#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 3.80 -0.04 1.61 0.01 -1.26 -5.14 113.70 112.69 1wim s SER 2 Ca 0.00 -0.86 -0.02 0.00 1.31 0.00 0.00 55.95 56.39 1wim s SER 2 Cb 0.00 -0.44 0.03 0.00 0.21 0.00 0.00 66.02 65.82 1wim s SER 2 CO 0.00 0.06 0.05 -0.44 0.41 0.00 0.00 173.24 173.33 1wim s SER 3 N -3.21 1.02 0.00 2.44 0.01 -1.26 -4.88 113.70 107.82 1wim s SER 3 Ca 0.27 0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.60 1wim s SER 3 Cb -0.07 -0.14 0.00 0.00 0.21 0.00 0.00 66.02 66.02 1wim s SER 3 CO 0.14 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.17 1wim n GLY 4 N 5.14 4.65 3.69 3.44 0.00 -1.26 -5.11 105.19 115.75 1wim n GLY 4 Ca -0.07 -0.79 -0.44 0.00 0.00 0.00 0.00 46.02 44.72 1wim n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wim n SER 5 N 0.00 3.42 -0.04 1.61 3.41 -1.26 -3.70 113.62 117.06 1wim n SER 5 Ca 0.00 1.08 0.01 0.00 -0.26 0.00 0.00 58.87 59.71 1wim n SER 5 Cb 0.00 -1.49 -0.16 0.00 -0.26 0.00 0.00 64.21 62.31 1wim n SER 5 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1wim n SER 6 N 3.46 0.08 0.00 4.04 3.41 -1.11 -4.94 113.62 118.57 1wim n SER 6 Ca 0.16 0.04 0.00 0.00 -0.26 0.00 0.00 58.87 58.80 1wim n SER 6 Cb 0.31 1.41 0.00 0.00 -0.26 0.00 0.00 64.21 65.67 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 1.48 -0.62 3.58 5.00 0.00 -1.26 -5.04 105.19 108.33 1wim n GLY 7 Ca -0.17 -1.58 -0.27 0.00 0.00 0.00 0.00 46.02 44.01 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 -0.88 0.56 0.00 0.00 5.02 -1.26 -3.70 118.16 117.90 1wim n LYS 9 Ca -0.05 0.12 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 1wim n LYS 9 Cb 0.65 -1.43 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 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 -3.11 0.86 0.24 -0.35 4.77 -1.26 -4.22 117.00 113.92 1wim n LEU 10 Ca -0.38 0.44 0.14 0.00 -0.03 0.00 0.00 56.01 56.18 1wim n LEU 10 Cb 0.91 -0.31 0.38 0.00 -2.33 0.00 0.00 43.42 42.07 1wim n LEU 10 CO 0.22 -0.31 0.88 0.00 -1.33 0.00 0.00 177.39 176.86 1wim n LEU 12 N -3.05 -3.12 -4.85 0.00 4.77 -1.24 -4.99 117.00 104.52 1wim n LEU 12 Ca 0.03 -0.76 -0.21 0.00 -0.03 0.00 0.00 56.01 55.03 1wim n LEU 12 Cb 0.44 -2.73 -0.04 0.00 -2.33 0.00 0.00 43.42 38.76 1wim n LEU 12 CO 0.31 0.44 -0.03 -0.83 -1.33 0.00 0.00 177.39 175.95 1wim s GLY 13 N -4.04 2.15 -0.27 -0.72 0.00 -1.26 -4.70 107.32 98.48 1wim s GLY 13 Ca 0.20 -1.91 -0.12 0.00 0.00 0.00 0.00 44.72 42.88 1wim s GLY 13 CO 0.80 -1.73 0.26 -0.54 0.00 0.00 0.00 173.10 171.89 1wim s GLU 14 N -4.08 4.00 0.01 2.90 2.02 -1.26 -2.47 118.70 119.82 1wim s GLU 14 Ca 0.46 -0.17 -0.08 0.00 0.02 0.00 0.00 54.97 55.21 1wim s GLU 14 Cb -0.02 -3.63 0.00 0.00 0.10 0.00 0.00 34.13 30.58 1wim s GLU 14 CO 0.27 -0.16 0.16 0.71 0.02 0.00 0.00 