#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2fug n ARG 16 N 0.00 0.00 0.00 5.31 0.00 -1.26 -1.91 116.66 118.80 2fug n ARG 16 Ca 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 57.85 57.88 2fug n ARG 16 Cb 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 32.46 32.31 2fug n ARG 16 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 2fug n GLU 17 N -0.16 0.49 -2.15 -0.14 1.02 -1.26 -3.82 120.64 114.62 2fug n GLU 17 Ca 0.00 0.00 -0.32 0.00 -0.02 0.00 0.00 57.16 56.82 2fug n GLU 17 Cb 0.00 -1.25 -0.01 0.00 -0.02 0.00 0.00 31.44 30.16 2fug n GLU 17 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2fug s GLY 18 N -0.02 1.92 0.39 0.62 0.00 -0.80 -4.84 107.32 104.59 2fug s GLY 18 Ca 0.00 0.11 0.06 0.00 0.00 0.00 0.00 44.72 44.89 2fug s GLY 18 CO 0.00 0.39 2.04 -2.22 0.00 0.00 0.00 173.10 173.31 2fug h ILE 19 N 0.40 1.12 0.21 0.90 2.04 -1.89 0.10 117.51 120.39 2fug h ILE 19 Ca -0.46 -0.25 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 2fug h ILE 19 Cb 1.19 0.46 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 2fug h ILE 19 CO 0.61 0.13 -0.10 0.25 0.00 0.00 0.00 178.15 179.03 2fug h LEU 20 N 0.63 -0.24 -0.89 1.44 5.85 -1.92 0.02 115.31 120.20 2fug h LEU 20 Ca 0.17 0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.99 2fug h LEU 20 Cb -0.05 0.06 -0.07 0.00 0.37 0.00 0.00 40.66 40.97 2fug h LEU 20 CO -0.03 -0.16 0.54 0.15 -0.34 0.00 0.00 178.44 178.60 2fug h PHE 21 N -0.30 0.99 0.54 1.25 3.57 -1.77 -2.60 116.94 118.62 2fug h PHE 21 Ca -0.03 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 2fug h PHE 21 Cb 0.21 -0.31 0.01 0.00 2.79 0.00 0.00 35.95 38.65 2fug h PHE 21 CO 0.16 0.43 -0.26 1.15 -2.23 0.00 0.00 178.31 177.56 2fug h THR 22 N 0.91 0.00 0.00 4.41 2.02 -0.81 -2.09 112.91 117.35 2fug h THR 22 Ca 0.42 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.60 2fug h THR 22 Cb 0.35 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.76 2fug h THR 22 CO -0.23 0.00 0.18 0.74 0.37 0.00 0.00 175.52 176.58 2fug h THR 23 N -0.73 0.00 0.01 3.16 2.02 -0.92 -0.19 112.91 116.25 2fug h THR 23 Ca -0.07 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 2fug h THR 23 Cb 0.56 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.41 2fug h THR 23 CO 0.12 0.00 -0.00 0.25 0.37 0.00 0.00 175.52 176.26 2fug h LEU 24 N 0.00 -0.01 -1.50 2.58 5.85 -1.16 -2.82 115.31 118.25 2fug h LEU 24 Ca 0.00 0.00 0.17 0.00 0.84 0.00 0.00 57.88 58.89 2fug h LEU 24 Cb 0.36 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 41.33 2fug h LEU 24 CO 0.00 0.14 0.55 1.05 -0.34 0.00 0.00 178.44 179.84 2fug h GLU 25 N -0.30 0.45 0.00 1.25 4.11 -0.83 0.54 114.58 119.80 2fug h GLU 25 Ca -0.00 -0.03 -0.08 0.00 0.07 0.00 0.00 59.36 59.33 2fug h GLU 25 Cb 0.01 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 2fug h GLU 25 CO 0.00 0.30 -0.36 1.57 0.07 0.00 0.00 179.01 180.59 2fug h LYS 26 N 0.47 0.00 0.15 1.06 5.09 -1.19 0.27 116.57 122.42 2fug h LYS 26 Ca 0.42 0.00 -0.29 0.00 0.09 0.00 0.00 60.65 60.87 2fug h LYS 26 Cb 0.95 0.00 0.01 0.00 0.10 0.00 0.00 32.23 33.29 2fug h LYS 26 CO -0.16 0.36 -1.29 1.25 -2.09 0.00 0.00 179.45 177.53 2fug h LEU 27 N 0.00 0.55 0.24 7.07 5.85 0.16 -2.64 115.31 126.53 2fug h LEU 27 Ca -0.00 -0.58 -0.01 0.00 0.84 0.00 0.00 57.88 58.13 2fug h LEU 27 Cb 0.74 -0.18 0.00 0.00 0.37 0.00 0.00 40.66 41.59 2fug h LEU 27 CO 0.05 1.45 -0.11 0.58 -0.34 0.00 0.00 178.44 180.06 2fug h VAL 28 N 0.10 0.83 -0.26 1.05 2.07 0.09 -2.40 116.25 117.73 2fug h VAL 28 Ca -0.16 -0.49 0.06 0.00 0.82 0.00 0.00 66.70 66.92 2fug h VAL 28 Cb 2.00 1.11 -0.06 0.00 -1.52 0.00 0.00 31.29 32.83 2fug h VAL 28 CO 0.22 0.11 -0.10 0.00 0.02 0.00 0.00 177.57 177.82 2fug h ALA 29 N 0.11 0.13 -0.93 1.67 0.00 -0.58 0.43 119.26 120.10 2fug h ALA 29 Ca -0.03 0.10 0.22 0.00 0.00 0.00 0.00 54.91 55.20 2fug h ALA 29 Cb 0.42 0.26 -0.07 0.00 0.00 0.00 0.00 17.79 18.40 2fug h ALA 29 CO 0.05 -0.50 0.61 2.35 0.00 0.00 0.00 179.25 181.77 2fug h TRP 30 N -0.05 0.52 0.34 0.00 2.91 -1.46 0.45 115.95 118.66 2fug h TRP 30 Ca 0.13 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.15 2fug h TRP 30 Cb 0.25 -0.16 0.00 0.00 -0.51 0.00 0.00 29.16 28.75 2fug h TRP 30 CO -0.29 0.12 -0.16 0.78 -1.03 0.00 0.00 178.44 177.86 2fug h GLY 31 N 0.38 -0.47 1.56 2.65 0.00 0.20 -2.97 103.07 104.42 2fug h GLY 31 Ca 0.49 0.18 0.00 0.00 0.00 0.00 0.00 47.33 47.99 2fug h GLY 31 CO -0.18 -0.17 0.12 -2.13 0.00 0.00 0.00 176.54 174.18 2fug n ARG 32 N -3.90 0.02 -0.06 4.80 0.63 0.82 -0.52 116.66 118.45 2fug n ARG 32 Ca -0.06 0.43 -0.02 0.00 -0.92 0.00 0.00 57.85 57.29 2fug n ARG 32 Cb 0.18 -1.70 0.24 0.00 0.45 0.00 0.00 32.46 31.63 2fug n ARG 32 CO 0.00 0.00 0.00 1.03 -2.51 0.00 0.00 177.63 176.15 2fug h SER 33 N 0.00 0.63 -0.02 6.15 