#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l6l n LYS 3 N 0.00 0.00 -3.72 0.00 4.76 -1.26 -4.22 118.16 113.72 1l6l n LYS 3 Ca 0.00 0.00 -0.35 0.00 -2.87 0.00 0.00 58.31 55.09 1l6l n LYS 3 Cb 0.00 0.00 -0.09 0.00 -1.84 0.00 0.00 35.03 33.10 1l6l n LYS 3 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1l6l s GLU 4 N 0.00 2.75 0.00 1.97 8.01 -1.26 -5.06 118.70 125.11 1l6l s GLU 4 Ca 0.00 -2.83 0.00 0.00 0.01 0.00 0.00 54.97 52.15 1l6l s GLU 4 Cb 0.00 -3.76 0.00 0.00 -4.31 0.00 0.00 34.13 26.06 1l6l s GLU 4 CO 0.00 -1.21 0.00 -0.35 0.01 0.00 0.00 175.26 173.71 1l6l n PRO 5 N 2.99 1.59 -1.92 0.39 -0.04 -1.26 -4.78 135.00 131.98 1l6l n PRO 5 Ca 0.13 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.27 1l6l n PRO 5 Cb 0.37 0.00 -0.04 0.00 -0.04 0.00 0.00 33.50 33.79 1l6l n PRO 5 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1l6l n VAL 7 N 7.71 0.00 0.10 0.00 3.14 -1.26 -4.91 118.33 123.10 1l6l n VAL 7 Ca 0.32 0.00 -0.01 0.00 -2.96 0.00 0.00 64.34 61.69 1l6l n VAL 7 Cb 0.50 0.00 0.26 0.00 -1.06 0.00 0.00 33.84 33.54 1l6l n VAL 7 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1l6l h GLU 8 N 0.00 0.24 0.00 1.45 4.39 -1.88 -2.22 114.58 116.56 1l6l h GLU 8 Ca 0.00 -0.10 -0.03 0.00 0.34 0.00 0.00 59.36 59.57 1l6l h GLU 8 Cb 0.00 -0.01 -0.00 0.00 -0.10 0.00 0.00 28.75 28.64 1l6l h GLU 8 CO 0.00 0.56 -0.40 0.77 -1.16 0.00 0.00 179.01 178.78 1l6l h SER 9 N 0.21 0.00 0.03 1.42 0.02 -1.88 -3.07 113.55 110.29 1l6l h SER 9 Ca 0.03 0.00 -0.08 0.00 -0.84 0.00 0.00 61.79 60.89 1l6l h SER 9 Cb 0.71 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.26 1l6l h SER 9 CO 0.05 0.12 -0.34 -0.07 -1.14 0.00 0.00 176.83 175.45 1l6l h LEU 10 N 0.00 0.25 -0.42 5.07 -0.00 -1.83 -3.34 115.31 115.04 1l6l h LEU 10 Ca -0.01 -0.86 -0.08 0.00 -0.00 0.00 0.00 57.88 56.93 1l6l h LEU 10 Cb 1.10 -0.08 -0.01 0.00 -0.00 0.00 0.00 40.66 41.66 1l6l h LEU 10 CO 0.01 1.08 -0.05 1.62 -0.00 0.00 0.00 178.44 181.10 1l6l h VAL 11 N -0.55 1.27 -1.49 1.22 3.04 -1.54 -3.29 116.25 114.90 1l6l h VAL 11 Ca -0.05 -1.12 -0.75 0.00 -1.01 0.00 0.00 66.70 63.77 1l6l h VAL 11 Cb 1.16 1.15 -0.15 0.00 -2.01 0.00 0.00 31.29 31.44 1l6l h VAL 11 CO 0.07 0.38 1.92 -0.24 -1.01 0.00 0.00 177.57 178.69 1l6l n SER 12 N -4.36 5.07 0.00 3.17 2.88 -1.16 -3.83 113.62 115.39 1l6l n SER 12 Ca -0.01 -3.07 0.00 0.00 -1.33 0.00 0.00 58.87 54.47 1l6l n SER 12 Cb 0.33 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.28 1l6l n SER 12 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1l6l