#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1l8y n LYS 2 N 0.00 -3.52 -3.22 1.61 3.00 -1.26 -4.92 118.16 109.85 1l8y n LYS 2 Ca 0.00 2.86 -0.09 0.00 -0.00 0.00 0.00 58.31 61.08 1l8y n LYS 2 Cb 0.00 -4.01 0.03 0.00 0.00 0.00 0.00 35.03 31.04 1l8y n LYS 2 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.40 178.87 1l8y n LEU 3 N -4.21 -5.78 0.10 3.14 -0.00 -1.26 -4.96 117.00 104.03 1l8y n LEU 3 Ca -0.09 -0.42 -0.10 0.00 -0.00 0.00 0.00 56.01 55.39 1l8y n LEU 3 Cb 0.68 -3.10 -0.07 0.00 -0.00 0.00 0.00 43.42 40.93 1l8y n LEU 3 CO 0.04 -0.48 0.37 1.55 -0.00 0.00 0.00 177.39 178.86 1l8y h PRO 4 N -0.32 -0.32 0.00 1.47 0.13 -1.84 -3.46 132.00 127.66 1l8y h PRO 4 Ca -0.30 0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1l8y h PRO 4 Cb 1.16 0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1l8y h PRO 4 CO 0.37 0.02 0.00 -1.91 -0.23 0.00 0.00 178.00 176.25 1l8y n GLU 5 N -5.01 0.00 -0.35 0.86 2.13 -1.26 -4.94 120.64 112.07 1l8y n GLU 5 Ca -0.08 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.70 1l8y n GLU 5 Cb 0.25 0.00 -0.01 0.00 0.27 0.00 0.00 31.44 31.95 1l8y n GLU 5 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 1l8y n SER 6 N 0.00 -0.70 -4.61 4.31 2.88 -1.26 -4.59 113.62 109.64 1l8y n SER 6 Ca 0.00 1.55 -0.51 0.00 -1.33 0.00 0.00 58.87 58.58 1l8y n SER 6 Cb 0.00 -0.30 -0.06 0.00 -0.75 0.00 0.00 64.21 63.11 1l8y n SER 6 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1l8y n PRO 7 N -5.23 1.39 -0.56 -1.46 -0.04 -1.26 -4.84 135.00 123.01 1l8y n PRO 7 Ca 0.06 0.50 -0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1l8y n PRO 7 Cb 0.31 -2.18 -0.00 0.00 -0.04 0.00 0.00 33.50 31.59 1l8y n PRO 7 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1l8y n LYS 8 N 2.85 0.00 0.00 0.54 3.00 -1.23 -4.71 118.16 118.62 1l8y n LYS 8 Ca 0.18 -0.31 0.00 0.00 -0.00 0.00 0.00 58.31 58.18 1l8y n LYS 8 Cb 0.21 -0.07 0.00 0.00 0.00 0.00 0.00 35.03 35.18 1l8y n LYS 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 1l8y n ARG 9 N 0.01 0.00 0.00 1.64 5.12 0.42 -3.32 116.66 120.54 1l8y n ARG 9 Ca -0.02 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.90 1l8y n ARG 9 Cb 0.57 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.87 1l8y n ARG 9 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1l8y n ALA 10 N 6.68 0.00 -0.51 7.54 0.00 -0.97 -0.15 120.51 133.11 1l8y n ALA 10 Ca 0.00 0.00 0.44 0.00 0.00 0.00 0.00 53.44 53.88 1l8y n ALA 10 Cb 0.00 0.00 0.69 0.00 0.00 0.00 0.00 19.45 20.14 1l8y n ALA 10 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1l8y h GLU 11 N 0.00 0.00 0.00 0.00 5.08 -1.63 -2.33 114.58 115.70 1l8y h GLU 11 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1l8y h GLU 11 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1l8y h GLU 11 CO 0.00 0.00 0.00 -1.91 -1.00 0.00 0.00 179.01 176.10 1l8y n GLU 12 N -3.71 0.00 -0.28 2.33 0.00 