175.26 176.25 1wim s TYR 15 N 1.72 0.05 0.16 1.61 1.51 -1.26 -5.01 117.35 116.13 1wim s TYR 15 Ca 0.10 -0.18 -0.30 0.00 -1.01 0.00 0.00 57.07 55.68 1wim s TYR 15 Cb -0.15 -0.04 -0.08 0.00 -0.11 0.00 0.00 41.96 41.57 1wim s TYR 15 CO 0.09 -0.33 1.33 -1.25 -1.11 0.00 0.00 175.55 174.28 1wim s PRO 16 N -1.77 4.37 0.41 -1.71 0.04 -1.26 -2.74 135.00 132.34 1wim s PRO 16 Ca -0.12 2.04 0.24 0.00 0.04 0.00 0.00 61.00 63.21 1wim s PRO 16 Cb -0.05 -3.22 1.29 0.00 0.04 0.00 0.00 34.50 32.55 1wim s PRO 16 CO -0.00 -0.31 1.67 -0.39 0.04 0.00 0.00 177.00 178.01 1wim h VAL 17 N 3.96 0.25 -0.20 -0.36 -1.51 -1.93 0.95 116.25 117.42 1wim h VAL 17 Ca -0.44 -0.07 0.06 0.00 -1.23 0.00 0.00 66.70 65.02 1wim h VAL 17 Cb 1.21 0.04 -0.07 0.00 -2.13 0.00 0.00 31.29 30.34 1wim h VAL 17 CO 0.81 0.04 -0.31 -0.33 -1.23 0.00 0.00 177.57 176.55 1wim h GLU 18 N 0.20 -0.33 -0.42 5.19 4.39 -1.92 -1.85 114.58 119.84 1wim h GLU 18 Ca 0.75 0.02 -0.11 0.00 0.34 0.00 0.00 59.36 60.35 1wim h GLU 18 Cb 2.14 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 30.85 1wim h GLU 18 CO -0.42 -0.22 -0.20 1.96 -1.16 0.00 0.00 179.01 178.98 1wim h GLN 19 N -0.34 0.82 -7.09 2.33 4.20 -1.22 -3.44 115.11 110.37 1wim h GLN 19 Ca 0.12 -0.32 -0.47 0.00 0.06 0.00 0.00 58.65 58.03 1wim h GLN 19 Cb 0.53 -0.04 0.21 0.00 0.30 0.00 0.00 27.48 28.48 1wim h GLN 19 CO -0.39 0.95 -0.11 -1.33 -0.67 0.00 0.00 178.83 177.28 1wim n MET 20 N -4.12 -1.66 -3.84 1.46 2.81 -0.70 -3.99 117.12 107.09 1wim n MET 20 Ca 0.00 -0.44 -0.26 0.00 -1.81 0.00 0.00 57.70 55.19 1wim n MET 20 Cb 0.42 -2.15 -0.17 0.00 -0.71 0.00 0.00 33.22 30.61 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 -2.45 0.76 0.01 2.03 2.01 -0.69 -4.84 115.64 112.46 1wim s THR 21 Ca 0.66 -0.23 -0.18 0.00 0.31 0.00 0.00 61.69 62.25 1wim s THR 21 Cb -0.23 -0.91 -0.06 0.00 0.01 0.00 0.00 72.50 71.32 1wim s THR 21 CO 0.63 0.22 0.51 -0.89 -0.69 0.00 0.00 174.62 174.41 1wim s THR 22 N 1.80 4.92 -0.11 -0.82 2.01 -1.26 -1.99 115.64 120.19 1wim s THR 22 Ca 0.04 1.07 -0.18 0.00 0.31 0.00 0.00 61.69 62.93 1wim s THR 22 Cb -0.13 -3.84 -0.04 0.00 0.01 0.00 0.00 72.50 68.49 1wim s THR 22 CO -0.07 0.50 0.48 -0.63 -0.69 0.00 0.00 174.62 174.21 1wim s ILE 23 N -0.68 5.17 -0.31 1.82 1.01 -0.03 -4.95 121.20 123.23 1wim s ILE 23 Ca 0.27 0.97 0.02 0.00 0.00 0.00 0.00 60.65 61.91 1wim s ILE 23 Cb -0.18 -3.82 0.24 0.00 0.01 0.00 0.00 42.46 38.71 1wim s ILE 23 CO 0.16 0.34 1.21 0.00 0.00 0.00 0.00 174.94 176.64 1wim n ALA 24 N 3.54 3.39 -0.00 9.38 0.00 -1.26 -2.03 120.51 133.52 1wim n ALA 24 Ca -0.07 -0.89 -0.00 0.00 0.00 0.00 0.00 53.44 52.48 1wim n ALA 24 Cb 0.52 -1.12 -0.00 0.00 0.00 0.00 0.00 19.45 18.84 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 0.02 0.01 -0.75 0.00 1.13 -1.26 -4.85 117.38 111.68 1wim n GLN 25 Ca 0.17 0.00 0.05 0.00 -1.94 0.00 0.00 57.00 55.29 1wim n GLN 25 Cb 0.81 -0.56 0.11 0.00 0.11 0.00 0.00 30.24 30.71 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 -0.54 -0.89 -4.39 0.00 1.13 -0.86 -4.91 117.38 106.92 1wim n GLN 27 Ca 0.12 0.10 -0.34 0.00 -1.94 0.00 0.00 57.00 54.94 1wim n GLN 27 Cb 0.82 -3.83 -0.13 0.00 0.11 0.00 0.00 30.24 27.21 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 0.50 5.38 -0.18 0.00 2.07 -1.26 -0.85 121.20 126.86 1wim s ILE 29 Ca -0.04 -0.08 -0.13 0.00 -1.41 0.00 0.00 60.65 58.99 1wim s ILE 29 Cb -0.15 -3.46 0.06 0.00 0.13 0.00 0.00 42.46 39.04 1wim s ILE 29 CO 0.03 0.42 0.47 -0.36 -1.91 0.00 0.00 174.94 173.58 1wim s PHE 30 N -1.22 -0.62 0.23 3.50 0.08 -0.84 -4.76 117.98 114.34 1wim s PHE 30 Ca 0.23 1.37 -0.32 0.00 0.12 0.00 0.00 56.93 58.33 1wim s PHE 30 Cb -0.12 0.27 -0.12 0.00 -0.57 0.00 0.00 43.02 42.47 1wim s PHE 30 CO 0.14 -0.32 1.68 0.00 -0.10 0.00 0.00 175.22 176.62 1wim n THR 32 N 3.47 -0.27 -0.01 0.00 -1.04 -1.26 -1.00 114.28 114.16 1wim n THR 32 Ca 0.14 1.31 -0.00 0.00 -2.04 0.00 0.00 64.05 63.46 1wim n THR 32 Cb 0.35 -1.66 -0.00 0.00 -1.82 0.00 0.00 70.33 67.20 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 -4.00 -0.03 0.00 -4.42 4.77 -1.26 0.80 117.00 112.86 1wim n LEU 33 Ca 0.01 0.78 0.00 0.00 -0.03 0.00 0.00 56.01 56.77 1wim n LEU 33 Cb 0.10 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.82 1wim n LEU 33 CO -0.06 -0.40 0.38 0.00 -1.33 0.00 0.00 177.39 175.97 1wim n LEU 35 N -1.58 0.17 0.13 0.00 0.00 -0.62 0.10 117.00 115.21 1wim n LEU 35 Ca 0.00 1.04 -0.11 0.00 0.00 0.00 0.00 56.01 56.95 1wim n LEU 35 Cb 0.00 -0.51 -0.07 0.00 0.00 0.00 0.00 43.42 42.84 1wim n LEU 35 CO 0.00 -1.14 0.37 0.50 0.00 0.00 0.00 177.39 177.12 1wim h LYS 36 N 0.00 -0.38 -0.60 1.96 3.64 0.12 -2.53 116.57 118.79 1wim h LYS 36 Ca 0.64 0.03 0.11 0.00 -1.27 0.00 0.00 60.65 60.15 1wim h LYS 36 Cb 2.02 0.09 -0.04 0.00 -0.41 0.00 0.00 32.23 33.89 1wim h LYS 36 CO -0.37 -0.05 0.40 1.96 -2.27 0.00 0.00 179.45 179.12 1wim h GLN 37 N -0.94 0.35 0.54 1.90 7.50 0.34 0.25 115.11 125.04 1wim h GLN 37 Ca -0.04 -0.02 -0.03 0.00 0.50 0.00 0.00 58.65 59.06 1wim h GLN 37 Cb 0.50 -0.08 0.01 0.00 0.05 0.00 0.00 27.48 27.96 1wim h GLN 37 CO 0.07 0.23 -0.26 -0.92 -1.50 0.00 0.00 178.83 176.45 1wim h TYR 38 N 0.36 -0.67 -0.28 2.96 3.20 -0.76 -0.83 116.97 120.95 1wim h TYR 38 Ca 0.28 -0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.13 1wim h TYR 38 Cb 0.61 0.22 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 1wim h TYR 38 CO -0.00 -0.42 0.15 -0.39 -1.64 0.00 0.00 178.16 175.87 1wim h VAL 39 N -0.92 1.09 0.73 1.81 -1.51 -1.21 -2.42 116.25 113.82 1wim h VAL 39 Ca -0.07 -0.23 -0.04 0.00 -1.23 0.00 