n GLN 13 N 4.43 0.00 0.00 -1.46 7.27 -1.24 -4.80 117.38 121.58 1l6l n GLN 13 Ca 0.40 0.00 0.12 0.00 0.07 0.00 0.00 57.00 57.59 1l6l n GLN 13 Cb 0.38 0.00 0.52 0.00 2.41 0.00 0.00 30.24 33.55 1l6l n GLN 13 CO 0.00 0.00 0.00 0.98 0.07 0.00 0.00 177.06 178.11 1l6l n TYR 14 N -1.61 0.02 0.26 3.69 4.19 -1.25 -3.32 117.16 119.15 1l6l n TYR 14 Ca 0.00 0.01 0.13 0.00 3.31 0.00 0.00 57.90 61.35 1l6l n TYR 14 Cb 0.00 -0.51 0.73 0.00 0.49 0.00 0.00 39.34 40.05 1l6l n TYR 14 CO 0.00 0.00 0.00 0.27 0.91 0.00 0.00 176.86 178.04 1l6l h PHE 15 N 0.00 0.00 0.00 2.98 -5.15 -1.92 -1.77 116.94 111.08 1l6l h PHE 15 Ca 0.00 0.00 -0.05 0.00 -0.20 0.00 0.00 57.97 57.72 1l6l h PHE 15 Cb 0.43 0.00 -0.01 0.00 0.22 0.00 0.00 35.95 36.59 1l6l h PHE 15 CO 0.00 0.11 -0.30 1.96 -2.00 0.00 0.00 178.31 178.08 1l6l h GLN 16 N 0.00 0.00 -0.87 6.09 4.20 -1.95 -3.37 115.11 119.21 1l6l h GLN 16 Ca -0.00 0.00 0.12 0.00 0.06 0.00 0.00 58.65 58.83 1l6l h GLN 16 Cb 0.33 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.04 1l6l h GLN 16 CO 0.01 0.76 0.56 1.15 -0.67 0.00 0.00 178.83 180.64 1l6l h THR 17 N -1.00 0.90 -0.05 -0.54 2.02 -1.66 -0.28 112.91 112.30 1l6l h THR 17 Ca -0.07 -0.26 -0.03 0.00 0.77 0.00 0.00 66.41 66.82 1l6l h THR 17 Cb 0.85 0.07 -0.01 0.00 -1.74 0.00 0.00 68.15 67.33 1l6l h THR 17 CO -0.04 0.14 -0.10 1.62 0.37 0.00 0.00 175.52 177.50 1l6l h VAL 18 N 0.76 1.11 0.00 3.16 3.04 -1.49 -2.49 116.25 120.34 1l6l h VAL 18 Ca 0.42 -0.48 -0.21 0.00 -1.01 0.00 0.00 66.70 65.42 1l6l h VAL 18 Cb 0.56 1.18 -0.04 0.00 -2.01 0.00 0.00 31.29 30.99 1l6l h VAL 18 CO -0.18 0.14 -1.70 0.41 -1.01 0.00 0.00 177.57 175.23 1l6l n THR 19 N -4.38 1.18 0.01 3.17 -1.04 -0.64 -4.22 114.28 108.36 1l6l n THR 19 Ca -0.02 -0.72 -0.11 0.00 -2.04 0.00 0.00 64.05 61.16 1l6l n THR 19 Cb 0.20 -0.66 -0.05 0.00 -1.82 0.00 0.00 70.33 68.00 1l6l n THR 19 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 1l6l h ASP 20 N 0.00 0.01 0.90 8.00 3.32 -0.63 -2.15 116.42 125.88 1l6l h ASP 20 Ca -0.24 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.82 1l6l h ASP 20 Cb 1.72 0.01 0.00 0.00 0.22 0.00 0.00 39.33 41.28 1l6l h ASP 20 CO 0.04 0.02 0.00 0.10 -1.72 0.00 0.00 179.24 177.69 1l6l h TYR 21 N 0.06 0.00 0.00 4.55 -0.00 -1.73 -2.27 116.97 117.58 1l6l h TYR 21 Ca 0.04 0.00 -0.09 0.00 -0.00 0.00 0.00 58.73 58.68 1l6l h TYR 21 Cb 0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.74 1l6l h TYR 21 CO -0.10 0.00 -0.42 0.78 -0.00 0.00 0.00 178.16 178.42 1l6l h GLY 22 N 2.13 