1.71 -1.54 120.64 119.15 1l8y n GLU 12 Ca 0.36 0.25 0.01 0.00 0.00 0.00 0.00 57.16 57.78 1l8y n GLU 12 Cb 1.80 -0.90 0.07 0.00 0.00 0.00 0.00 31.44 32.42 1l8y n GLU 12 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.13 178.10 1l8y h ILE 13 N 0.00 0.15 0.13 6.31 6.09 -0.53 -1.13 117.51 128.54 1l8y h ILE 13 Ca 0.00 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.48 1l8y h ILE 13 Cb 0.00 0.15 0.00 0.00 0.47 0.00 0.00 36.82 37.45 1l8y h ILE 13 CO 0.00 0.00 -0.06 -0.25 -3.07 0.00 0.00 178.15 174.77 1l8y h TRP 14 N -0.03 -0.16 -0.40 2.19 7.01 -1.60 -2.11 115.95 120.84 1l8y h TRP 14 Ca 0.35 -0.00 0.04 0.00 2.11 0.00 0.00 58.89 61.39 1l8y h TRP 14 Cb 0.59 0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 27.64 1l8y h TRP 14 CO -0.67 -0.10 -0.33 0.37 -2.79 0.00 0.00 178.44 174.91 1l8y h GLN 15 N -0.45 -0.11 -1.04 2.65 4.15 -1.22 1.03 115.11 120.11 1l8y h GLN 15 Ca -0.02 0.01 0.28 0.00 0.77 0.00 0.00 58.65 59.69 1l8y h GLN 15 Cb 0.13 0.03 -0.07 0.00 0.21 0.00 0.00 27.48 27.78 1l8y h GLN 15 CO 0.03 -0.08 0.71 0.37 -1.93 0.00 0.00 178.83 177.94 1l8y h GLN 16 N -0.12 0.20 -0.04 1.69 4.15 -1.28 1.25 115.11 120.95 1l8y h GLN 16 Ca 0.07 -0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.36 1l8y h GLN 16 Cb 0.29 -0.04 0.01 0.00 0.21 0.00 0.00 27.48 27.95 1l8y h GLN 16 CO -0.44 0.13 -0.44 1.03 -1.93 0.00 0.00 178.83 177.18 1l8y h SER 17 N 0.20 0.46 0.00 -0.69 0.87 0.14 -3.34 113.55 111.20 1l8y h SER 17 Ca 0.54 -0.70 -0.06 0.00 -1.23 0.00 0.00 61.79 60.34 1l8y h SER 17 Cb 1.74 -0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 63.55 1l8y h SER 17 CO -0.15 1.09 -0.54 -0.37 -0.53 0.00 0.00 176.83 176.34 1l8y h VAL 18 N -0.14 0.51 -0.91 2.23 -1.51 0.22 -3.38 116.25 113.27 1l8y h VAL 18 Ca -0.04 -1.52 0.33 0.00 -1.23 0.00 0.00 66.70 64.24 1l8y h VAL 18 Cb 1.12 1.09 -0.11 0.00 -2.13 0.00 0.00 31.29 31.27 1l8y h VAL 18 CO 0.09 0.17 0.57 0.00 -1.23 0.00 0.00 177.57 177.17 1l8y n ILE 19 N -4.60 -0.21 -0.23 7.19 3.06 0.41 0.11 119.36 125.09 1l8y n ILE 19 Ca -0.13 1.33 -0.02 0.00 -2.50 0.00 0.00 62.75 61.43 1l8y n ILE 19 Cb 0.35 -2.18 0.09 0.00 0.54 0.00 0.00 39.64 38.45 1l8y n ILE 19 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 1l8y h GLY 20 N 0.00 0.96 1.70 4.50 0.00 -1.73 1.22 103.07 109.73 1l8y h GLY 20 Ca 0.62 -0.26 -0.19 0.00 0.00 0.00 0.00 47.33 47.50 1l8y h GLY 20 CO -0.39 0.17 -1.02 -1.80 0.00 0.00 0.00 176.54 173.50 1l8y h ASP 21 N 0.70 0.00 0.43 0.19 3.58 0.58 -2.40 116.42 119.50 1l8y h ASP 21 Ca 0.29 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.53 1l8y h ASP 21 Cb 0.16 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.20 1l8y h ASP 21 CO -0.17 0.79 -0.88 1.88 -2.88 0.00 0.00 179.24 177.98 1l8y h TYR 22 N 0.00 0.46 0.01 0.28 0.05 -0.74 -2.52 116.97 114.51 1l8y h TYR 22 Ca -0.07 -0.24 -0.19 0.00 0.05 0.00 0.00 58.73 58.27 1l8y h TYR 22 Cb 1.67 -0.05 -0.02 