0.87 0.05 -3.03 113.55 118.20 2fug h SER 33 Ca 0.00 -0.12 0.00 0.00 -1.23 0.00 0.00 61.79 60.44 2fug h SER 33 Cb 0.24 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.04 2fug h SER 33 CO 0.00 0.68 -0.17 0.59 -0.53 0.00 0.00 176.83 177.40 2fug n ASN 34 N -4.26 2.21 -2.12 6.23 4.13 0.33 -4.21 115.26 117.56 2fug n ASN 34 Ca 0.02 -1.61 -0.24 0.00 1.68 0.00 0.00 54.58 54.44 2fug n ASN 34 Cb 0.25 0.21 0.13 0.00 -1.54 0.00 0.00 39.78 38.83 2fug n ASN 34 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 2fug n SER 35 N 0.55 4.80 -4.69 6.41 3.41 -1.14 -4.93 113.62 118.02 2fug n SER 35 Ca 0.09 -3.46 -0.42 0.00 -0.26 0.00 0.00 58.87 54.82 2fug n SER 35 Cb 0.43 -0.86 -0.03 0.00 -0.26 0.00 0.00 64.21 63.50 2fug n SER 35 CO 0.00 0.00 0.00 -0.76 -0.16 0.00 0.00 175.04 174.12 2fug s LEU 36 N -3.01 4.27 -0.68 1.04 1.43 -1.25 -5.00 118.68 115.49 2fug s LEU 36 Ca 0.52 1.53 -0.02 0.00 -1.03 0.00 0.00 54.13 55.13 2fug s LEU 36 Cb 0.43 -3.53 0.17 0.00 0.03 0.00 0.00 46.19 43.29 2fug s LEU 36 CO 0.06 -0.39 0.50 0.86 0.23 0.00 0.00 176.35 177.61 2fug s TRP 37 N 1.74 3.48 -0.26 0.29 -0.00 -1.26 -5.06 118.94 117.87 2fug s TRP 37 Ca 0.48 -2.84 -0.35 0.00 -0.00 0.00 0.00 56.10 53.39 2fug s TRP 37 Cb -0.19 -3.16 -0.12 0.00 -0.00 0.00 0.00 33.47 30.00 2fug s TRP 37 CO 0.20 -0.80 2.04 -2.30 -0.00 0.00 0.00 176.95 176.09 2fug n PRO 38 N 3.15 1.43 -3.59 5.86 -0.02 -1.26 -3.32 135.00 137.24 2fug n PRO 38 Ca 0.11 0.46 -0.30 0.00 -2.02 0.00 0.00 63.50 61.75 2fug n PRO 38 Cb 0.37 -2.50 -0.09 0.00 -0.02 0.00 0.00 33.50 31.27 2fug n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2fug n ALA 39 N 8.40 3.89 -1.61 3.55 0.00 -0.83 -5.00 120.51 128.90 2fug n ALA 39 Ca 0.33 -4.67 -0.48 0.00 0.00 0.00 0.00 53.44 48.62 2fug n ALA 39 Cb 0.24 -1.16 -0.04 0.00 0.00 0.00 0.00 19.45 18.49 2fug n ALA 39 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2fug n THR 40 N 1.47 0.85 -3.18 0.00 5.66 -1.26 -3.57 114.28 114.26 2fug n THR 40 Ca 0.25 -0.21 -0.24 0.00 -3.05 0.00 0.00 64.05 60.80 2fug n THR 40 Cb 0.38 -1.04 -0.05 0.00 -1.55 0.00 0.00 70.33 68.06 2fug n THR 40 CO 0.00 0.00 0.00 0.33 -3.05 0.00 0.00 175.07 172.35 2fug n PHE 41 N 1.70 2.01 -1.85 1.09 7.35 0.75 -4.88 117.46 123.64 2fug n PHE 41 Ca 0.14 -3.90 -0.32 0.00 -0.76 0.00 0.00 57.45 52.62 2fug n PHE 41 Cb 0.26 -0.46 0.02 0.00 0.35 0.00 0.00 39.48 39.66 2fug n PHE 41 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 2fug s GLY 42 N -2.47 1.87 0.00 7.13 0.00 -1.26 -3.38 107.32 109.22 2fug s GLY 42 Ca 0.41 0.19 0.00 0.00 0.00 0.00 0.00 44.72 45.33 2fug s GLY 42 CO -0.09 0.50 0.00 1.04 0.00 0.00 0.00 173.10 174.55 2fug n LEU 43 N -2.54 0.00 0.00 0.66 4.77 0.42 -4.89 117.00 115.42 2fug n LEU 43 Ca 0.08 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.06 2fug n LEU 43 Cb 0.53 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.62 2fug n LEU 43 CO 0.52 0.00 0.00 0.00 -1.33 0.00 0.00 177.39 176.58 2fug n ALA 44 N -2.58 0.00 -0.35 -1.18 0.00 -1.26 -4.64 120.51 110.51 2fug n ALA 44 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.55 2fug n ALA 44 Cb 0.00 0.00 0.29 0.00 0.00 0.00 0.00 19.45 19.74 2fug n ALA 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fug h ALA 47 N 1.52 1.83 0.03 0.00 0.00 -1.16 -0.28 119.26 121.19 2fug h ALA 47 Ca 0.43 0.22 -0.19 0.00 0.00 0.00 0.00 54.91 55.37 2fug h ALA 47 Cb 0.54 0.25 0.02 0.00 0.00 0.00 0.00 17.79 18.60 2fug h ALA 47 CO -0.32 -0.64 -0.78 0.82 0.00 0.00 0.00 179.25 178.33 2fug h ILE 48 N 0.21 1.39 0.00 0.00 5.03 -1.33 -3.20 117.51 119.61 2fug h ILE 48 Ca 0.72 -2.21 0.00 0.00 -0.12 0.00 0.00 64.86 63.25 2fug h ILE 48 Cb 1.67 2.64 0.00 0.00 -3.03 0.00 0.00 36.82 38.10 2fug h ILE 48 CO -0.67 0.65 0.00 1.21 -0.68 0.00 0.00 178.15 178.66 2fug n GLU 49 N -4.09 0.01 0.00 2.37 4.07 -0.26 -1.93 120.64 120.80 2fug n GLU 49 Ca -0.11 0.17 0.11 0.00 -0.06 0.00 0.00 57.16 57.27 2fug n GLU 49 Cb 0.76 -1.51 0.11 0.00 -0.06 0.00 0.00 31.44 30.74 2fug n GLU 49 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 2fug n MET 50 N -1.52 0.11 0.06 5.31 0.00 -0.35 -3.86 117.12 116.87 2fug n MET 50 Ca 0.05 -0.07 0.13 0.00 0.00 0.00 0.00 57.70 57.81 2fug n MET 50 Cb 0.23 -1.50 0.49 0.00 0.00 0.00 0.00 33.22 32.45 2fug n MET 50 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 175.97 174.64 2fug n MET 51 N -1.38 0.15 -0.16 3.17 2.81 -0.81 -3.10 117.12 117.80 2fug n MET 51 Ca 0.06 0.13 0.03 0.00 -1.81 0.00 0.00 57.70 56.11 2fug n MET 51 Cb 0.34 -1.68 0.10 0.00 -0.71 0.00 0.00 33.22 31.28 2fug n MET 51 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2fug n ALA 52 N -1.66 2.60 0.12 3.04 0.00 -1.25 -2.77 120.51 120.59 2fug n ALA 52 Ca 0.06 -0.43 0.05 0.00 0.00 0.00 0.00 53.44 53.12 2fug n ALA 52 Cb 0.39 -1.00 0.09 0.00 0.00 