0.00 2.00 0.10 0.00 -1.58 -3.17 103.07 102.55 1l6l h GLY 22 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1l6l h GLY 22 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.54 177.04 1l6l h LYS 23 N 0.00 0.00 -0.25 4.80 1.57 -0.82 -2.93 116.57 118.95 1l6l h LYS 23 Ca -0.00 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.68 1l6l h LYS 23 Cb 1.32 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.61 1l6l h LYS 23 CO 0.05 0.00 -0.25 -0.44 -0.57 0.00 0.00 179.45 178.24 1l6l h ASP 24 N 0.00 0.47 1.60 0.86 3.32 -1.62 -2.26 116.42 118.79 1l6l h ASP 24 Ca 0.00 -0.16 -0.02 0.00 0.02 0.00 0.00 57.03 56.87 1l6l h ASP 24 Cb 0.52 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.94 1l6l h ASP 24 CO 0.00 0.72 -0.10 -0.07 -1.72 0.00 0.00 179.24 178.07 1l6l h LEU 25 N 0.42 0.00 -1.36 1.55 3.38 -1.70 -2.80 115.31 114.79 1l6l h LEU 25 Ca 0.06 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 57.96 1l6l h LEU 25 Cb 0.67 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.41 1l6l h LEU 25 CO 0.05 0.10 -0.31 -0.03 0.09 0.00 0.00 178.44 178.34 1l6l h MET 26 N 0.00 0.02 0.03 1.13 4.05 -1.45 0.05 114.93 118.76 1l6l h MET 26 Ca -0.00 -0.01 -0.26 0.00 -0.28 0.00 0.00 59.70 59.15 1l6l h MET 26 Cb 0.93 -0.00 -0.03 0.00 -0.80 0.00 0.00 31.60 31.69 1l6l h MET 26 CO 0.01 0.33 -1.36 0.93 0.23 0.00 0.00 176.91 177.05 1l6l h GLU 27 N 0.01 0.06 0.00 0.39 5.08 -1.48 -3.21 114.58 115.43 1l6l h GLU 27 Ca -0.00 -0.10 0.00 0.00 -1.00 0.00 0.00 59.36 58.26 1l6l h GLU 27 Cb 0.56 0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1l6l h GLU 27 CO 0.04 0.86 0.00 1.63 -1.00 0.00 0.00 179.01 180.54 1l6l n LYS 28 N -3.27 0.04 -0.09 2.33 4.76 -0.82 -3.46 118.16 117.65 1l6l n LYS 28 Ca -0.10 0.05 -0.12 0.00 -2.87 0.00 0.00 58.31 55.27 1l6l n LYS 28 Cb 1.00 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 32.54 1l6l n LYS 28 CO 0.00 0.00 0.00 1.55 -1.37 0.00 0.00 177.40 177.58 1l6l n VAL 29 N -1.48 1.46 -0.91 -0.18 3.14 -0.06 -4.29 118.33 116.01 1l6l n VAL 29 Ca 0.07 -0.78 -0.18 0.00 -2.96 0.00 0.00 64.34 60.49 1l6l n VAL 29 Cb 0.30 -0.79 0.04 0.00 -1.06 0.00 0.00 33.84 32.33 1l6l n VAL 29 CO 0.00 0.00 0.00 0.29 -6.46 0.00 0.00 176.83 170.66 1l6l n LYS 30 N -2.93 1.87 0.00 1.45 5.02 -1.21 -4.20 118.16 118.16 1l6l n LYS 30 Ca -0.33 -1.70 0.00 0.00 -2.02 0.00 0.00 58.31 54.26 1l6l n LYS 30 Cb 1.11 -1.67 0.00 0.00 -0.02 0.00 0.00 35.03 34.45 1l6l n LYS 30 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1l6l n SER 31 N 0.23 0.00 0.24 4.39 