0.00 1.01 0.00 0.00 36.73 39.33 1l8y h TYR 22 CO 0.00 1.05 -0.89 -0.07 -1.05 0.00 0.00 178.16 177.20 1l8y h LEU 23 N 0.18 0.11 0.03 3.88 3.38 0.14 -3.31 115.31 119.72 1l8y h LEU 23 Ca -0.06 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.82 1l8y h LEU 23 Cb 1.50 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 42.22 1l8y h LEU 23 CO 0.14 0.94 -0.01 0.00 0.09 0.00 0.00 178.44 179.60 1l8y h ALA 24 N 1.05 -0.04 -0.88 1.53 0.00 -1.36 0.87 119.26 120.43 1l8y h ALA 24 Ca -0.03 -0.11 0.18 0.00 0.00 0.00 0.00 54.91 54.95 1l8y h ALA 24 Cb 1.55 0.01 -0.17 0.00 0.00 0.00 0.00 17.79 19.19 1l8y h ALA 24 CO 0.12 -0.42 -0.22 0.07 0.00 0.00 0.00 179.25 178.81 1l8y h ARG 25 N -0.24 -0.00 0.02 0.00 0.11 -1.54 -2.90 114.38 109.82 1l8y h ARG 25 Ca -0.00 0.00 -0.39 0.00 0.10 0.00 0.00 59.98 59.69 1l8y h ARG 25 Cb 0.23 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 31.24 1l8y h ARG 25 CO 0.01 -0.00 -2.41 0.34 0.10 0.00 0.00 179.97 178.00 1l8y n PHE 26 N -5.57 0.16 -1.07 4.08 -0.00 -1.23 -5.08 117.46 108.76 1l8y n PHE 26 Ca 0.13 0.04 0.00 0.00 -0.00 0.00 0.00 57.45 57.62 1l8y n PHE 26 Cb 0.44 -1.02 0.00 0.00 -0.00 0.00 0.00 39.48 38.90 1l8y n PHE 26 CO 0.00 0.00 0.00 1.17 -0.00 0.00 0.00 176.76 177.93 1l8y n LYS 27 N -3.26 0.00 -1.48 -4.13 3.00 0.30 -4.73 118.16 107.86 1l8y n LYS 27 Ca -0.44 0.36 -0.00 0.00 -0.00 0.00 0.00 58.31 58.23 1l8y n LYS 27 Cb 1.00 -0.71 -0.00 0.00 0.00 0.00 0.00 35.03 35.32 1l8y n LYS 27 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 1l8y n ASN 28 N 0.00 -2.08 -0.59 3.14 5.15 -1.14 -4.93 115.26 114.80 1l8y n ASN 28 Ca 0.00 0.00 0.06 0.00 -0.60 0.00 0.00 54.58 54.04 1l8y n ASN 28 Cb 0.00 -0.54 0.12 0.00 -0.53 0.00 0.00 39.78 38.83 1l8y n ASN 28 CO 0.00 0.00 0.00 -0.67 1.40 0.00 0.00 177.26 177.99 1l8y n ASP 29 N 1.97 2.64 0.00 1.20 -0.08 -1.26 -4.80 116.55 116.21 1l8y n ASP 29 Ca -0.00 -1.84 0.00 0.00 -1.51 0.00 0.00 54.79 51.44 1l8y n ASP 29 Cb 0.24 -0.16 0.00 0.00 2.34 0.00 0.00 41.12 43.54 1l8y n ASP 29 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 1l8y n ARG 30 N 0.57 0.00 -0.39 -0.67 0.63 -1.26 -0.93 116.66 114.60 1l8y n ARG 30 Ca 0.10 0.00 0.34 0.00 -0.92 0.00 0.00 57.85 57.37 1l8y n ARG 30 Cb 0.39 0.00 0.57 0.00 0.45 0.00 0.00 32.46 33.87 1l8y n ARG 30 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 1l8y n VAL 31 N -2.39 -0.24 0.03 5.15 0.31 -1.26 0.34 118.33 120.28 1l8y n VAL 31 Ca 0.00 1.58 -0.16 0.00 -0.01 0.00 0.00 64.34 65.75 1l8y n VAL 31 Cb 0.00 -2.59 -0.14 0.00 -0.91 0.00 0.00 33.84 30.20 1l8y n VAL 31 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1l8y h LYS 32 N 0.00 0.20 0.05 5.55 1.57 -1.42 -3.36 116.57 119.16 1l8y h LYS 32 Ca 0.76 -0.34 0.03 0.00 -1.87 0.00 0.00 60.65 59.22 1l8y h LYS 32 Cb 2.38 0.13 -0.05 0.00 0.08 0.00 0.00 32.23 34.77 1l8y h LYS 32 CO -0.44 1.01 -0.34 0.00 -0.57 0.00 0.00 179.45 179.11 1l8y h