0.00 66.70 65.13 1wim h VAL 39 Cb 0.55 0.71 0.01 0.00 -2.13 0.00 0.00 31.29 30.43 1wim h VAL 39 CO 0.12 0.10 -0.35 -0.33 -1.23 0.00 0.00 177.57 175.88 1wim h GLU 40 N 0.39 -0.95 -0.64 5.19 5.08 -0.49 -2.53 114.58 120.62 1wim h GLU 40 Ca 0.10 0.06 0.13 0.00 -1.00 0.00 0.00 59.36 58.66 1wim h GLU 40 Cb 0.01 0.22 -0.11 0.00 0.50 0.00 0.00 28.75 29.37 1wim h GLU 40 CO -0.02 -0.63 0.01 -0.07 -1.00 0.00 0.00 179.01 177.30 1wim h LEU 41 N -1.19 -0.27 -0.94 1.33 4.07 -1.03 0.27 115.31 117.54 1wim h LEU 41 Ca -0.10 0.16 0.14 0.00 0.08 0.00 0.00 57.88 58.16 1wim h LEU 41 Cb 0.76 0.28 -0.09 0.00 1.08 0.00 0.00 40.66 42.68 1wim h LEU 41 CO 0.17 -0.12 0.55 -0.07 -1.08 0.00 0.00 178.44 177.89 1wim h LEU 42 N 0.12 0.75 -0.05 1.67 3.38 -1.44 -1.29 115.31 118.45 1wim h LEU 42 Ca 0.34 0.07 -0.09 0.00 0.09 0.00 0.00 57.88 58.29 1wim h LEU 42 Cb 0.55 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.24 1wim h LEU 42 CO -0.55 0.35 -0.30 0.40 0.09 0.00 0.00 178.44 178.44 1wim h ILE 43 N 0.81 1.45 -0.73 1.22 2.04 -0.34 -3.13 117.51 118.82 1wim h ILE 43 Ca 0.49 -1.75 0.15 0.00 1.00 0.00 0.00 64.86 64.75 1wim h ILE 43 Cb 0.61 2.41 -0.11 0.00 -0.74 0.00 0.00 36.82 39.00 1wim h ILE 43 CO -0.32 0.50 0.20 0.11 0.00 0.00 0.00 178.15 178.64 1wim h LYS 44 N -0.23 0.29 0.17 2.37 1.79 0.08 -2.86 116.57 118.18 1wim h LYS 44 Ca -0.02 -0.02 -0.01 0.00 -2.18 0.00 0.00 60.65 58.42 1wim h LYS 44 Cb 0.97 -0.07 0.00 0.00 -1.58 0.00 0.00 32.23 31.55 1wim h LYS 44 CO 0.06 0.19 -0.09 1.49 -1.08 0.00 0.00 179.45 180.02 1wim h GLU 45 N 0.30 -0.23 0.00 3.15 4.57 -1.31 -3.48 114.58 117.57 1wim h GLU 45 Ca 0.41 0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.60 1wim h GLU 45 Cb 0.68 0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 1wim h GLU 45 CO -0.48 -0.16 0.00 0.41 -1.18 0.00 0.00 179.01 177.60 1wim n GLY 46 N -1.12 3.15 0.38 1.92 0.00 -1.08 -4.94 105.19 103.49 1wim n GLY 46 Ca -0.03 -0.90 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 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 -0.96 -4.59 0.99 7.94 -1.26 -3.78 117.00 115.34 1wim n LEU 47 Ca 0.00 1.61 -0.43 0.00 -1.11 0.00 0.00 56.01 56.08 1wim n LEU 47 Cb 0.00 -0.21 -0.03 0.00 0.53 0.00 0.00 43.42 43.71 1wim n LEU 47 CO 0.00 -1.31 0.83 -1.61 -1.11 0.00 0.00 177.39 174.19 1wim s GLU 48 N -5.46 3.69 -0.15 1.96 2.02 -1.26 -4.91 118.70 114.58 1wim s GLU 48 Ca -0.11 0.42 -0.17 0.00 0.02 0.00 0.00 54.97 55.12 1wim s GLU 48 Cb 0.10 -3.88 -0.15 0.00 0.10 0.00 0.00 34.13 30.30 1wim s GLU 48 CO 0.56 -1.18 0.27 1.15 0.02 0.00 0.00 175.26 176.09 1wim h THR 49 N 6.04 0.84 -4.00 3.63 2.02 -1.87 -3.42 112.91 116.15 1wim h THR 49 Ca -0.23 -1.79 -0.53 0.00 0.77 0.00 0.00 66.41 64.63 1wim h THR 49 Cb 1.07 1.75 0.09 0.00 -1.74 0.00 0.00 