3.41 -1.26 -4.90 113.62 115.74 1l6l n SER 31 Ca 0.33 0.00 0.16 0.00 -0.26 0.00 0.00 58.87 59.10 1l6l n SER 31 Cb 0.60 0.06 0.67 0.00 -0.26 0.00 0.00 64.21 65.27 1l6l n SER 31 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 1l6l h PRO 32 N 0.00 0.00 -6.44 4.33 0.13 -1.75 -3.42 132.00 124.85 1l6l h PRO 32 Ca 0.00 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.54 1l6l h PRO 32 Cb 0.00 0.00 0.04 0.00 0.13 0.00 0.00 31.00 31.17 1l6l h PRO 32 CO 0.00 0.00 0.92 0.39 -0.23 0.00 0.00 178.00 179.08 1l6l n GLU 33 N -2.85 2.23 -4.26 0.86 1.02 -1.26 -2.37 120.64 114.00 1l6l n GLU 33 Ca 0.01 0.81 -0.30 0.00 -0.02 0.00 0.00 57.16 57.65 1l6l n GLU 33 Cb 0.27 -2.61 -0.09 0.00 -0.02 0.00 0.00 31.44 28.99 1l6l n GLU 33 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 1l6l n LEU 34 N 4.57 -1.18 0.00 -4.62 -0.00 -1.26 -4.94 117.00 109.56 1l6l n LEU 34 Ca 0.19 -1.23 -0.22 0.00 -0.00 0.00 0.00 56.01 54.74 1l6l n LEU 34 Cb 0.30 -1.70 0.17 0.00 -0.00 0.00 0.00 43.42 42.19 1l6l n LEU 34 CO 0.66 0.46 0.54 1.67 -0.00 0.00 0.00 177.39 180.72 1l6l n GLN 35 N -4.55 -1.87 0.25 1.47 7.27 -1.00 -4.87 117.38 114.09 1l6l n GLN 35 Ca -0.32 -1.40 -0.15 0.00 0.07 0.00 0.00 57.00 55.20 1l6l n GLN 35 Cb 0.69 -1.13 -0.08 0.00 2.41 0.00 0.00 30.24 32.14 1l6l n GLN 35 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1l6l h ALA 36 N -2.23 -1.09 0.00 1.69 0.00 -1.92 -2.81 119.26 112.89 1l6l h ALA 36 Ca -0.31 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1l6l h ALA 36 Cb 0.91 0.63 0.00 0.00 0.00 0.00 0.00 17.79 19.33 1l6l h ALA 36 CO 0.21 -1.11 0.00 1.05 0.00 0.00 0.00 179.25 179.40 1l6l h GLU 37 N -0.83 0.00 0.00 0.00 9.09 -1.98 -2.20 114.58 118.65 1l6l h GLU 37 Ca -0.06 0.00 -0.14 0.00 0.05 0.00 0.00 59.36 59.22 1l6l h GLU 37 Cb 0.72 0.00 -0.02 0.00 -1.65 0.00 0.00 28.75 27.80 1l6l h GLU 37 CO -0.04 0.00 -0.66 0.00 0.05 0.00 0.00 179.01 178.36 1l6l h ALA 38 N 2.08 0.87 0.05 1.06 0.00 -1.85 -3.15 119.26 118.32 1l6l h ALA 38 Ca 0.00 -0.60 -0.26 0.00 0.00 0.00 0.00 54.91 54.04 1l6l h ALA 38 Cb 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1l6l h ALA 38 CO 0.00 0.83 -1.30 0.87 0.00 0.00 0.00 179.25 179.65 1l6l h LYS 39 N 0.00 0.11 0.00 0.00 1.57 -1.35 -3.30 116.57 113.61 1l6l h LYS 39 Ca -0.01 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.58 1l6l h LYS 39 Cb 1.20 0.07 0.00 0.00 0.08 0.00 0.00 32.23 33.58 1l6l h LYS 39 CO 0.09 0.99 0.00 0.66 -0.57 0.00 0.00 179.45 180.61 1l6l h SER 40 N 0.03 0.00 -0.39 0.86 4.64 -1.55 -2.79 113.55 