ALA 33 N 0.51 -0.54 -0.80 3.86 0.00 0.56 0.26 119.26 123.11 1l8y h ALA 33 Ca -0.29 -0.04 0.17 0.00 0.00 0.00 0.00 54.91 54.76 1l8y h ALA 33 Cb 2.02 0.59 -0.11 0.00 0.00 0.00 0.00 17.79 20.28 1l8y h ALA 33 CO 0.13 -0.87 0.29 1.25 0.00 0.00 0.00 179.25 180.04 1l8y h LEU 34 N -0.53 0.20 0.01 0.00 6.46 -1.04 -1.68 115.31 118.73 1l8y h LEU 34 Ca 0.05 0.14 -0.00 0.00 -0.12 0.00 0.00 57.88 57.94 1l8y h LEU 34 Cb 0.59 0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.66 1l8y h LEU 34 CO -0.24 0.02 -0.01 0.11 -0.62 0.00 0.00 178.44 177.70 1l8y h LYS 35 N 0.37 -0.02 -1.07 1.25 1.79 -1.57 1.07 116.57 118.40 1l8y h LYS 35 Ca 0.46 0.00 0.31 0.00 -2.18 0.00 0.00 60.65 59.24 1l8y h LYS 35 Cb 0.79 0.00 -0.04 0.00 -1.58 0.00 0.00 32.23 31.40 1l8y h LYS 35 CO -0.48 0.46 0.79 0.00 -1.08 0.00 0.00 179.45 179.14 1l8y h ALA 36 N 0.46 2.99 0.08 3.86 0.00 -0.35 0.78 119.26 127.08 1l8y h ALA 36 Ca -0.00 -0.04 -0.37 0.00 0.00 0.00 0.00 54.91 54.50 1l8y h ALA 36 Cb 0.49 0.08 -0.04 0.00 0.00 0.00 0.00 17.79 18.33 1l8y h ALA 36 CO 0.00 -1.34 -2.12 -0.12 0.00 0.00 0.00 179.25 175.67 1l8y n MET 37 N -4.14 0.71 0.17 0.00 0.00 -0.69 -3.78 117.12 109.40 1l8y n MET 37 Ca 0.23 0.25 -0.07 0.00 -0.00 0.00 0.00 57.70 58.10 1l8y n MET 37 Cb 1.15 -1.65 -0.04 0.00 0.00 0.00 0.00 33.22 32.69 1l8y n MET 37 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 175.97 177.46 1l8y h GLU 38 N -0.04 -0.44 -0.23 2.12 4.81 0.34 -1.15 114.58 119.99 1l8y h GLU 38 Ca -0.48 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 58.84 1l8y h GLU 38 Cb 1.94 0.10 -0.07 0.00 0.63 0.00 0.00 28.75 31.35 1l8y h GLU 38 CO 0.00 -0.29 -0.27 0.52 -0.73 0.00 0.00 179.01 178.24 1l8y h MET 39 N -0.46 -0.28 0.00 1.92 2.86 -1.31 0.19 114.93 117.85 1l8y h MET 39 Ca -0.04 0.02 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 1l8y h MET 39 Cb 0.36 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.08 1l8y h MET 39 CO 0.06 -0.19 0.10 1.15 1.06 0.00 0.00 176.91 179.10 1l8y h THR 40 N -0.29 0.00 0.10 2.22 2.02 -1.65 1.03 112.91 116.34 1l8y h THR 40 Ca 0.13 0.00 -0.24 0.00 0.77 0.00 0.00 66.41 67.07 1l8y h THR 40 Cb 0.49 0.59 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 1l8y h THR 40 CO -0.39 0.00 -1.23 -0.25 0.37 0.00 0.00 175.52 174.01 1l8y h TRP 41 N 0.00 0.37 0.00 3.16 2.91 0.67 -3.34 115.95 119.72 1l8y h TRP 41 Ca 0.00 -0.27 -0.13 0.00 1.13 0.00 0.00 58.89 59.61 1l8y h TRP 41 Cb 0.20 -0.01 -0.02 0.00 -0.51 0.00 0.00 29.16 28.82 1l8y h TRP 41 CO 0.00 1.48 -0.77 -2.95 -1.03 0.00 0.00 178.44 175.17 1l8y h ASN 42 N -0.44 0.00 0.00 2.65 7.08 -0.58 -3.12 115.58 121.18 1l8y h ASN 42 Ca -0.27 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 52.95 1l8y h ASN 42 Cb 1.64 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.88 1l8y h ASN 42 CO 0.03 0.59 0.05 0.78 -2.08 0.00 0.00 177.43 176.81 1l8y h ASN 43 N 0.00 0.00 0.00 6.14 2.35 0.92 -3.33 115.58 121.66 1l8y h ASN 43 Ca -0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.71 1l8y h ASN 43 Cb 1.49 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.86 1l8y h ASN 43 CO 0.07 0.00 0.00 0.80 -1.65 0.00 0.00 177.43 176.65 1l8y n MET 44 N -2.98 0.00 -3.97 0.81 1.56 -1.18 -5.05 117.12 106.31 1l8y n MET 44 Ca -0.03 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.40 1l8y n MET 44 Cb 0.11 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.48 1l8y n MET 44 CO 0.00 0.00 0.00 -0.85 -0.73 0.00 0.00 175.97 174.39 1l8y n GLU 45 N 0.00 -0.07 0.31 2.12 0.28 -1.25 -4.93 120.64 117.10 1l8y n GLU 45 Ca 0.00 0.00 0.15 0.00 -0.16 0.00 0.00 57.16 57.15 1l8y n GLU 45 Cb 0.00 0.00 0.76 0.00 1.43 0.00 0.00 31.44 33.63 1l8y n GLU 45 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 177.13 176.75 1l8y h LYS 46 N 0.00 0.00 0.11 3.44 1.63 -1.95 -2.80 116.57 117.00 1l8y h LYS 46 Ca 0.00 0.00 -0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1l8y h LYS 46 Cb 0.00 0.00 -0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1l8y h LYS 46 CO 0.00 0.00 -0.07 -0.22 -3.45 0.00 0.00 179.45 175.71 1l8y h LYS 47 N 0.00 -0.16 0.00 1.90 3.64 -1.96 -2.99 116.57 117.00 1l8y h LYS 47 Ca 0.02 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1l8y h LYS 47 Cb 0.81 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.66 1l8y h LYS 47 CO -0.00 -0.11 0.00 0.39 -2.27 0.00 0.00 179.45 177.46 1l8y n GLU 48 N -2.59 0.00 0.00 1.90 -0.58 -1.07 -2.62 120.64 115.68 1l8y n GLU 48 Ca -0.02 0.20 0.00 0.00 -0.42 0.00 0.00 57.16 56.92 1l8y n GLU 48 Cb 0.07 -1.04 0.00 0.00 -0.57 0.00 0.00 31.44 29.89 1l8y n GLU 48 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1l8y n LYS 49 N -1.09 0.00 0.06 3.49 5.02 -1.16 0.23 118.16 124.70 1l8y n LYS 49 Ca 0.00 0.31 -0.13 0.00 -2.02 0.00 0.00 58.31 56.46 1l8y n LYS 49 Cb 0.00 -0.51 -0.07 0.00 -0.02 0.00 0.00 35.03 34.43 1l8y n LYS 49 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 1l8y h LEU 50 N 0.00 -1.26 -2.13 -0.35 7.12 -1.71 -1.41 115.31 115.57 1l8y h LEU 50 Ca 0.00 0.15 0.08 0.00 0.13 0.00 0.00 57.88 58.24 1l8y h LEU 50 Cb 0.00 0.49 -0.01 0.00 -0.53 0.00 0.00 40.66 40.61 1l8y h LEU 50 CO 0.00 -0.45 0.24 0.24 -0.13 0.00 0.00 178.44 178.34 1l8y h MET 51 N -0.56 0.00 -0.19 1.25 2.86 -1.00 0.29 114.93 117.58 1l8y h MET 51 Ca 0.05 0.00 -0.10 0.00 -2.06 0.00 0.00 59.70 57.59 1l8y h MET 51 Cb 0.65 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.29 1l8y h MET 51 CO -0.32 0.00 -0.30 -1.49 1.06 0.00 0.00 176.91 175.86 1l8y h TRP 52 N 0.00 0.42 -0.08 -0.22 4.06 0.90 -2.67 115.95 118.36 1l8y h TRP 52 Ca 0.12 -0.09 0.04 0.00 2.06 0.00 0.00 58.89 61.02 1l8y h TRP 52 Cb 0.60 -0.10 -0.06 0.00 -1.00 0.00 0.00 29.16 28.61 1l8y h TRP 52 CO 0.00 0.64 -0.29 0.82 -3.56 0.00 0.00 178.44 176.05 1l8y h ILE 53 N 0.33 0.35 0.00 1.49 2.04 -0.08 -1.86 117.51 119.78 1l8y h