#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gif s PRO 2 N 0.00 2.12 -0.06 0.03 0.02 -1.22 -4.12 135.00 131.76 1gif s PRO 2 Ca 0.00 -1.87 0.01 0.00 0.02 0.00 0.00 61.00 59.16 1gif s PRO 2 Cb 0.00 -1.89 0.02 0.00 0.02 0.00 0.00 34.50 32.65 1gif s PRO 2 CO 0.00 -0.02 -0.06 -1.64 -0.33 0.00 0.00 177.00 174.95 1gif s MET 3 N -3.80 1.13 -0.08 5.54 -1.94 0.10 -1.15 119.30 119.10 1gif s MET 3 Ca 0.38 -0.18 0.03 0.00 -1.71 0.00 0.00 55.69 54.21 1gif s MET 3 Cb 0.04 -1.12 0.01 0.00 2.01 0.00 0.00 34.83 35.76 1gif s MET 3 CO 0.20 -0.12 -0.18 0.12 -0.01 0.00 0.00 175.02 175.04 1gif s PHE 4 N 1.13 2.04 -0.06 -0.03 5.36 -0.07 -0.63 117.98 125.72 1gif s PHE 4 Ca -0.07 -0.82 0.05 0.00 -0.96 0.00 0.00 56.93 55.13 1gif s PHE 4 Cb -0.14 -1.41 -0.00 0.00 -0.34 0.00 0.00 43.02 41.12 1gif s PHE 4 CO -0.01 -0.36 -0.20 0.42 -1.46 0.00 0.00 175.22 173.61 1gif s ILE 5 N 0.51 1.69 -0.12 3.12 1.01 -0.37 -1.13 121.20 125.92 1gif s ILE 5 Ca -0.17 -0.85 0.02 0.00 0.00 0.00 0.00 60.65 59.66 1gif s ILE 5 Cb -0.17 -1.45 0.01 0.00 0.01 0.00 0.00 42.46 40.86 1gif s ILE 5 CO 0.06 0.48 -0.19 -0.69 0.00 0.00 0.00 174.94 174.60 1gif s VAL 6 N 0.08 1.80 -0.16 2.92 1.01 0.69 -1.43 120.40 125.31 1gif s VAL 6 Ca -0.07 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1gif s VAL 6 Cb -0.14 -1.61 0.01 0.00 0.00 0.00 0.00 36.38 34.65 1gif s VAL 6 CO 0.04 0.50 -0.20 0.20 0.00 0.00 0.00 175.10 175.64 1gif s ASN 7 N 0.80 3.22 0.08 3.32 0.01 -0.18 0.10 114.94 122.28 1gif s ASN 7 Ca -0.09 -0.61 -0.06 0.00 -0.71 0.00 0.00 52.86 51.39 1gif s ASN 7 Cb -0.16 -1.48 -0.01 0.00 0.41 0.00 0.00 41.25 40.01 1gif s ASN 7 CO 0.00 0.04 0.13 0.28 -1.51 0.00 0.00 177.10 176.04 1gif s THR 8 N 1.07 0.16 -2.44 1.60 -1.32 -0.18 -1.00 115.64 113.54 1gif s THR 8 Ca -0.01 -1.36 0.23 0.00 -1.21 0.00 0.00 61.69 59.34 1gif s THR 8 Cb -0.14 -1.41 0.44 0.00 -1.51 0.00 0.00 72.50 69.88 1gif s THR 8 CO -0.07 -0.74 1.53 -0.46 -2.21 0.00 0.00 174.62 172.68 1gif n ASN 9 N -0.02 2.09 -4.77 8.08 6.94 -1.20 -1.23 115.26 125.15 1gif n ASN 9 Ca -0.14 -1.75 -0.38 0.00 -0.02 0.00 0.00 54.58 52.29 1gif n ASN 9 Cb 0.62 -0.10 -0.04 0.00 -2.36 0.00 0.00 39.78 37.90 1gif n ASN 9 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1gif s VAL 10 N -1.81 3.63 0.43 3.53 1.01 -1.26 -4.35 120.40 121.57 1gif s VAL 10 Ca 0.34 1.40 -0.25 0.00 0.00 0.00 0.00 61.98 63.47 1gif s VAL 10 Cb 0.19 -3.80 -0.08 0.00 0.00 0.00 0.00 36.38 32.69 1gif s VAL 10 CO 0.29 0.16 1.26 -2.16 0.00 0.00 0.00 175.10 174.65 1gif s PRO 11 N -2.05 3.85 0.28 2.72 0.04 -1.26 0.46 135.00 139.04 1gif s PRO 11 Ca 0.52 2.04 0.02 0.00 0.04 0.00 0.00 61.00 63.62 1gif s PRO 11 Cb -0.26 -2.62 0.63 