114.36 1l6l h SER 40 Ca -0.14 0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.11 1l6l h SER 40 Cb 1.91 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.98 1l6l h SER 40 CO 0.14 0.00 -0.01 0.22 -0.87 0.00 0.00 176.83 176.31 1l6l h TYR 41 N 0.00 0.83 -0.94 4.77 -0.00 -1.62 -2.76 116.97 117.25 1l6l h TYR 41 Ca 0.00 -0.12 0.01 0.00 -0.00 0.00 0.00 58.73 58.62 1l6l h TYR 41 Cb 0.45 -0.23 -0.05 0.00 -0.00 0.00 0.00 36.73 36.91 1l6l h TYR 41 CO 0.00 0.78 0.63 0.74 -0.00 0.00 0.00 178.16 180.31 1l6l h PHE 42 N 0.73 1.19 -0.08 -3.82 0.04 -1.68 -1.37 116.94 111.95 1l6l h PHE 42 Ca 0.14 0.03 -0.01 0.00 2.80 0.00 0.00 57.97 60.92 1l6l h PHE 42 Cb 0.46 -0.40 -0.00 0.00 2.20 0.00 0.00 35.95 38.21 1l6l h PHE 42 CO 0.02 0.75 -0.01 0.93 -0.60 0.00 0.00 178.31 179.40 1l6l h GLU 43 N 1.28 0.14 -0.13 1.51 5.08 -1.62 -2.93 114.58 117.90 1l6l h GLU 43 Ca 0.35 -0.05 -0.06 0.00 -1.00 0.00 0.00 59.36 58.60 1l6l h GLU 43 Cb -0.15 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.08 1l6l h GLU 43 CO -0.08 0.45 -0.17 0.87 -1.00 0.00 0.00 179.01 179.08 1l6l h LYS 44 N -0.17 0.22 -0.14 2.33 1.57 -1.30 -2.26 116.57 116.82 1l6l h LYS 44 Ca 0.02 -0.06 -0.13 0.00 -1.87 0.00 0.00 60.65 58.62 1l6l h LYS 44 Cb 0.39 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1l6l h LYS 44 CO 0.01 0.40 -0.47 0.66 -0.57 0.00 0.00 179.45 179.47 1l6l h SER 45 N 0.21 0.37 1.45 0.86 4.64 -1.25 -2.77 113.55 117.05 1l6l h SER 45 Ca 0.04 -0.17 -0.05 0.00 -0.47 0.00 0.00 61.79 61.14 1l6l h SER 45 Cb 0.43 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 62.41 1l6l h SER 45 CO 0.03 0.78 -0.22 0.11 -0.87 0.00 0.00 176.83 176.67 1l6l h LYS 46 N 0.28 0.00 0.00 4.77 1.57 -1.27 -2.49 116.57 119.42 1l6l h LYS 46 Ca 0.02 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 1l6l h LYS 46 Cb 0.93 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.24 1l6l h LYS 46 CO 0.08 0.22 0.00 0.39 -0.57 0.00 0.00 179.45 179.56 1l6l n GLU 47 N -3.21 0.84 0.00 3.15 1.02 -0.89 -2.34 120.64 119.21 1l6l n GLU 47 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1l6l n GLU 47 Cb 0.54 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.62 1l6l n GLU 47 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1l6l n GLN 48 N -0.85 2.78 0.05 3.49 6.02 -1.14 -4.57 117.38 123.17 1l6l n GLN 48 Ca 0.14 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 57.03 1l6l n GLN 48 Cb 0.06 -0.86 -0.07 0.00 1.02 0.00 0.00 30.24 30.40 1l6l n GLN 48 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1l6l