0.00 0.00 19.45 18.92 2fug n ALA 52 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2fug n SER 53 N 0.15 2.30 -3.49 0.00 7.64 -1.18 -4.68 113.62 114.36 2fug n SER 53 Ca 0.07 -1.70 -0.40 0.00 1.01 0.00 0.00 58.87 57.85 2fug n SER 53 Cb 0.29 -0.10 0.02 0.00 -1.01 0.00 0.00 64.21 63.41 2fug n SER 53 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2fug n THR 54 N 0.45 5.59 -3.47 0.44 -1.04 -1.11 -4.93 114.28 110.21 2fug n THR 54 Ca 0.08 -5.71 -0.43 0.00 -2.04 0.00 0.00 64.05 55.95 2fug n THR 54 Cb 0.32 -1.49 -0.07 0.00 -1.82 0.00 0.00 70.33 67.26 2fug n THR 54 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 2fug s ASP 55 N -1.41 5.88 0.00 8.00 2.15 -1.26 -5.13 116.67 124.90 2fug s ASP 55 Ca 0.41 -1.89 0.00 0.00 0.43 0.00 0.00 52.55 51.51 2fug s ASP 55 Cb 0.23 -2.08 0.00 0.00 -0.30 0.00 0.00 42.92 40.77 2fug s ASP 55 CO -0.17 -0.75 0.00 0.00 -0.17 0.00 0.00 175.17 174.08 2fug n ALA 56 N 5.00 0.00 0.00 3.66 0.00 -1.26 -5.25 120.51 122.67 2fug n ALA 56 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.34 2fug n ALA 56 Cb 0.41 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.86 2fug n ALA 56 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2fug n GLN 74 N 0.00 0.00 -4.08 0.00 1.13 -1.26 -5.32 117.38 107.86 2fug n GLN 74 Ca 0.00 0.00 -0.14 0.00 -1.94 0.00 0.00 57.00 54.92 2fug n GLN 74 Cb 0.00 0.00 -0.13 0.00 0.11 0.00 0.00 30.24 30.22 2fug n GLN 74 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2fug s ALA 75 N 0.00 0.38 0.32 -1.58 0.00 -1.26 -5.00 121.76 114.62 2fug s ALA 75 Ca 0.00 -0.35 0.03 0.00 0.00 0.00 0.00 51.96 51.64 2fug s ALA 75 Cb 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.05 2fug s ALA 75 CO 0.00 0.04 0.15 0.16 0.00 0.00 0.00 175.76 176.11 2fug s ASP 76 N -0.57 1.80 -0.44 0.00 -4.77 -1.21 -4.48 116.67 107.00 2fug s ASP 76 Ca -0.03 -1.58 -0.22 0.00 -3.30 0.00 0.00 52.55 47.42 2fug s ASP 76 Cb -0.04 0.39 0.03 0.00 -1.09 0.00 0.00 42.92 42.20 2fug s ASP 76 CO -0.00 -0.89 0.62 0.52 0.70 0.00 0.00 175.17 176.12 2fug n VAL 77 N -0.65 -9.02 -3.42 2.11 0.31 -1.25 -3.82 118.33 102.60 2fug n VAL 77 Ca -0.00 0.64 -0.37 0.00 -0.01 0.00 0.00 64.34 64.60 2fug n VAL 77 Cb 0.65 -6.21 -0.06 0.00 -0.91 0.00 0.00 33.84 27.30 2fug n VAL 77 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2fug s MET 78 N -2.58 4.23 -0.30 5.55 0.23 -0.73 -1.97 119.30 123.73 2fug s MET 78 Ca 0.28 0.33 -0.11 0.00 -1.03 0.00 0.00 55.69 55.16 2fug s MET 78 Cb -0.06 -3.39 -0.03 0.00 -1.53 0.00 0.00 34.83 29.81 2fug s MET 78 CO 0.80 0.28 0.19 0.42 -2.03 0.00 0.00 175.02 174.68 2fug s ILE 79 N 0.26 5.13 -0.44 3.16 1.01 -1.23 -2.54 121.20 126.55 2fug s ILE 79 Ca 0.22 -0.05 -0.21 0.00 0.00 0.00 0.00 60.65 60.61 2fug s ILE 79 Cb -0.15 -3.52 0.02 0.00 0.01 0.00 0.00 42.46 38.82 2fug s ILE 79 CO 0.09 0.15 0.66 -0.69 0.00 0.00 0.00 174.94 175.15 2fug s VAL 80 N 1.72 4.81 -0.52 2.92 1.01 -0.62 -0.18 120.40 129.54 2fug s VAL 80 Ca 0.06 0.15 0.04 0.00 0.00 0.00 0.00 61.98 62.23 2fug s VAL 80 Cb -0.16 -4.22 0.14 0.00 0.00 0.00 0.00 36.38 32.14 2fug s VAL 80 CO 0.10 -0.61 0.28 0.00 0.00 0.00 0.00 175.10 174.87 2fug s ALA 81 N 2.86 3.03 0.00 5.51 0.00 -1.22 0.12 121.76 132.06 2fug s ALA 81 Ca 0.23 -3.14 0.00 0.00 0.00 0.00 0.00 51.96 49.05 2fug s ALA 81 Cb -0.14 -2.08 0.00 0.00 0.00 0.00 0.00 23.12 20.90 2fug s ALA 81 CO 0.19 -2.04 0.00 0.41 0.00 0.00 0.00 175.76 174.32 2fug n GLY 82 N 3.10 -0.64 3.63 0.00 0.00 -1.26 -0.44 105.19 109.58 2fug n GLY 82 Ca 0.08 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.98 2fug n GLY 82 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2fug s ARG 83 N -1.44 3.92 -0.90 1.61 1.70 -1.26 -2.94 118.95 119.63 2fug s ARG 83 Ca 0.00 1.38 -0.23 0.00 -0.47 0.00 0.00 55.73 56.42 2fug s ARG 83 Cb 0.00 -3.90 0.07 0.00 -0.57 0.00 0.00 34.95 30.55 2fug s ARG 83 CO 0.00 -1.12 1.27 -1.17 -1.08 0.00 0.00 175.30 173.20 2fug s LEU 84 N 4.47 3.96 0.83 -1.89 1.98 -1.26 -4.75 118.68 122.03 2fug s LEU 84 Ca 0.60 -1.37 -0.13 0.00 -2.89 0.00 0.00 54.13 50.33 2fug s LEU 84 Cb -0.19 -2.50 0.10 0.00 0.66 0.00 0.00 46.19 44.25 2fug s LEU 84 CO 0.24 -1.44 1.18 -0.24 -1.89 0.00 0.00 176.35 174.20 2fug n SER 85 N 8.21 0.86 0.17 3.68 2.88 -1.26 -2.34 113.62 125.82 2fug n SER 85 Ca 0.21 0.55 0.02 0.00 -1.33 0.00 0.00 58.87 58.32 2fug n SER 85 Cb 0.49 -1.50 0.29 0.00 -0.75 0.00 0.00 64.21 62.75 2fug n SER 85 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2fug h LYS 86 N -1.12 0.00 -0.06 -1.46 1.57 -1.78 0.96 116.57 114.68 2fug h LYS 86 Ca -0.46 0.00 -0.12 0.00 -1.87 0.00 0.00 60.65 58.21 2fug h LYS 86 Cb 1.29 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.59 2fug h LYS 86 CO 0.45 0.46 -0.50 -0.22 -0.57 0.00 0.00 179.45 179.07 2fug h LYS 87 N 0.00 0.15 0.02 3.15 