68.15 69.32 1wim h THR 49 CO 1.04 0.29 0.57 0.00 0.37 0.00 0.00 175.52 177.78 1wim s ALA 50 N -2.42 3.02 -0.67 6.16 0.00 -1.26 -4.94 121.76 121.64 1wim s ALA 50 Ca -0.18 1.16 0.02 0.00 0.00 0.00 0.00 51.96 52.96 1wim s ALA 50 Cb 0.01 -3.47 0.17 0.00 0.00 0.00 0.00 23.12 19.82 1wim s ALA 50 CO 0.44 -0.94 0.47 0.42 0.00 0.00 0.00 175.76 176.15 1wim s ILE 51 N -1.38 3.26 0.70 0.00 1.01 -1.26 -5.06 121.20 118.47 1wim s ILE 51 Ca 0.64 -3.65 -0.12 0.00 0.00 0.00 0.00 60.65 57.52 1wim s ILE 51 Cb -0.35 -3.14 0.17 0.00 0.01 0.00 0.00 42.46 39.15 1wim s ILE 51 CO 0.43 -0.93 0.64 -0.24 0.00 0.00 0.00 174.94 174.84 1wim n SER 52 N 2.69 -1.47 -4.75 3.58 2.88 -1.26 -1.36 113.62 113.93 1wim n SER 52 Ca 0.13 -0.92 -0.41 0.00 -1.33 0.00 0.00 58.87 56.34 1wim n SER 52 Cb 0.35 -0.58 -0.02 0.00 -0.75 0.00 0.00 64.21 63.21 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 2.12 0.49 -3.76 0.00 -0.04 -1.26 -4.53 135.00 128.02 1wim n PRO 54 Ca 0.07 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.16 1wim n PRO 54 Cb 0.39 -1.49 -0.13 0.00 -0.04 0.00 0.00 33.50 32.24 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 -1.99 5.20 0.45 3.54 -1.08 -1.26 -4.95 116.67 116.58 1wim s ASP 55 Ca 0.23 -0.95 0.30 0.00 -0.52 0.00 0.00 52.55 51.61 1wim s ASP 55 Cb 0.11 -1.87 1.20 0.00 -1.46 0.00 0.00 42.92 40.90 1wim s ASP 55 CO 0.18 -0.27 1.88 0.00 0.52 0.00 0.00 175.17 177.49 1wim h ALA 56 N 8.22 1.00 -0.62 3.66 0.00 -2.02 -2.69 119.26 126.81 1wim h ALA 56 Ca -0.27 0.00 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 1wim h ALA 56 Cb 1.10 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.76 1wim h ALA 56 CO 0.60 0.00 0.28 0.00 0.00 0.00 0.00 179.25 180.13 1wim n ALA 57 N -1.99 4.28 -2.53 0.00 0.00 -1.26 -4.87 120.51 114.14 1wim n ALA 57 Ca 0.01 -1.87 -0.41 0.00 0.00 0.00 0.00 53.44 51.17 1wim n ALA 57 Cb 0.29 -1.23 -0.10 0.00 0.00 0.00 0.00 19.45 18.41 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 5.23 0.24 -0.13 0.00 -0.04 -1.26 -3.03 135.00 136.01 1wim n PRO 59 Ca -0.11 0.13 -0.24 0.00 -0.04 0.00 0.00 63.50 63.24 1wim n PRO 59 Cb 0.49 -1.50 -0.11 0.00 -0.04 0.00 0.00 33.50 32.35 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 -1.25 0.60 -3.11 0.54 0.00 -1.26 -5.03 118.16 108.64 1wim n LYS 60 Ca 0.08 0.21 -0.14 0.00 0.00 0.00 0.00 58.31 58.45 1wim n LYS 60 Cb 0.11 -1.48 0.06 0.00 0.00 0.00 0.00 35.03 33.72 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 -3.79 -5.07 -2.65 1.64 6.02 -1.17 -4.97 117.38 107.39 1wim n GLN 61 Ca -0.50 0.61 -0.42 0.00 -0.01 0.00 0.00 57.00 56.68 1wim n GLN 61 Cb 0.92 -4.92 -0.03 0.00 1.02 0.00 0.00 30.24 27.23 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 -3.74 2.67 0.83 1.08 0.00 -1.26 -4.45 107.32 102.45 1wim s GLY 62 Ca 