h LEU 49 N 0.00 -0.18 0.11 1.08 7.12 -1.39 -3.19 115.31 118.86 1l6l h LEU 49 Ca 0.00 -0.33 -0.01 0.00 0.13 0.00 0.00 57.88 57.68 1l6l h LEU 49 Cb 0.67 0.05 0.00 0.00 -0.53 0.00 0.00 40.66 40.84 1l6l h LEU 49 CO 0.00 0.38 -0.05 0.74 -0.13 0.00 0.00 178.44 179.38 1l6l h THR 50 N -0.91 1.06 0.00 1.05 2.02 -1.75 -3.15 112.91 111.22 1l6l h THR 50 Ca -0.02 -0.68 0.00 0.00 0.77 0.00 0.00 66.41 66.48 1l6l h THR 50 Cb 0.50 1.48 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 1l6l h THR 50 CO 0.04 0.16 0.07 -0.65 0.37 0.00 0.00 175.52 175.51 1l6l h PRO 51 N -0.46 0.00 -0.01 6.66 0.11 -1.75 -1.30 132.00 135.25 1l6l h PRO 51 Ca -0.01 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.09 1l6l h PRO 51 Cb 0.38 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.49 1l6l h PRO 51 CO 0.02 0.00 0.00 1.25 -0.21 0.00 0.00 178.00 179.07 1l6l h LEU 52 N 0.00 0.02 0.00 2.35 5.85 -1.52 -1.32 115.31 120.68 1l6l h LEU 52 Ca 0.00 -0.19 -0.15 0.00 0.84 0.00 0.00 57.88 58.38 1l6l h LEU 52 Cb 0.15 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.15 1l6l h LEU 52 CO 0.00 0.20 -0.87 0.40 -0.34 0.00 0.00 178.44 177.83 1l6l h ILE 53 N -0.16 1.00 0.00 4.05 5.03 -1.60 -3.22 117.51 122.61 1l6l h ILE 53 Ca 0.00 -2.50 -0.02 0.00 -0.12 0.00 0.00 64.86 62.23 1l6l h ILE 53 Cb 0.19 2.45 -0.00 0.00 -3.03 0.00 0.00 36.82 36.42 1l6l h ILE 53 CO -0.00 0.57 -0.10 0.50 -0.68 0.00 0.00 178.15 178.44 1l6l h LYS 54 N 0.00 0.00 0.00 2.37 1.63 -1.16 -2.46 116.57 116.95 1l6l h LYS 54 Ca -0.05 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.75 1l6l h LYS 54 Cb 1.55 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.18 1l6l h LYS 54 CO 0.08 0.10 0.00 -0.22 -3.45 0.00 0.00 179.45 175.96 1l6l h LYS 55 N 0.00 0.00 -0.04 1.90 3.64 -1.25 -2.93 116.57 117.89 1l6l h LYS 55 Ca -0.00 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.39 1l6l h LYS 55 Cb 0.43 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.25 1l6l h LYS 55 CO 0.01 0.00 0.15 0.00 -2.27 0.00 0.00 179.45 177.34 1l6l h ALA 56 N 2.01 1.31 -0.11 5.00 0.00 -1.64 -2.55 119.26 123.28 1l6l h ALA 56 Ca 0.00 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 1l6l h ALA 56 Cb 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1l6l h ALA 56 CO 0.00 -0.17 0.07 0.78 0.00 0.00 0.00 179.25 179.92 1l6l h GLY 57 N 0.00 0.16 1.77 0.00 0.00 -1.76 -2.71 103.07 100.53 1l6l h GLY 57 Ca 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 47.33 47.28 1l6l h GLY 57 CO -0.00 0.07 -0.10 -0.37 0.00 0.00 0.00 