ILE 53 Ca 0.04 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 65.85 1l8y h ILE 53 Cb 0.70 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.12 1l8y h ILE 53 CO 0.05 0.00 -0.25 0.50 0.00 0.00 0.00 178.15 178.45 1l8y h LYS 54 N -0.39 0.00 -0.11 2.37 3.64 -1.50 1.43 116.57 122.02 1l8y h LYS 54 Ca 0.08 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1l8y h LYS 54 Cb 0.52 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.33 1l8y h LYS 54 CO -0.30 0.25 0.06 -0.22 -2.27 0.00 0.00 179.45 176.97 1l8y h LYS 55 N 0.00 0.15 0.00 1.90 3.11 -1.00 2.24 116.57 122.97 1l8y h LYS 55 Ca -0.00 -0.02 -0.09 0.00 -2.81 0.00 0.00 60.65 57.73 1l8y h LYS 55 Cb 0.47 -0.03 -0.01 0.00 -1.00 0.00 0.00 32.23 31.66 1l8y h LYS 55 CO 0.03 0.18 -0.72 0.00 -2.81 0.00 0.00 179.45 176.13 1l8y h ALA 56 N 0.96 0.70 0.00 5.00 0.00 -1.21 -2.34 119.26 122.38 1l8y h ALA 56 Ca 0.04 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.38 1l8y h ALA 56 Cb 0.07 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 1l8y h ALA 56 CO -0.01 0.50 -0.76 0.00 0.00 0.00 0.00 179.25 178.98 1l8y h ALA 57 N 1.64 0.70 -0.02 0.00 0.00 0.23 0.88 119.26 122.68 1l8y h ALA 57 Ca -0.04 -0.69 -0.15 0.00 0.00 0.00 0.00 54.91 54.02 1l8y h ALA 57 Cb 1.31 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.96 1l8y h ALA 57 CO 0.04 0.95 -0.68 1.49 0.00 0.00 0.00 179.25 181.05 1l8y h GLU 58 N 0.00 0.11 0.00 0.00 4.57 0.38 -2.55 114.58 117.09 1l8y h GLU 58 Ca -0.01 -0.09 -0.11 0.00 -1.18 0.00 0.00 59.36 57.98 1l8y h GLU 58 Cb 1.38 0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 29.97 1l8y h GLU 58 CO 0.10 0.75 -0.51 0.22 -1.18 0.00 0.00 179.01 178.39 1l8y h ASP 59 N 0.08 0.00 0.00 1.04 3.58 -0.82 -3.19 116.42 117.10 1l8y h ASP 59 Ca -0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.44 1l8y h ASP 59 Cb 1.21 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.26 1l8y h ASP 59 CO 0.10 0.51 0.07 -0.61 -2.88 0.00 0.00 179.24 176.42 1l8y h GLN 60 N 0.00 0.00 -0.96 0.28 4.15 0.12 -2.36 115.11 116.33 1l8y h GLN 60 Ca -0.01 0.00 0.18 0.00 0.77 0.00 0.00 58.65 59.59 1l8y h GLN 60 Cb 1.35 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.96 1l8y h GLN 60 CO 0.07 0.00 0.61 -0.22 -1.93 0.00 0.00 178.83 177.35 1l8y h LYS 61 N 0.00 0.67 -0.48 1.69 1.63 -1.64 2.34 116.57 120.78 1l8y h LYS 61 Ca 0.00 -0.04 -0.11 0.00 -0.85 0.00 0.00 60.65 59.65 1l8y h LYS 61 Cb 0.13 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.59 1l8y h LYS 61 CO 0.00 0.44 -0.15 -0.09 -3.45 0.00 0.00 179.45 176.20 1l8y h ARG 62 N 0.69 0.92 -0.00 1.90 9.65 -1.71 -3.16 114.38 122.67 1l8y h ARG 62 Ca 0.52 -0.35 0.00 0.00 -1.10 0.00 0.00 59.98 59.05 1l8y h ARG 62 Cb 0.90 -0.05 0.00 0.00 -1.39 0.00 0.00 29.97 29.42 1l8y h ARG 62 CO -0.28 1.00 -0.89 0.66 2.80 0.00 0.00 179.97 183.26 1l8y n TYR 63 N -4.13 0.00 -0.16 2.20 4.02 -0.34 -4.41 117.16 114.34 1l8y n TYR 