3.64 -1.90 -2.71 116.57 118.92 2fug h LYS 87 Ca -0.00 -0.08 -0.21 0.00 -1.27 0.00 0.00 60.65 59.08 2fug h LYS 87 Cb 0.88 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.68 2fug h LYS 87 CO 0.06 0.62 -1.00 1.98 -2.27 0.00 0.00 179.45 178.84 2fug h MET 88 N 0.12 0.06 0.00 1.90 4.05 -1.74 -3.39 114.93 115.92 2fug h MET 88 Ca 0.00 -0.09 0.00 0.00 -0.28 0.00 0.00 59.70 59.33 2fug h MET 88 Cb 0.93 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 31.76 2fug h MET 88 CO 0.07 1.00 0.00 0.00 0.23 0.00 0.00 176.91 178.22 2fug n ALA 89 N -2.39 0.00 -0.38 0.39 0.00 0.27 -0.82 120.51 117.58 2fug n ALA 89 Ca -0.02 0.00 0.32 0.00 0.00 0.00 0.00 53.44 53.74 2fug n ALA 89 Cb 0.92 0.45 0.64 0.00 0.00 0.00 0.00 19.45 21.46 2fug n ALA 89 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2fug h PRO 90 N 0.00 0.16 0.47 0.00 0.13 -1.76 -1.83 132.00 129.17 2fug h PRO 90 Ca 0.00 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.10 2fug h PRO 90 Cb 0.00 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.10 2fug h PRO 90 CO 0.00 0.11 -0.23 0.28 -0.23 0.00 0.00 178.00 177.93 2fug h VAL 91 N 0.17 0.44 -0.98 1.56 2.07 -1.21 -2.29 116.25 116.01 2fug h VAL 91 Ca 0.66 -0.42 0.21 0.00 0.82 0.00 0.00 66.70 67.97 2fug h VAL 91 Cb 2.16 0.60 -0.09 0.00 -1.52 0.00 0.00 31.29 32.44 2fug h VAL 91 CO -0.21 0.06 0.62 -0.03 0.02 0.00 0.00 177.57 178.04 2fug h MET 92 N -0.92 0.53 0.08 1.57 1.85 -0.91 -1.33 114.93 115.81 2fug h MET 92 Ca -0.06 -0.03 -0.00 0.00 -0.61 0.00 0.00 59.70 58.99 2fug h MET 92 Cb 0.58 -0.12 -0.00 0.00 0.43 0.00 0.00 31.60 32.49 2fug h MET 92 CO 0.11 0.35 -0.08 -0.09 -0.40 0.00 0.00 176.91 176.80 2fug h ARG 93 N 0.55 -0.15 -1.26 0.39 9.65 -1.25 -0.77 114.38 121.53 2fug h ARG 93 Ca 0.54 0.01 0.37 0.00 -1.10 0.00 0.00 59.98 59.80 2fug h ARG 93 Cb 1.14 0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 29.71 2fug h ARG 93 CO -0.29 -0.10 0.93 0.00 2.80 0.00 0.00 179.97 183.31 2fug h ARG 94 N -0.16 0.00 0.00 0.20 3.08 -0.73 1.43 114.38 118.21 2fug h ARG 94 Ca -0.01 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.01 2fug h ARG 94 Cb 0.13 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.18 2fug h ARG 94 CO -0.01 0.00 -0.16 0.28 -1.07 0.00 0.00 179.97 179.02 2fug h VAL 95 N 0.00 0.29 0.00 2.04 2.07 -0.73 -2.92 116.25 116.99 2fug h VAL 95 Ca 0.60 -1.29 -0.03 0.00 0.82 0.00 0.00 66.70 66.80 2fug h VAL 95 Cb 2.46 2.05 -0.00 0.00 -1.52 0.00 0.00 31.29 34.27 2fug h VAL 95 CO -0.01 0.15 -0.28 -0.25 0.02 0.00 0.00 177.57 177.20 2fug h TRP 96 N 0.00 0.00 -1.10 1.57 7.01 0.34 -3.34 115.95 120.42 2fug h TRP 96 Ca -0.00 0.00 0.31 0.00 2.11 0.00 0.00 58.89 61.31 2fug h TRP 96 Cb 1.03 0.00 -0.11 0.00 -2.10 0.00 0.00 29.16 27.98 2fug h TRP 96 CO 0.00 0.40 0.69 0.93 -2.79 0.00 0.00 178.44 177.68 2fug h GLU 97 N -1.00 0.31 -1.94 2.65 5.08 -1.25 -1.26 114.58 117.17 2fug h GLU 97 Ca -0.04 -0.02 -0.27 0.00 -1.00 0.00 0.00 59.36 58.02 2fug h GLU 97 Cb 0.50 -0.07 -0.10 0.00 0.50 0.00 0.00 28.75 29.58 2fug h GLU 97 CO -0.03 0.21 -0.00 0.94 -1.00 0.00 0.00 179.01 179.13 2fug n GLN 98 N -4.73 1.96 -4.24 2.33 7.27 -1.10 -4.83 117.38 114.05 2fug n GLN 98 Ca 0.29 -1.34 -0.13 0.00 0.07 0.00 0.00 57.00 55.89 2fug n GLN 98 Cb 1.02 -1.86 -0.10 0.00 2.41 0.00 0.00 30.24 31.71 2fug n GLN 98 CO 0.00 0.00 0.00 -1.64 0.07 0.00 0.00 177.06 175.49 2fug s MET 99 N -0.31 1.05 0.02 3.69 -1.94 -0.48 -4.98 119.30 116.36 2fug s MET 99 Ca 0.51 -1.48 -0.30 0.00 -1.71 0.00 0.00 55.69 52.71 2fug s MET 99 Cb 0.29 -0.39 -0.05 0.00 2.01 0.00 0.00 34.83 36.68 2fug s MET 99 CO -0.07 -0.04 1.27 -1.25 -0.01 0.00 0.00 175.02 174.92 2fug s PRO 100 N -3.84 4.36 0.20 2.03 0.04 -1.26 -4.93 135.00 131.59 2fug s PRO 100 Ca 0.19 1.82 -0.00 0.00 0.04 0.00 0.00 61.00 63.05 2fug s PRO 100 Cb 0.05 -3.45 0.45 0.00 0.04 0.00 0.00 34.50 31.59 2fug s PRO 100 CO 0.01 -0.40 1.03 -3.47 0.04 0.00 0.00 177.00 174.21 2fug n ASP 101 N 4.62 -0.12 -4.53 6.66 -0.08 -1.26 -3.22 116.55 118.63 2fug n ASP 101 Ca 0.11 1.12 -0.32 0.00 -1.51 0.00 0.00 54.79 54.19 2fug n ASP 101 Cb 0.45 -0.39 -0.05 0.00 2.34 0.00 0.00 41.12 43.47 2fug n ASP 101 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 2fug n PRO 102 N -4.92 1.91 -4.46 -0.67 -0.02 -1.26 -4.83 135.00 120.74 2fug n PRO 102 Ca 0.14 -2.60 -0.23 0.00 -2.02 0.00 0.00 63.50 58.80 2fug n PRO 102 Cb 0.46 -3.65 -0.09 0.00 -0.02 0.00 0.00 33.50 30.20 2fug n PRO 102 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2fug s LYS 103 N 5.95 1.77 0.25 -0.52 -2.85 -1.20 -4.77 119.74 118.37 2fug s LYS 103 Ca 0.65 -2.03 -0.07 0.00 -1.00 0.00 0.00 55.97 53.52 2fug s LYS 103 Cb 0.01 -0.60 -0.02 0.00 -2.06 0.00 0.00 37.83 35.16 2fug s LYS 103 CO 0.12 -0.37 0.35 -1.58 0.10 0.00 0.00 175.35 173.97 2fug s TRP 104 N -3.33 