Cb 0.53 -0.66 0.34 0.00 0.00 0.00 0.00 19.45 19.66 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 0.33 0.00 0.00 4.81 -2.00 -1.11 114.58 116.61 1wim h GLU 76 Ca 0.49 -0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.63 1wim h GLU 76 Cb 0.89 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.19 1wim h GLU 76 CO -0.90 0.22 -0.48 0.82 -0.73 0.00 0.00 179.01 177.93 1wim h ILE 77 N 0.34 0.79 -0.84 2.32 1.08 0.79 -3.38 117.51 118.62 1wim h ILE 77 Ca 0.60 -1.74 0.16 0.00 -0.39 0.00 0.00 64.86 63.49 1wim h ILE 77 Cb 1.21 1.65 -0.16 0.00 -3.07 0.00 0.00 36.82 36.45 1wim h ILE 77 CO -0.58 0.27 -0.23 0.80 -0.69 0.00 0.00 178.15 177.72 1wim n MET 78 N -4.59 -0.09 -0.28 2.37 1.56 0.47 0.99 117.12 117.55 1wim n MET 78 Ca -0.14 1.30 0.05 0.00 -0.27 0.00 0.00 57.70 58.64 1wim n MET 78 Cb 0.40 -1.94 0.14 0.00 2.15 0.00 0.00 33.22 33.96 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 0.03 -0.66 2.12 4.15 -1.38 0.26 115.11 119.63 1wim h GLN 79 Ca 0.39 -0.00 0.14 0.00 0.77 0.00 0.00 58.65 59.94 1wim h GLN 79 Cb 0.59 -0.01 -0.11 0.00 0.21 0.00 0.00 27.48 28.17 1wim h GLN 79 CO -0.86 0.02 -0.00 0.00 -1.93 0.00 0.00 178.83 176.06 1wim h ARG 80 N 0.03 0.11 -0.33 1.69 3.08 0.45 0.88 114.38 120.29 1wim h ARG 80 Ca 0.42 -0.01 -0.12 0.00 0.07 0.00 0.00 59.98 60.35 1wim h ARG 80 Cb 0.70 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.72 1wim h ARG 80 CO -0.80 0.07 -0.25 -0.92 -1.07 0.00 0.00 179.97 177.00 1wim h TYR 81 N 0.11 0.89 -0.26 3.04 3.20 -0.58 -2.51 116.97 120.86 1wim h TYR 81 Ca 0.35 -0.25 0.05 0.00 3.14 0.00 0.00 58.73 62.02 1wim h TYR 81 Cb 0.58 -0.19 -0.05 0.00 1.54 0.00 0.00 36.73 38.60 1wim h TYR 81 CO -0.39 1.00 -0.06 0.87 -1.64 0.00 0.00 178.16 177.94 1wim h LYS 82 N 0.53 0.01 -0.76 1.82 1.57 0.59 -1.77 116.57 118.55 1wim h LYS 82 Ca 0.06 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 1wim h LYS 82 Cb 0.82 -0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.09 1wim h LYS 82 CO 0.07 0.00 0.40 1.57 -0.57 0.00 0.00 179.45 180.92 1wim h LYS 83 N 0.01 1.07 -0.23 3.15 2.10 -0.90 -2.80 116.57 118.97 1wim h LYS 83 Ca 0.13 -0.13 0.05 0.00 -2.00 0.00 0.00 60.65 58.70 1wim h LYS 83 Cb 0.19 -0.21 -0.05 0.00 -0.90 0.00 0.00 32.23 31.26 1wim h LYS 83 CO -0.27 0.81 -0.12 -0.07 -2.00 0.00 0.00 179.45 177.80 1wim h LEU 84 N 1.06 -0.40 -0.14 7.07 3.38 -0.91 -2.41 115.31 122.96 1wim h LEU 84 Ca 0.27 0.09 0.04 0.00 0.09 0.00 0.00 57.88 58.37 1wim h LEU 84 Cb 0.06 0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 