63 Ca 0.01 0.00 -0.02 0.00 -0.01 0.00 0.00 57.90 57.88 1l8y n TYR 63 Cb 0.41 0.00 0.05 0.00 -0.02 0.00 0.00 39.34 39.79 1l8y n TYR 63 CO 0.00 0.00 0.00 1.05 -1.01 0.00 0.00 176.86 176.90 1l8y h GLU 64 N 0.50 0.09 0.00 -0.72 4.11 0.39 0.52 114.58 119.48 1l8y h GLU 64 Ca 0.00 -0.01 -0.03 0.00 0.07 0.00 0.00 59.36 59.40 1l8y h GLU 64 Cb 0.55 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.78 1l8y h GLU 64 CO 0.00 0.06 -0.12 0.00 0.07 0.00 0.00 179.01 179.02 1l8y h ARG 65 N 0.09 0.00 -0.42 1.06 -0.00 -1.77 -0.87 114.38 112.48 1l8y h ARG 65 Ca 0.25 0.00 0.07 0.00 -0.50 0.00 0.00 59.98 59.80 1l8y h ARG 65 Cb 0.38 0.00 -0.06 0.00 0.00 0.00 0.00 29.97 30.28 1l8y h ARG 65 CO -0.43 0.12 0.03 0.93 0.00 0.00 0.00 179.97 180.62 1l8y h GLU 66 N 0.00 0.14 0.00 0.04 4.39 -0.18 1.01 114.58 119.98 1l8y h GLU 66 Ca -0.00 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1l8y h GLU 66 Cb 0.23 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1l8y h GLU 66 CO 0.02 0.09 -0.00 1.25 -1.16 0.00 0.00 179.01 179.21 1l8y h LEU 67 N 0.15 -0.00 -1.91 1.33 6.46 -1.24 0.03 115.31 120.12 1l8y h LEU 67 Ca 0.21 -0.78 0.24 0.00 -0.12 0.00 0.00 57.88 57.43 1l8y h LEU 67 Cb 0.28 0.00 -0.03 0.00 -0.73 0.00 0.00 40.66 40.18 1l8y h LEU 67 CO -0.31 0.88 0.70 -1.28 -0.62 0.00 0.00 178.44 177.80 1l8y h SER 68 N -0.99 0.00 0.21 1.25 0.87 -1.03 0.75 113.55 114.61 1l8y h SER 68 Ca -0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.55 1l8y h SER 68 Cb 0.78 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.73 1l8y h SER 68 CO 0.00 0.00 -1.80 -1.84 -0.53 0.00 0.00 176.83 172.66 1l8y n GLU 69 N -3.97 0.65 0.14 2.24 0.28 0.35 -3.97 120.64 116.36 1l8y n GLU 69 Ca 0.17 -0.12 -0.25 0.00 -0.16 0.00 0.00 57.16 56.81 1l8y n GLU 69 Cb 0.99 -1.59 -0.16 0.00 1.43 0.00 0.00 31.44 32.12 1l8y n GLU 69 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 177.13 177.49 1l8y h MET 70 N 0.00 0.54 -0.54 3.44 2.86 0.24 -3.28 114.93 118.19 1l8y h MET 70 Ca -0.02 -0.91 0.00 0.00 -2.06 0.00 0.00 59.70 56.71 1l8y h MET 70 Cb 1.05 0.34 0.00 0.00 0.06 0.00 0.00 31.60 33.05 1l8y h MET 70 CO 0.00 1.44 0.00 0.54 1.06 0.00 0.00 176.91 179.95 1l8y n ARG 71 N -3.74 2.33 -3.82 1.72 3.00 0.81 -4.95 116.66 112.00 1l8y n ARG 71 Ca -0.17 -1.48 -0.13 0.00 -0.01 0.00 0.00 57.85 56.06 1l8y n ARG 71 Cb 1.09 -1.53 0.01 0.00 0.00 0.00 0.00 32.46 32.03 1l8y n ARG 71 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1l8y n ALA 72 N 0.51 -1.43 -0.07 7.54 0.00 -1.24 -4.79 120.51 121.03 1l8y n ALA 72 Ca 0.13 -0.16 -0.08 0.00 0.00 0.00 0.00 53.44 53.34 1l8y n ALA 72 Cb 0.49 -0.68 -0.01 0.00 0.00 0.00 0.00 19.45 19.25 1l8y n ALA 72 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 1l8y h PRO 73 N 1.58 0.16 -0.93 0.00 0.11 -1.90 -1.69 132.00 129.34 1l8y h PRO 73 Ca -0.19 -0.01 -0.27 0.00 0.11 0.00 0.00 66.00 65.63 1l8y h PRO 73 Cb 0.38 -0.04 -0.16 0.00 