0.77 -0.07 1.78 0.51 -1.26 -4.57 118.94 112.78 2fug s TRP 104 Ca 0.30 -1.05 -0.03 0.00 -2.12 0.00 0.00 56.10 53.20 2fug s TRP 104 Cb 0.05 -0.13 0.04 0.00 -0.81 0.00 0.00 33.47 32.63 2fug s TRP 104 CO 0.15 -0.89 0.13 0.08 -0.51 0.00 0.00 176.95 175.91 2fug s VAL 105 N -3.92 -0.13 -0.14 4.03 1.01 -1.26 -1.77 120.40 118.23 2fug s VAL 105 Ca 0.30 0.26 0.02 0.00 0.00 0.00 0.00 61.98 62.55 2fug s VAL 105 Cb 0.02 -0.24 0.00 0.00 0.00 0.00 0.00 36.38 36.16 2fug s VAL 105 CO 0.12 0.11 -0.19 -0.63 0.00 0.00 0.00 175.10 174.51 2fug s ILE 106 N 1.60 2.40 -0.30 2.22 1.01 -1.05 -0.24 121.20 126.83 2fug s ILE 106 Ca -0.04 -0.87 -0.16 0.00 0.00 0.00 0.00 60.65 59.58 2fug s ILE 106 Cb -0.12 -1.98 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 2fug s ILE 106 CO -0.05 0.53 0.41 -0.94 0.00 0.00 0.00 174.94 174.89 2fug s SER 107 N 0.70 6.26 -0.19 3.58 1.04 -0.09 -1.59 113.70 123.41 2fug s SER 107 Ca -0.08 0.10 -0.27 0.00 0.48 0.00 0.00 55.95 56.17 2fug s SER 107 Cb -0.16 -2.22 -0.00 0.00 0.10 0.00 0.00 66.02 63.73 2fug s SER 107 CO 0.01 -0.29 0.92 -0.32 0.98 0.00 0.00 173.24 174.55 2fug s MET 108 N 2.14 4.28 0.24 4.02 1.75 0.12 -0.82 119.30 131.03 2fug s MET 108 Ca 0.15 1.17 0.00 0.00 -1.25 0.00 0.00 55.69 55.76 2fug s MET 108 Cb -0.16 -3.60 0.00 0.00 2.84 0.00 0.00 34.83 33.91 2fug s MET 108 CO 0.11 -0.46 0.00 0.41 -0.65 0.00 0.00 175.02 174.43 2fug n GLY 109 N 3.42 -1.34 0.00 2.11 0.00 0.14 -4.11 105.19 105.41 2fug n GLY 109 Ca 0.08 -0.80 0.00 0.00 0.00 0.00 0.00 46.02 45.30 2fug n GLY 109 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fug n ALA 110 N -1.78 0.00 -0.01 4.61 0.00 -0.01 -1.77 120.51 121.55 2fug n ALA 110 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.45 2fug n ALA 110 Cb 0.62 0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.09 2fug n ALA 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2fug h ALA 112 N 0.07 -0.72 -3.00 0.00 0.00 -1.51 -3.38 119.26 110.72 2fug h ALA 112 Ca 0.02 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2fug h ALA 112 Cb 0.03 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.02 2fug h ALA 112 CO -0.04 -0.68 0.00 0.43 0.00 0.00 0.00 179.25 178.96 2fug n SER 113 N -4.17 0.00 -5.00 0.00 7.64 0.35 -1.07 113.62 111.36 2fug n SER 113 Ca -0.06 0.41 -0.19 0.00 1.01 0.00 0.00 58.87 60.04 2fug n SER 113 Cb 0.20 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.45 2fug n SER 113 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2fug s SER 114 N -2.66 5.30 0.00 6.43 1.04 -0.13 -3.84 113.70 119.84 2fug s SER 114 Ca 0.00 -0.59 0.00 0.00 0.48 0.00 0.00 55.95 55.84 2fug s SER 114 Cb 0.00 -0.19 0.00 0.00 0.10 0.00 0.00 66.02 65.93 2fug s SER 114 CO 0.00 -1.12 0.08 0.61 0.98 0.00 0.00 173.24 173.79 2fug n GLY 115 N -2.12 0.23 7.00 7.32 0.00 0.40 -3.58 105.19 114.44 2fug n GLY 115 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 2fug n GLY 115 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2fug n GLY 116 N 0.44 2.02 1.54 -0.02 0.00 -1.26 -1.64 105.19 106.27 2fug n GLY 116 Ca 0.00 -0.46 0.03 0.00 0.00 0.00 0.00 46.02 45.59 2fug n GLY 116 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2fug n MET 117 N 8.07 3.67 -3.84 1.61 0.00 -1.26 -4.75 117.12 120.62 2fug n MET 117 Ca 0.00 -3.05 -0.30 0.00 0.00 0.00 0.00 57.70 54.36 2fug n MET 117 Cb 0.00 -2.08 -0.14 0.00 0.00 0.00 0.00 33.22 31.00 2fug n MET 117 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 2fug s PHE 118 N -2.90 2.61 -0.58 3.17 0.08 -0.65 -5.04 117.98 114.66 2fug s PHE 118 Ca 0.50 -2.79 -0.20 0.00 0.12 0.00 0.00 56.93 54.56 2fug s PHE 118 Cb 0.40 -2.37 0.08 0.00 -0.57 0.00 0.00 43.02 40.56 2fug s PHE 118 CO 0.12 -0.77 0.77 -0.80 -0.10 0.00 0.00 175.22 174.43 2fug s ASN 119 N 0.09 6.20 0.05 1.36 -0.87 -1.26 -4.77 114.94 115.75 2fug s ASN 119 Ca 0.17 -1.11 -0.28 0.00 -1.57 0.00 0.00 52.86 50.07 2fug s ASN 119 Cb -0.25 -2.34 0.09 0.00 -0.02 0.00 0.00 41.25 38.73 2fug s ASN 119 CO -0.01 -1.15 0.99 0.54 -2.57 0.00 0.00 177.10 174.91 2fug s ASN 120 N 3.34 -0.23 0.46 -1.22 4.22 -1.26 -5.00 114.94 115.26 2fug s ASN 120 Ca 0.16 -0.20 0.24 0.00 -2.14 0.00 0.00 52.86 50.93 2fug s ASN 120 Cb -0.20 0.39 1.27 0.00 1.28 0.00 0.00 41.25 43.98 2fug s ASN 120 CO 0.10 -0.68 1.83 0.10 -2.04 0.00 0.00 177.10 176.41 2fug h TYR 121 N 2.00 0.35 -0.52 1.54 -0.00 -2.04 -2.74 116.97 115.56 2fug h TYR 121 Ca -0.23 0.01 -0.09 0.00 -0.00 0.00 0.00 58.73 58.42 2fug h TYR 121 Cb 1.23 -0.10 -0.02 0.00 -0.00 0.00 0.00 36.73 37.84 2fug h TYR 121 CO 0.32 0.06 -0.03 0.00 -0.00 0.00 0.00 178.16 178.51 2fug h ALA 122 N 1.57 0.70 -3.17 0.10 0.00 -1.95 -3.46 119.26 113.05 2fug h ALA 122 Ca 0.51 -0.31 -0.64 0.00 0.00 0.00 0.00 54.91 54.47 2fug h ALA 122 Cb 1.57 -0.19 -0.16 0.00 0.00 0.00 0.00 17.79 19.02 