176.54 176.13 1l6l n THR 58 N -4.98 0.00 0.00 4.70 5.66 -0.97 -1.84 114.28 116.85 1l6l n THR 58 Ca -0.05 -0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.95 1l6l n THR 58 Cb 0.06 -0.34 0.00 0.00 -1.55 0.00 0.00 70.33 68.49 1l6l n THR 58 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1l6l n GLU 59 N -1.49 0.00 -0.10 1.09 1.02 -1.03 -4.38 120.64 115.75 1l6l n GLU 59 Ca 0.07 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.14 1l6l n GLU 59 Cb 0.34 0.00 0.09 0.00 -0.02 0.00 0.00 31.44 31.85 1l6l n GLU 59 CO 0.00 0.00 0.00 1.37 1.18 0.00 0.00 177.13 179.68 1l6l h LEU 60 N 0.00 0.81 -0.51 -4.62 -0.00 -1.80 -2.42 115.31 106.77 1l6l h LEU 60 Ca 0.00 -0.27 -0.04 0.00 -0.00 0.00 0.00 57.88 57.57 1l6l h LEU 60 Cb 0.00 -0.22 -0.02 0.00 -0.00 0.00 0.00 40.66 40.42 1l6l h LEU 60 CO 0.00 0.97 0.15 0.58 -0.00 0.00 0.00 178.44 180.14 1l6l h VAL 61 N 0.72 1.23 -0.27 0.15 2.07 -1.65 -0.98 116.25 117.52 1l6l h VAL 61 Ca 0.11 -0.80 -0.19 0.00 0.82 0.00 0.00 66.70 66.65 1l6l h VAL 61 Cb 0.67 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1l6l h VAL 61 CO 0.05 0.29 -0.56 -1.13 0.02 0.00 0.00 177.57 176.24 1l6l h ASN 62 N 0.70 0.94 1.23 0.57 -1.24 -1.36 -3.08 115.58 113.34 1l6l h ASN 62 Ca 0.16 -0.51 0.00 0.00 0.71 0.00 0.00 56.30 56.67 1l6l h ASN 62 Cb 0.29 -0.27 0.00 0.00 0.73 0.00 0.00 38.32 39.07 1l6l h ASN 62 CO -0.00 1.30 0.00 -0.26 -1.29 0.00 0.00 177.43 177.18 1l6l h PHE 63 N 0.64 0.00 -0.99 0.67 0.04 -1.36 -3.25 116.94 112.70 1l6l h PHE 63 Ca 0.01 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.79 1l6l h PHE 63 Cb 1.16 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 39.26 1l6l h PHE 63 CO 0.07 0.00 0.65 1.25 -0.60 0.00 0.00 178.31 179.68 1l6l h LEU 64 N 0.00 1.14 -0.81 1.54 5.85 -1.08 -2.45 115.31 119.50 1l6l h LEU 64 Ca 0.00 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.69 1l6l h LEU 64 Cb 0.61 -0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.36 1l6l h LEU 64 CO 0.00 0.83 0.00 -0.24 -0.34 0.00 0.00 178.44 178.69 1l6l n SER 65 N -4.39 0.47 0.00 1.25 2.88 -1.23 -3.83 113.62 108.78 1l6l n SER 65 Ca 0.12 0.66 0.00 0.00 -1.33 0.00 0.00 58.87 58.32 1l6l n SER 65 Cb 0.01 -0.74 0.00 0.00 -0.75 0.00 0.00 64.21 62.73 1l6l n SER 65 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1l6l n TYR 66 N -2.07 0.00 -2.77 0.66 4.02 -0.92 -4.71 117.16 111.36 1l6l n TYR 66 Ca 0.01 0.00 -0.43 0.00 -0.01 0.00 0.00 57.90 57.47 1l6l n TYR 66 Cb 0.12 -0.44 -0.03 0.00 -0.02 0.00 0.00 39.34 38.97 1l6l n TYR 66 