0.11 0.00 0.00 31.00 31.29 1l8y h PRO 73 CO 0.14 0.11 0.35 -0.35 -0.21 0.00 0.00 178.00 178.03 1l8y n PRO 74 N -5.08 2.36 -3.07 1.05 -0.04 -1.26 -4.36 135.00 124.60 1l8y n PRO 74 Ca -0.01 -2.15 -0.16 0.00 -0.04 0.00 0.00 63.50 61.15 1l8y n PRO 74 Cb 0.11 -1.89 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 1l8y n PRO 74 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1l8y n ALA 75 N -0.38 1.31 -1.03 0.55 0.00 -0.63 -2.95 120.51 117.37 1l8y n ALA 75 Ca 0.37 -2.90 -0.23 0.00 0.00 0.00 0.00 53.44 50.67 1l8y n ALA 75 Cb 1.23 -0.99 0.14 0.00 0.00 0.00 0.00 19.45 19.83 1l8y n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1l8y n ALA 76 N 0.29 5.44 -2.33 0.00 0.00 -1.24 -4.81 120.51 117.86 1l8y n ALA 76 Ca 0.20 -2.67 -0.04 0.00 0.00 0.00 0.00 53.44 50.93 1l8y n ALA 76 Cb 0.67 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1l8y n ALA 76 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1l8y n THR 77 N -0.87 -0.30 0.00 0.00 -1.04 -1.26 -4.75 114.28 106.05 1l8y n THR 77 Ca 0.53 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.54 1l8y n THR 77 Cb 1.31 -1.34 0.00 0.00 -1.82 0.00 0.00 70.33 68.48 1l8y n THR 77 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1l8y n ASN 78 N 1.09 0.00 -0.41 8.00 3.02 -1.26 -4.91 115.26 120.79 1l8y n ASN 78 Ca -0.02 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.57 1l8y n ASN 78 Cb 0.52 0.00 0.12 0.00 -0.61 0.00 0.00 39.78 39.81 1l8y n ASN 78 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1l8y n SER 79 N -0.72 1.18 0.08 6.41 7.64 -1.26 -4.33 113.62 122.62 1l8y n SER 79 Ca 0.00 -1.97 0.00 0.00 1.01 0.00 0.00 58.87 57.91 1l8y n SER 79 Cb 0.00 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.06 1l8y n SER 79 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1l8y n SER 80 N 0.14 0.35 -1.39 6.43 7.64 -1.15 -4.42 113.62 121.21 1l8y n SER 80 Ca 0.08 0.27 0.18 0.00 1.01 0.00 0.00 58.87 60.41 1l8y n SER 80 Cb 0.19 0.05 -0.07 0.00 -1.01 0.00 0.00 64.21 63.38 1l8y n SER 80 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1l8y n LYS 81 N -3.36 -3.04 -3.40 1.43 4.76 -1.26 -4.85 118.16 108.44 1l8y n LYS 81 Ca 0.00 2.30 -0.27 0.00 -2.87 0.00 0.00 58.31 57.47 1l8y n LYS 81 Cb 0.04 -3.62 -0.10 0.00 -1.84 0.00 0.00 35.03 29.51 1l8y n LYS 81 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 1l8y s LYS 82 N -3.35 0.86 1.30 1.97 1.02 -1.26 -5.07 119.74 115.20 1l8y s LYS 82 Ca 0.00 -2.00 -0.20 0.00 0.02 0.00 0.00 55.97 53.79 1l8y s LYS 82 Cb 0.00 -1.40 0.32 0.00 -0.52 0.00 0.00 37.83 36.23 1l8y s LYS 82 CO 0.00 -1.36 1.01 -0.48 -0.92 0.00 0.00 175.35 173.60 1l8y s LEU 83 N 0.20 -0.13 0.00 3.17 -0.00 -1.26 -5.30 118.68 115.35 1l8y s LEU 83 Ca 0.31 0.89 0.19 0.00 -0.00 0.00 0.00 54.13 55.52 1l8y s LEU 83 Cb 0.00 -2.52 0.15 0.00 -0.00 0.00 0.00 46.19 43.82 1l8y s LEU 83 CO -0.17 -4.70 1.10 -0.62 -0.00 0.00 0.00 176.35 171.96