2fug h ALA 122 CO -0.14 0.55 -0.75 0.42 0.00 0.00 0.00 179.25 179.32 2fug s ILE 123 N -4.97 3.01 0.27 0.00 1.01 -1.03 -2.31 121.20 117.18 2fug s ILE 123 Ca -0.12 -1.67 -0.30 0.00 0.00 0.00 0.00 60.65 58.56 2fug s ILE 123 Cb 0.12 -2.46 -0.09 0.00 0.01 0.00 0.00 42.46 40.03 2fug s ILE 123 CO 0.84 -0.07 1.04 -0.69 0.00 0.00 0.00 174.94 176.06 2fug s VAL 124 N -1.59 3.70 0.09 2.92 1.01 -0.99 -4.61 120.40 120.93 2fug s VAL 124 Ca 0.23 1.71 0.27 0.00 0.00 0.00 0.00 61.98 64.19 2fug s VAL 124 Cb -0.09 -4.09 0.28 0.00 0.00 0.00 0.00 36.38 32.49 2fug s VAL 124 CO 0.13 0.41 1.86 1.56 0.00 0.00 0.00 175.10 179.06 2fug h GLN 125 N 3.93 0.00 -0.85 2.72 1.08 -1.90 -3.41 115.11 116.67 2fug h GLN 125 Ca -0.46 0.00 0.17 0.00 -1.45 0.00 0.00 58.65 56.91 2fug h GLN 125 Cb 1.21 0.00 -0.22 0.00 -0.05 0.00 0.00 27.48 28.42 2fug h GLN 125 CO 0.67 0.15 0.03 1.21 -0.95 0.00 0.00 178.83 179.95 2fug s ASN 126 N -6.05 -0.80 0.55 1.46 3.84 -1.26 0.15 114.94 112.84 2fug s ASN 126 Ca 0.01 0.71 0.44 0.00 0.21 0.00 0.00 52.86 54.23 2fug s ASN 126 Cb 0.10 1.75 1.66 0.00 -0.55 0.00 0.00 41.25 44.21 2fug s ASN 126 CO 0.61 -0.15 1.67 0.58 -2.79 0.00 0.00 177.10 177.03 2fug h VAL 127 N 5.61 0.18 0.00 -5.21 2.07 -1.20 0.78 116.25 118.48 2fug h VAL 127 Ca -0.17 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.35 2fug h VAL 127 Cb 1.15 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 31.10 2fug h VAL 127 CO 0.07 0.00 0.00 -0.67 0.02 0.00 0.00 177.57 176.99 2fug n ASP 128 N -4.04 0.00 -0.10 0.57 2.03 -1.25 -0.96 116.55 112.80 2fug n ASP 128 Ca 0.36 0.01 0.14 0.00 0.52 0.00 0.00 54.79 55.82 2fug n ASP 128 Cb 1.68 -0.09 0.54 0.00 -0.72 0.00 0.00 41.12 42.53 2fug n ASP 128 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 2fug n SER 129 N -1.09 0.47 0.09 1.67 7.64 0.27 -4.47 113.62 118.20 2fug n SER 129 Ca 0.02 -0.44 0.00 0.00 1.01 0.00 0.00 58.87 59.46 2fug n SER 129 Cb 0.02 -0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.15 2fug n SER 129 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2fug n VAL 130 N -1.06 0.61 -4.16 0.44 0.24 -0.13 -5.06 118.33 109.21 2fug n VAL 130 Ca 0.12 0.20 -0.35 0.00 -2.04 0.00 0.00 64.34 62.28 2fug n VAL 130 Cb 0.30 -1.09 -0.13 0.00 -1.47 0.00 0.00 33.84 31.45 2fug n VAL 130 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2fug s VAL 131 N -2.00 3.66 0.06 3.34 -7.23 -1.00 -5.04 120.40 112.19 2fug s VAL 131 Ca 0.00 -0.42 -0.35 0.00 -1.81 0.00 0.00 61.98 59.41 2fug s VAL 131 Cb 0.00 -2.64 -0.14 0.00 0.56 0.00 0.00 36.38 34.17 2fug s VAL 131 CO 0.00 0.45 1.63 -2.65 -0.31 0.00 0.00 175.10 174.22 2fug n PRO 132 N 4.22 1.97 -3.70 4.82 -0.02 -1.26 -3.96 135.00 137.07 2fug n PRO 132 Ca -0.18 0.71 -0.37 0.00 -2.02 0.00 0.00 63.50 61.64 2fug n PRO 132 Cb 0.52 -2.48 -0.06 0.00 -0.02 0.00 0.00 33.50 31.45 2fug n PRO 132 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2fug s VAL 133 N 1.83 5.29 -0.21 -1.45 1.01 -1.26 -4.24 120.40 121.36 2fug s VAL 133 Ca 0.84 0.50 0.08 0.00 0.00 0.00 0.00 61.98 63.40 2fug s VAL 133 Cb -0.74 -3.55 -0.19 0.00 0.00 0.00 0.00 36.38 31.91 2fug s VAL 133 CO 0.44 0.59 -0.10 0.47 0.00 0.00 0.00 175.10 176.51 2fug n ASP 134 N 2.00 1.43 -3.71 3.32 8.00 0.66 -4.95 116.55 123.31 2fug n ASP 134 Ca -0.17 -0.07 -0.16 0.00 0.71 0.00 0.00 54.79 55.10 2fug n ASP 134 Cb 0.54 0.18 -0.15 0.00 -0.02 0.00 0.00 41.12 41.67 2fug n ASP 134 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2fug s VAL 135 N -2.46 -0.15 -0.06 2.53 1.01 -1.10 -5.00 120.40 115.17 2fug s VAL 135 Ca -0.22 0.28 -0.09 0.00 0.00 0.00 0.00 61.98 61.95 2fug s VAL 135 Cb 0.07 -0.25 -0.05 0.00 0.00 0.00 0.00 36.38 36.16 2fug s VAL 135 CO 0.64 0.12 0.24 -0.31 0.00 0.00 0.00 175.10 175.78 2fug s TYR 136 N 1.73 3.63 -0.21 5.22 1.51 -1.26 -0.91 117.35 127.05 2fug s TYR 136 Ca -0.03 0.65 0.01 0.00 -1.01 0.00 0.00 57.07 56.69 2fug s TYR 136 Cb -0.12 -2.04 0.05 0.00 -0.11 0.00 0.00 41.96 39.75 2fug s TYR 136 CO -0.05 0.69 -0.07 0.54 -1.11 0.00 0.00 175.55 175.54 2fug s VAL 137 N -1.11 1.50 0.00 0.71 0.11 0.00 -4.92 120.40 116.70 2fug s VAL 137 Ca 0.20 -1.07 -0.01 0.00 -2.93 0.00 0.00 61.98 58.18 2fug s VAL 137 Cb -0.13 -1.70 -0.04 0.00 -1.53 0.00 0.00 36.38 32.98 2fug s VAL 137 CO 0.09 0.02 0.95 -0.81 -3.33 0.00 0.00 175.10 172.03 2fug n PRO 138 N 4.70 0.30 -4.09 1.54 -0.04 -1.26 0.23 135.00 136.39 2fug n PRO 138 Ca -0.13 -0.15 -0.28 0.00 -0.04 0.00 0.00 63.50 62.91 2fug n PRO 138 Cb 0.45 -1.57 -0.03 0.00 -0.04 0.00 0.00 33.50 32.32 2fug n PRO 138 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2fug n GLY 139 N 2.88 3.08 0.00 0.55 0.00 -1.26 -4.87 105.19 105.57 2fug n GLY 139 Ca 0.06 -2.32 0.00 0.00 0.00 0.00 0.00 46.02 43.76 2fug n GLY 139 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2fug