0.13 0.56 -0.09 0.00 0.00 0.00 0.00 44.72 45.32 1wim s GLY 62 CO 0.52 1.82 1.15 0.30 0.00 0.00 0.00 173.10 176.89 1wim s HIS 63 N 1.30 1.82 -0.10 1.90 3.76 -1.26 -1.34 115.29 121.37 1wim s HIS 63 Ca 0.52 0.12 -0.06 0.00 -0.15 0.00 0.00 55.06 55.50 1wim s HIS 63 Cb -0.22 -3.54 -0.04 0.00 1.11 0.00 0.00 32.58 29.89 1wim s HIS 63 CO 0.26 -2.09 0.14 -0.51 -0.85 0.00 0.00 174.74 171.68 1wim s LEU 64 N -5.51 4.34 0.98 0.89 2.01 -0.46 -4.72 118.68 116.21 1wim s LEU 64 Ca 0.69 0.43 -0.14 0.00 0.01 0.00 0.00 54.13 55.12 1wim s LEU 64 Cb -0.06 -2.15 0.18 0.00 0.01 0.00 0.00 46.19 44.18 1wim s LEU 64 CO 0.48 0.38 1.14 -1.10 1.01 0.00 0.00 176.35 178.26 1wim s GLN 65 N -1.18 0.57 -0.03 1.70 1.11 -1.26 -4.83 119.66 115.73 1wim s GLN 65 Ca 0.17 0.24 -0.24 0.00 0.01 0.00 0.00 55.36 55.54 1wim s GLN 65 Cb -0.12 -1.78 -0.18 0.00 -1.01 0.00 0.00 33.01 29.93 1wim s GLN 65 CO 0.06 -2.58 1.06 1.49 0.01 0.00 0.00 175.29 175.34 1wim h GLU 66 N -1.77 -0.17 -0.74 2.91 4.57 -2.00 -3.00 114.58 114.38 1wim h GLU 66 Ca -0.51 0.01 0.16 0.00 -1.18 0.00 0.00 59.36 57.85 1wim h GLU 66 Cb 1.32 0.04 -0.11 0.00 -0.16 0.00 0.00 28.75 29.84 1wim h GLU 66 CO 0.55 0.28 0.19 -2.95 -1.18 0.00 0.00 179.01 175.90 1wim h ASN 67 N -0.73 0.03 0.19 1.04 -1.07 -1.99 0.16 115.58 113.20 1wim h ASN 67 Ca -0.02 0.15 0.01 0.00 0.07 0.00 0.00 56.30 56.51 1wim h ASN 67 Cb 0.53 0.19 -0.03 0.00 -2.07 0.00 0.00 38.32 36.94 1wim h ASN 67 CO 0.03 -0.03 -0.26 -0.33 0.07 0.00 0.00 177.43 176.91 1wim h GLU 68 N 0.28 -0.49 0.15 4.14 4.39 -1.95 -2.64 114.58 118.45 1wim h GLU 68 Ca 0.42 0.03 -0.00 0.00 0.34 0.00 0.00 59.36 60.15 1wim h GLU 68 Cb 0.72 0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.47 1wim h GLU 68 CO -0.51 -0.33 -0.11 0.82 -1.16 0.00 0.00 179.01 177.73 1wim h ILE 69 N -0.51 0.77 -0.98 3.13 2.04 -1.14 0.19 117.51 121.01 1wim h ILE 69 Ca 0.01 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.97 1wim h ILE 69 Cb 0.50 0.77 -0.12 0.00 -0.74 0.00 0.00 36.82 37.23 1wim h ILE 69 CO -0.10 0.00 -0.55 1.21 0.00 0.00 0.00 178.15 178.71 1wim n GLU 70 N -5.22 -0.40 -0.12 2.37 0.00 0.45 -0.57 120.64 117.15 1wim n GLU 70 Ca -0.08 1.49 -0.11 0.00 0.00 0.00 0.00 57.16 58.46 1wim n GLU 70 Cb 0.14 -2.19 -0.02 0.00 0.00 0.00 0.00 31.44 29.37 1wim n GLU 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1wim h MET 72 N 0.44 -0.29 -6.48 0.00 1.85 0.13 -3.42 114.93 107.17 1wim h MET 72 Ca 0.10 0.02 -0.43 0.00 -0.61 0.00 0.00 59.70 58.78 1wim h MET 72 Cb 0.49 0.06 0.02 0.00 0.43 0.00 0.00 31.60 32.61 1wim h MET 72 CO 0.02 -0.19 -0.24 0.14 -0.40 0.00 0.00 176.91 176.25 1wim s VAL 73 N -5.76 2.93 0.78 -5.77 -7.23 0.07 -5.03 120.40 100.39 1wim s VAL 73 Ca -0.14 -0.98 -0.05 0.00 -1.81 0.00 0.00 61.98 58.99 1wim s VAL 73 Cb 0.11 -2.95 0.14 0.00 0.56 0.00 0.00 36.38 34.24 1wim s VAL 73 CO 0.64 0.00 1.08 0.00 -0.31 0.00 0.00 175.10 176.51 1wim s ALA 74 N -2.39 3.27 0.08 1.32 0.00 -1.26 -4.76 121.76 118.02 1wim s ALA 74 Ca 0.56 -1.51 -0.28 0.00 0.00 0.00 0.00 51.96 50.72 1wim s ALA 74 Cb -0.10 -2.26 -0.16 0.00 0.00 0.00 0.00 23.12 20.60 1wim s ALA 74 CO 0.34 -1.69 1.67 0.00 0.00 0.00 0.00 175.76 176.08 1wim h ALA 75 N -0.82 -0.49 -1.05 0.00 0.00 -1.98 0.23 119.26 115.15 1wim h ALA 75 Ca -0.39 -0.10 0.35 0.00 0.00 0.00 0.00 54.91 54.76 1wim h ALA 75 Cb 1.26 0.21 -0.15 0.00 0.00 0.00 0.00 17.79 19.12 1wim h ALA 75 CO 0.42 -0.78 0.62 1.05 0.00 0.00 0.00 179.25 180.55 1wim h GLU 76 N -0.49 0.24 0.00 0.00 4.11 -2.01 -0.96 114.58 115.47 1wim h GLU 76 Ca -0.04 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.37 1wim h GLU 76 Cb 0.39 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1wim h GLU 76 CO 0.06 0.16 -0.08 0.82 0.07 0.00 0.00 179.01 180.04 1wim h ILE 77 N 0.25 0.00 -0.74 -1.06 1.08 -1.83 -3.38 117.51 111.83 1wim h ILE 77 Ca 0.75 -0.86 0.11 0.00 -0.39 0.00 0.00 64.86 64.47 1wim h ILE 77 Cb 1.88 0.00 -0.12 0.00 -3.07 0.00 0.00 36.82 35.51 1wim h ILE 77 CO -0.58 0.00 -0.31 0.80 -0.69 0.00 0.00 178.15 177.37 1wim n MET 78 N -4.37 -0.20 -0.33 2.37 1.56 0.75 0.11 117.12 117.02 1wim n MET 78 Ca -0.01 1.14 0.10 0.00 -0.27 0.00 0.00 57.70 58.66 1wim n MET 78 Cb 0.04 -1.69 0.21 0.00 2.15 0.00 0.00 33.22 33.93 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 -0.08 -0.20 2.12 -0.06 -0.42 0.13 117.38 113.80 1wim n GLN 79 Ca 0.07 1.41 -0.01 0.00 -2.00 0.00 0.00 57.00 56.46 1wim n GLN 79 Cb 0.28 -2.18 0.09 0.00 -4.06 0.00 0.00 30.24 24.37 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 0.50 0.51 3.69 3.08 0.61 -1.73 114.38 121.04 1wim h ARG 80 Ca 0.51 -0.03 -0.02 0.00 0.07 0.00 0.00 59.98 60.50 1wim h ARG 80 Cb 0.94 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.88 1wim h ARG 80 CO -0.91 0.33 -0.24 -0.92 -1.07 0.00 0.00 179.97 177.16 1wim h TYR 81 N 0.52 -0.63 -0.63 3.04 3.20 0.11 -1.94 116.97 120.64 1wim h TYR 81 Ca 0.29 -0.01 0.12 0.00 3.14 0.00 0.00 58.73 62.26 1wim h TYR 81 Cb 0.26 0.21 -0.12 0.00 1.54 0.00 0.00 36.73 38.62 1wim h TYR 81 CO -0.12 -0.34 -0.23 0.87 -1.64 0.00 0.00 178.16 176.70 1wim h LYS 82 N -0.81 -0.07 0.00 1.82 1.57 -0.96 -0.70 116.57 117.43 1wim h LYS 82 Ca -0.07 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.74 1wim h LYS 82 Cb 0.58 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.87 1wim h LYS 82 CO 0.11 -0.04 -0.14 0.87 -0.57 0.00 0.00 179.45 179.68 1wim h LYS 83 N -0.07 -0.23 -0.56 3.15 1.57 -1.26 -2.63 116.57 116.55 1wim h LYS 83 Ca 0.29 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 59.19 1wim h LYS 83 Cb 0.52 0.05 -0.11 0.00 0.08 