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 1l6l s PHE 67 N -0.88 2.75 0.00 -0.72 2.99 -1.25 -4.44 117.98 116.42 1l6l s PHE 67 Ca 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 56.93 56.08 1l6l s PHE 67 Cb 0.00 -4.43 0.00 0.00 0.00 0.00 0.00 43.02 38.59 1l6l s PHE 67 CO 0.00 -1.72 0.00 0.28 -0.00 0.00 0.00 175.22 173.78 1l6l n VAL 68 N 6.06 0.00 -1.69 -0.44 0.31 -1.26 -4.99 118.33 116.31 1l6l n VAL 68 Ca 0.15 0.00 -0.44 0.00 -0.01 0.00 0.00 64.34 64.04 1l6l n VAL 68 Cb 0.48 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.38 1l6l n VAL 68 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1l6l n GLU 69 N -1.05 2.46 -1.20 5.55 1.02 -1.26 -4.99 120.64 121.17 1l6l n GLU 69 Ca 0.00 0.89 0.00 0.00 -0.02 0.00 0.00 57.16 58.03 1l6l n GLU 69 Cb 0.00 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 28.73 1l6l n GLU 69 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 1l6l n LEU 70 N 3.62 0.00 -3.79 -4.62 4.77 -1.26 -5.19 117.00 110.53 1l6l n LEU 70 Ca 0.16 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 56.02 1l6l n LEU 70 Cb 0.32 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.32 1l6l n LEU 70 CO 0.64 0.00 -0.03 -0.83 -1.33 0.00 0.00 177.39 175.84 1l6l s GLY 71 N -0.60 -0.09 -0.27 -0.72 0.00 -1.26 -5.15 107.32 99.22 1l6l s GLY 71 Ca 0.00 0.15 -0.02 0.00 0.00 0.00 0.00 44.72 44.85 1l6l s GLY 71 CO 0.00 -0.04 0.51 -1.08 0.00 0.00 0.00 173.10 172.49 1l6l s THR 72 N -1.51 -0.83 -0.40 0.90 -1.32 -1.26 -5.06 115.64 106.16 1l6l s THR 72 Ca -0.13 -0.02 0.06 0.00 -1.21 0.00 0.00 61.69 60.39 1l6l s THR 72 Cb -0.05 -0.91 0.31 0.00 -1.51 0.00 0.00 72.50 70.34 1l6l s THR 72 CO 0.03 -0.04 1.23 0.00 -2.21 0.00 0.00 174.62 173.62 1l6l n GLN 73 N 5.40 0.82 -2.49 7.08 0.00 -1.26 -5.14 117.38 121.79 1l6l n GLN 73 Ca -0.03 -1.54 -0.42 0.00 0.00 0.00 0.00 57.00 55.00 1l6l n GLN 73 Cb 0.50 -0.49 -0.03 0.00 0.00 0.00 0.00 30.24 30.22 1l6l n GLN 73 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1l6l s PRO 74 N 0.18 4.41 -0.27 2.61 0.04 -1.26 -5.25 135.00 135.45 1l6l s PRO 74 Ca 0.20 1.66 -0.25 0.00 0.04 0.00 0.00 61.00 62.64 1l6l s PRO 74 Cb 0.30 -3.48 0.12 0.00 0.04 0.00 0.00 34.50 31.47 1l6l s PRO 74 CO -0.08 -0.33 1.00 0.00 0.04 0.00 0.00 177.00 177.63 1l6l s ALA 75 N 1.70 -1.95 0.00 8.56 0.00 -1.26 -5.37 121.76 123.44 1l6l s ALA 75 Ca 0.56 1.86 0.00 0.00 0.00 0.00 0.00 51.96 54.38 1l6l s ALA 75 Cb -0.25 -1.35 0.00 0.00 0.00 0.00 0.00 23.12 21.52 1l6l s ALA 75 CO 0.25 -0.25 0.00 0.94 0.00 0.00 0.00 175.76 176.70