s PRO 141 N 0.00 3.60 0.16 0.00 0.04 -1.26 -5.06 135.00 132.48 2fug s PRO 141 Ca 0.00 -0.06 -0.31 0.00 0.04 0.00 0.00 61.00 60.67 2fug s PRO 141 Cb 0.00 -3.05 -0.08 0.00 0.04 0.00 0.00 34.50 31.41 2fug s PRO 141 CO 0.00 0.62 1.37 -1.25 0.04 0.00 0.00 177.00 177.78 2fug s PRO 142 N -1.89 4.34 0.44 0.56 0.04 -1.26 -4.93 135.00 132.29 2fug s PRO 142 Ca 0.30 2.10 -0.20 0.00 0.04 0.00 0.00 61.00 63.23 2fug s PRO 142 Cb -0.13 -3.21 -0.15 0.00 0.04 0.00 0.00 34.50 31.05 2fug s PRO 142 CO 0.18 -0.37 0.13 0.54 0.04 0.00 0.00 177.00 177.51 2fug n ARG 143 N 3.31 0.11 -0.18 4.56 1.74 -1.26 -4.68 116.66 120.26 2fug n ARG 143 Ca 0.09 0.04 -0.06 0.00 -0.77 0.00 0.00 57.85 57.15 2fug n ARG 143 Cb 0.42 -1.12 0.00 0.00 -1.02 0.00 0.00 32.46 30.75 2fug n ARG 143 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 2fug h PRO 144 N 0.30 -0.18 -1.21 5.56 0.11 -1.92 0.41 132.00 135.07 2fug h PRO 144 Ca -0.39 0.01 0.36 0.00 0.11 0.00 0.00 66.00 66.09 2fug h PRO 144 Cb 1.44 0.04 -0.10 0.00 0.11 0.00 0.00 31.00 32.48 2fug h PRO 144 CO 0.46 -0.12 0.79 0.93 -0.21 0.00 0.00 178.00 179.85 2fug h GLU 145 N -0.19 0.20 -0.52 1.05 3.07 -1.93 1.06 114.58 117.32 2fug h GLU 145 Ca 0.21 -0.01 0.05 0.00 -0.50 0.00 0.00 59.36 59.11 2fug h GLU 145 Cb 0.54 -0.04 -0.04 0.00 -0.84 0.00 0.00 28.75 28.36 2fug h GLU 145 CO -0.63 0.13 0.27 0.00 -1.40 0.00 0.00 179.01 177.38 2fug h ALA 146 N 1.57 0.67 -0.85 3.43 0.00 -0.46 -1.82 119.26 121.79 2fug h ALA 146 Ca 0.70 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.60 2fug h ALA 146 Cb 2.12 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 19.80 2fug h ALA 146 CO -0.32 -0.08 0.42 1.25 0.00 0.00 0.00 179.25 180.53 2fug h LEU 147 N 0.52 1.11 0.63 0.00 7.12 0.13 -1.62 115.31 123.19 2fug h LEU 147 Ca 0.23 -0.13 -0.03 0.00 0.13 0.00 0.00 57.88 58.08 2fug h LEU 147 Cb 0.13 -0.28 0.00 0.00 -0.53 0.00 0.00 40.66 39.98 2fug h LEU 147 CO -0.16 0.92 -0.33 0.40 -0.13 0.00 0.00 178.44 179.14 2fug h ILE 148 N 1.21 0.00 -0.80 4.05 5.03 -0.84 -1.14 117.51 125.03 2fug h ILE 148 Ca 0.29 0.00 0.23 0.00 -0.12 0.00 0.00 64.86 65.27 2fug h ILE 148 Cb 0.10 0.00 -0.03 0.00 -3.03 0.00 0.00 36.82 33.86 2fug h ILE 148 CO -0.04 0.00 0.78 0.22 -0.68 0.00 0.00 178.15 178.43 2fug h TYR 149 N -0.88 0.00 0.27 1.37 5.03 -1.30 0.14 116.97 121.59 2fug h TYR 149 Ca -0.09 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.21 2fug h TYR 149 Cb 0.69 0.00 0.00 0.00 1.55 0.00 0.00 36.73 38.97 2fug h TYR 149 CO 0.03 0.00 -0.13 0.00 -1.32 0.00 0.00 178.16 176.74 2fug h ALA 150 N 1.18 -0.36 -0.05 1.82 0.00 -0.21 -2.55 119.26 119.09 2fug h ALA 150 Ca 0.38 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 2fug h ALA 150 Cb 1.94 0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.86 2fug h ALA 150 CO -0.00 -0.59 -0.27 -0.39 0.00 0.00 0.00 179.25 178.00 2fug h VAL 151 N -0.59 1.22 -0.70 0.00 -1.51 -0.03 -2.42 116.25 112.21 2fug h VAL 151 Ca -0.04 -1.03 0.08 0.00 -1.23 0.00 0.00 66.70 64.48 2fug h VAL 151 Cb 0.43 1.48 -0.06 0.00 -2.13 0.00 0.00 31.29 31.01 2fug h VAL 151 CO 0.06 0.30 0.37 0.24 -1.23 0.00 0.00 177.57 177.31 2fug h MET 152 N 0.08 0.64 -0.61 5.19 2.07 -1.18 1.95 114.93 123.07 2fug h MET 152 Ca 0.01 -0.04 -0.04 0.00 -2.07 0.00 0.00 59.70 57.56 2fug h MET 152 Cb 0.53 -0.14 -0.03 0.00 -1.87 0.00 0.00 31.60 30.09 2fug h MET 152 CO 0.04 0.42 0.20 0.37 1.07 0.00 0.00 176.91 179.01 2fug h GLN 153 N 0.66 0.94 -0.14 1.72 5.75 -1.04 0.80 115.11 123.80 2fug h GLN 153 Ca 0.33 -0.19 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 2fug h GLN 153 Cb 0.28 -0.14 -0.01 0.00 1.07 0.00 0.00 27.48 28.69 2fug h GLN 153 CO -0.23 0.82 0.09 1.25 -2.65 0.00 0.00 178.83 178.12 2fug h LEU 154 N 0.86 0.16 0.19 -2.39 5.85 -0.36 0.07 115.31 119.69 2fug h LEU 154 Ca 0.20 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.91 2fug h LEU 154 Cb 0.27 -0.04 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 2fug h LEU 154 CO -0.01 0.12 -0.43 -0.61 -0.34 0.00 0.00 178.44 177.18 2fug h GLN 155 N 0.18 -0.65 0.00 1.25 4.15 0.35 0.21 115.11 120.59 2fug h GLN 155 Ca 0.05 0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.51 2fug h GLN 155 Cb -0.01 0.15 0.00 0.00 0.21 0.00 0.00 27.48 27.83 2fug h GLN 155 CO -0.01 -0.44 0.00 1.63 -1.93 0.00 0.00 178.83 178.08 2fug n LYS 156 N -4.91 0.05 -0.13 1.69 5.02 0.27 -2.24 118.16 117.91 2fug n LYS 156 Ca -0.08 0.26 -0.21 0.00 -2.02 0.00 0.00 58.31 56.26 2fug n LYS 156 Cb 0.35 -1.50 -0.11 0.00 -0.02 0.00 0.00 35.03 33.75 2fug n LYS 156 CO 0.00 0.00 0.00 1.17 -0.52 0.00 0.00 177.40 178.05 2fug n LYS 157 N -1.29 0.63 0.07 1.97 4.81 0.13 -1.85 118.16 122.63 2fug n LYS 157 Ca 0.02 0.18 0.18 0.00 -0.87 0.00 0.00 58.31 57.81 2fug n LYS 157 Cb 0.03 -1.50 0.69 0.00 0.02 0.00 0.00 35.03 