0.00 0.00 32.23 32.77 1wim h LYS 83 CO -0.68 -0.15 -0.15 -0.07 -0.57 0.00 0.00 179.45 177.83 1wim h LEU 84 N -0.23 -0.55 -0.43 2.94 3.38 -0.36 0.13 115.31 120.19 1wim h LEU 84 Ca 0.05 0.17 0.07 0.00 0.09 0.00 0.00 57.88 58.25 1wim h LEU 84 Cb 0.29 0.36 -0.09 0.00 0.09 0.00 0.00 40.66 41.31 1wim h LEU 84 CO -0.13 -0.19 -0.47 1.56 0.09 0.00 0.00 178.44 179.29 1wim h GLN 85 N -0.01 -0.33 0.38 1.13 1.08 -0.87 -1.27 115.11 115.23 1wim h GLN 85 Ca 0.27 0.02 -0.02 0.00 -1.45 0.00 0.00 58.65 57.47 1wim h GLN 85 Cb 0.42 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 1wim h GLN 85 CO -0.58 -0.22 -0.18 0.35 -0.95 0.00 0.00 178.83 177.25 1wim h PHE 86 N -0.34 -0.47 -0.93 2.96 3.57 -1.20 -1.74 116.94 118.79 1wim h PHE 86 Ca 0.12 -0.01 0.25 0.00 3.53 0.00 0.00 57.97 61.86 1wim h PHE 86 Cb 0.59 0.16 -0.17 0.00 2.79 0.00 0.00 35.95 39.31 1wim h PHE 86 CO -0.67 -0.24 -0.01 0.39 -2.23 0.00 0.00 178.31 175.55 1wim n GLU 87 N -5.27 -0.08 -2.06 1.11 -0.58 0.36 0.48 120.64 114.60 1wim n GLU 87 Ca -0.11 1.41 -0.30 0.00 -0.42 0.00 0.00 57.16 57.74 1wim n GLU 87 Cb 0.24 -2.22 0.03 0.00 -0.57 0.00 0.00 31.44 28.92 1wim n GLU 87 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1wim n ARG 88 N -5.40 3.22 -0.08 3.49 1.74 -0.53 -4.73 116.66 114.38 1wim n ARG 88 Ca 0.21 -4.02 -0.10 0.00 -0.77 0.00 0.00 57.85 53.17 1wim n ARG 88 Cb 0.69 -2.27 -0.05 0.00 -1.02 0.00 0.00 32.46 29.81 1wim n ARG 88 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1wim h SER 89 N 2.48 0.00 -4.75 0.55 0.87 0.96 -3.48 113.55 110.19 1wim h SER 89 Ca 0.42 -0.25 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1wim h SER 89 Cb 0.87 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1wim h SER 89 CO 1.07 0.94 0.00 0.61 -0.53 0.00 0.00 176.83 178.92 1wim n GLY 90 N 1.59 0.80 3.55 5.77 0.00 -1.26 -4.85 105.19 110.80 1wim n GLY 90 Ca -0.13 -1.82 -0.37 0.00 0.00 0.00 0.00 46.02 43.70 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 -2.58 2.61 -1.22 1.61 0.04 -1.26 -4.91 135.00 129.29 1wim s PRO 91 Ca 0.00 0.49 -0.19 0.00 0.04 0.00 0.00 61.00 61.34 1wim s PRO 91 Cb 0.00 -4.49 0.07 0.00 0.04 0.00 0.00 34.50 30.12 1wim s PRO 91 CO 0.00 -2.83 1.65 -1.12 0.04 0.00 0.00 177.00 174.74 1wim s SER 92 N 8.13 6.75 -0.36 6.66 0.01 -1.26 -4.94 113.70 128.69 1wim s SER 92 Ca 0.68 -2.18 -0.10 0.00 1.31 0.00 0.00 55.95 55.65 1wim s SER 92 Cb -0.12 -2.57 0.03 0.00 0.21 0.00 0.00 66.02 63.57 1wim s SER 92 CO 0.18 -1.25 0.18 -0.55 0.41 0.00 0.00 173.24 172.21 1wim s SER 93 N 4.40 5.64 0.00 2.44 0.15 -1.26 -5.32 113.70 119.75 1wim s SER 93 Ca 0.51 -0.99 0.12 0.00 0.70 0.00 0.00 55.95 56.30 1wim s SER 93 Cb 0.03 -1.99 0.73 0.00 -1.71 0.00 0.00 66.02 63.08 1wim s SER 93 CO 0.03 -0.36 1.17 0.61 1.20 0.00 0.00 173.24 175.88