1wim h LEU 84 CO -0.04 -0.15 -0.15 1.56 0.09 0.00 0.00 178.44 179.75 1wim h GLN 85 N -0.09 -0.17 -0.59 1.13 4.20 -1.14 -2.66 115.11 115.78 1wim h GLN 85 Ca 0.13 0.01 0.10 0.00 0.06 0.00 0.00 58.65 58.94 1wim h GLN 85 Cb 0.28 0.04 -0.11 0.00 0.30 0.00 0.00 27.48 27.99 1wim h GLN 85 CO -0.29 -0.11 -0.39 0.35 -0.67 0.00 0.00 178.83 177.71 1wim h PHE 86 N -0.18 -1.14 -0.98 2.96 3.57 -1.19 0.83 116.94 120.81 1wim h PHE 86 Ca 0.10 0.08 0.27 0.00 3.53 0.00 0.00 57.97 61.95 1wim h PHE 86 Cb 0.32 0.58 -0.18 0.00 2.79 0.00 0.00 35.95 39.46 1wim h PHE 86 CO -0.27 -0.41 0.03 0.93 -2.23 0.00 0.00 178.31 176.36 1wim h GLU 87 N -0.20 0.01 -3.01 1.11 5.08 -1.10 -2.97 114.58 113.51 1wim h GLU 87 Ca 0.20 -0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.95 1wim h GLU 87 Cb 0.56 -0.00 -0.41 0.00 0.50 0.00 0.00 28.75 29.40 1wim h GLU 87 CO -0.69 0.01 -0.67 1.03 -1.00 0.00 0.00 179.01 177.68 1wim s ARG 88 N -6.01 1.92 -0.24 2.33 0.52 0.26 -5.06 118.95 112.67 1wim s ARG 88 Ca -0.13 -2.77 -0.27 0.00 -0.52 0.00 0.00 55.73 52.04 1wim s ARG 88 Cb 0.29 -2.90 0.13 0.00 0.52 0.00 0.00 34.95 32.99 1wim s ARG 88 CO 0.78 -1.24 1.07 0.45 0.02 0.00 0.00 175.30 176.37 1wim s SER 89 N -0.67 -0.38 0.00 0.23 0.15 -1.06 -4.82 113.70 107.15 1wim s SER 89 Ca 0.23 0.63 0.00 0.00 0.70 0.00 0.00 55.95 57.51 1wim s SER 89 Cb -0.11 0.60 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 1wim s SER 89 CO -0.11 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.74 1wim n GLY 90 N 1.63 0.32 3.57 9.45 0.00 -1.26 -4.94 105.19 113.96 1wim n GLY 90 Ca -0.11 -2.04 -0.27 0.00 0.00 0.00 0.00 46.02 43.59 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 -0.15 2.52 -0.15 1.61 0.04 -1.26 -4.73 135.00 132.88 1wim s PRO 91 Ca 0.00 -0.70 -0.13 0.00 0.04 0.00 0.00 61.00 60.21 1wim s PRO 91 Cb 0.00 -5.15 -0.10 0.00 0.04 0.00 0.00 34.50 29.29 1wim s PRO 91 CO 0.00 -3.67 0.13 1.03 0.04 0.00 0.00 177.00 174.53 1wim h SER 92 N 10.57 0.00 0.11 6.66 0.87 -2.02 -3.39 113.55 126.35 1wim h SER 92 Ca 0.15 -0.29 0.01 0.00 -1.23 0.00 0.00 61.79 60.43 1wim h SER 92 Cb 0.97 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.89 1wim h SER 92 CO 1.22 0.90 -0.51 -1.28 -0.53 0.00 0.00 176.83 176.62 1wim h SER 93 N -1.00 -1.54 0.00 6.23 0.87 -2.05 -3.55 113.55 112.52 1wim h SER 93 Ca -0.08 0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1wim h SER 93 Cb 0.64 0.57 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 1wim h SER 93 CO -0.05 -0.54 0.00 0.61 -0.53 0.00 0.00 176.83 176.33