34.26 2fug n LYS 157 CO 0.00 0.00 0.00 -0.39 1.17 0.00 0.00 177.40 178.18 2fug h VAL 158 N -0.26 0.77 -0.13 3.15 -1.51 -0.25 0.34 116.25 118.37 2fug h VAL 158 Ca -0.60 0.00 -0.05 0.00 -1.23 0.00 0.00 66.70 64.82 2fug h VAL 158 Cb 1.82 0.79 -0.00 0.00 -2.13 0.00 0.00 31.29 31.77 2fug h VAL 158 CO -0.18 0.00 -0.10 0.03 -1.23 0.00 0.00 177.57 176.09 2fug h ARG 159 N 0.00 0.30 0.00 5.19 3.08 -1.69 -3.44 114.38 117.82 2fug h ARG 159 Ca 0.19 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 60.09 2fug h ARG 159 Cb 0.78 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.83 2fug h ARG 159 CO -0.00 0.68 0.00 0.41 -1.07 0.00 0.00 179.97 179.98 2fug n GLY 160 N 0.13 0.46 0.00 0.04 0.00 0.12 -4.84 105.19 101.09 2fug n GLY 160 Ca -0.06 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.01 2fug n GLY 160 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2fug n GLN 161 N -1.58 0.54 -3.57 1.61 6.02 -1.21 -4.06 117.38 115.12 2fug n GLN 161 Ca 0.00 0.00 -0.28 0.00 -0.01 0.00 0.00 57.00 56.71 2fug n GLN 161 Cb 0.00 -1.28 -0.12 0.00 1.02 0.00 0.00 30.24 29.86 2fug n GLN 161 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2fug s ALA 162 N -2.00 1.79 -0.16 -1.58 0.00 -0.77 -5.00 121.76 114.05 2fug s ALA 162 Ca 0.15 -2.51 -0.10 0.00 0.00 0.00 0.00 51.96 49.50 2fug s ALA 162 Cb 0.07 -1.75 -0.05 0.00 0.00 0.00 0.00 23.12 21.39 2fug s ALA 162 CO 0.11 -2.05 0.17 1.52 0.00 0.00 0.00 175.76 175.51 2fug s TYR 163 N 0.23 3.50 0.00 0.00 -0.85 -1.26 -4.47 117.35 114.50 2fug s TYR 163 Ca 0.23 0.47 0.00 0.00 -0.52 0.00 0.00 57.07 57.25 2fug s TYR 163 Cb -0.13 -2.11 0.00 0.00 0.38 0.00 0.00 41.96 40.10 2fug s TYR 163 CO -0.08 0.46 0.00 0.09 -1.52 0.00 0.00 175.55 174.50 2fug n ASN 164 N 2.89 1.18 0.00 -0.18 5.03 -1.15 -4.81 115.26 118.22 2fug n ASN 164 Ca -0.17 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.28 2fug n ASN 164 Cb 0.53 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.29 2fug n ASN 164 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.26 176.64 2fug n GLU 165 N -2.62 0.00 0.00 3.52 0.00 -1.26 -4.30 120.64 115.99 2fug n GLU 165 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2fug n GLU 165 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.81 2fug n GLU 165 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.13 175.00 2fug n ARG 166 N 0.00 0.00 -0.04 5.31 0.63 -1.26 -4.40 116.66 116.90 2fug n ARG 166 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2fug n ARG 166 Cb 0.00 -1.47 0.00 0.00 0.45 0.00 0.00 32.46 31.44 2fug n ARG 166 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 2fug n GLY 167 N -0.65 0.98 3.87 5.14 0.00 -1.26 -5.09 105.19 108.18 2fug n GLY 167 Ca 0.00 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.70 2fug n GLY 167 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2fug s GLU 168 N -0.68 3.82 -0.07 1.61 2.02 -1.26 -4.97 118.70 119.16 2fug s GLU 168 Ca 0.00 0.37 -0.30 0.00 0.02 0.00 0.00 54.97 55.06 2fug s GLU 168 Cb 0.00 -2.53 -0.03 0.00 0.10 0.00 0.00 34.13 31.67 2fug s GLU 168 CO 0.00 0.18 1.19 1.03 0.02 0.00 0.00 175.26 177.67 2fug s ARG 169 N -3.22 4.34 -0.13 1.61 1.81 -1.26 -2.95 118.95 119.15 2fug s ARG 169 Ca 0.49 1.64 -0.15 0.00 -1.72 0.00 0.00 55.73 55.99 2fug s ARG 169 Cb -0.11 -3.58 -0.05 0.00 -0.45 0.00 0.00 34.95 30.77 2fug s ARG 169 CO 0.24 -0.46 0.37 -0.51 -0.68 0.00 0.00 175.30 174.26 2fug s LEU 170 N 2.34 4.28 0.87 2.53 1.43 -1.26 -4.96 118.68 123.91 2fug s LEU 170 Ca 0.55 0.67 -0.10 0.00 -1.03 0.00 0.00 54.13 54.21 2fug s LEU 170 Cb -0.24 -2.51 0.12 0.00 0.03 0.00 0.00 46.19 43.59 2fug s LEU 170 CO 0.21 0.09 1.11 -2.16 0.23 0.00 0.00 176.35 175.83 2fug s PRO 171 N 0.36 1.44 0.08 1.29 0.04 -1.26 -4.77 135.00 132.17 2fug s PRO 171 Ca 0.21 1.30 0.15 0.00 0.04 0.00 0.00 61.00 62.70 2fug s PRO 171 Cb -0.14 -1.79 -0.13 0.00 0.04 0.00 0.00 34.50 32.48 2fug s PRO 171 CO 0.07 -2.26 0.91 -1.35 0.04 0.00 0.00 177.00 174.42 2fug h PRO 172 N -1.59 0.00 0.00 0.56 0.11 -1.86 -3.46 132.00 125.76 2fug h PRO 172 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 2fug h PRO 172 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2fug h PRO 172 CO 0.47 0.38 0.00 1.33 -0.21 0.00 0.00 178.00 179.97 2fug n VAL 173 N -2.98 0.00 -3.63 3.15 0.24 -1.26 -4.42 118.33 109.42 2fug n VAL 173 Ca -0.09 0.00 -0.29 0.00 -2.04 0.00 0.00 64.34 61.92 2fug n VAL 173 Cb 0.86 -0.71 -0.13 0.00 -1.47 0.00 0.00 33.84 32.38 2fug n VAL 173 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2fug s ALA 174 N -2.00 1.56 0.00 2.33 0.00 -1.26 -4.99 121.76 117.39 2fug s ALA 174 Ca 0.00 -2.07 0.00 0.00 0.00 0.00 0.00 51.96 49.89 2fug s ALA 174 Cb 0.00 -1.71 0.00 0.00 0.00 0.00 0.00 23.12 21.41 2fug s ALA 174 CO 0.00 -1.96 0.00 0.00 0.00 0.00 0.00 175.76 173.80