0.00 0.04 0.00 0.00 34.50 32.28 1gif s PRO 11 CO 0.33 -0.55 1.76 -0.09 0.04 0.00 0.00 177.00 178.48 1gif h ARG 12 N 2.42 0.61 0.00 4.56 2.43 -1.93 -0.21 114.38 122.26 1gif h ARG 12 Ca -0.50 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.64 1gif h ARG 12 Cb 1.25 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1gif h ARG 12 CO 0.61 0.41 0.00 0.00 -1.51 0.00 0.00 179.97 179.48 1gif h ALA 13 N 1.61 1.00 -0.00 2.80 0.00 -2.02 -1.33 119.26 121.31 1gif h ALA 13 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.42 1gif h ALA 13 Cb 0.79 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1gif h ALA 13 CO -0.39 0.00 -0.20 0.43 0.00 0.00 0.00 179.25 179.09 1gif n SER 14 N -2.80 0.53 -4.63 0.00 7.64 -0.09 -4.83 113.62 109.43 1gif n SER 14 Ca -0.02 -0.45 -0.43 0.00 1.01 0.00 0.00 58.87 58.99 1gif n SER 14 Cb 0.10 -0.02 -0.03 0.00 -1.01 0.00 0.00 64.21 63.24 1gif n SER 14 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1gif s VAL 15 N -2.64 4.63 0.51 0.44 1.01 -0.51 -4.85 120.40 119.00 1gif s VAL 15 Ca 0.23 1.58 -0.22 0.00 0.00 0.00 0.00 61.98 63.57 1gif s VAL 15 Cb 0.19 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 32.20 1gif s VAL 15 CO 0.53 -0.36 1.24 -2.16 0.00 0.00 0.00 175.10 174.35 1gif s PRO 16 N 3.35 3.41 0.30 2.72 0.04 -1.26 -4.93 135.00 138.63 1gif s PRO 16 Ca 0.41 1.95 -0.30 0.00 0.04 0.00 0.00 61.00 63.10 1gif s PRO 16 Cb -0.13 -2.28 -0.12 0.00 0.04 0.00 0.00 34.50 32.01 1gif s PRO 16 CO 0.13 -0.88 1.54 -3.47 0.04 0.00 0.00 177.00 174.36 1gif n ASP 17 N -0.85 3.63 0.00 6.66 2.03 -1.26 -1.29 116.55 125.47 1gif n ASP 17 Ca 0.09 1.16 0.00 0.00 0.52 0.00 0.00 54.79 56.56 1gif n ASP 17 Cb 0.47 -1.57 0.00 0.00 -0.72 0.00 0.00 41.12 39.31 1gif n ASP 17 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1gif n GLY 18 N 1.93 3.31 0.26 0.27 0.00 -1.26 -4.96 105.19 104.74 1gif n GLY 18 Ca 0.08 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.14 1gif n GLY 18 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1gif h PHE 19 N 0.00 0.05 -0.54 1.61 3.57 -1.56 -0.06 116.94 120.02 1gif h PHE 19 Ca 0.00 0.05 0.02 0.00 3.53 0.00 0.00 57.97 61.56 1gif h PHE 19 Cb 0.00 0.09 -0.03 0.00 2.79 0.00 0.00 35.95 38.79 1gif h PHE 19 CO 0.00 -0.17 0.34 -0.07 -2.23 0.00 0.00 178.31 176.18 1gif h LEU 20 N 0.16 0.56 -0.15 0.59 4.07 -1.93 -0.85 115.31 117.76 1gif h LEU 20 Ca 0.38 -0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.33 1gif h LEU 20 Cb 0.65 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.25 1gif h LEU 20 CO -0.57 0.40 0.08 0.28 -1.08 0.00 0.00 178.44 177.56 1gif h SER 21 N 0.68 0.19 -0.59 -0.43 0.02 -1.80 0.11 113.55 111.73 1gif h SER 21 Ca 0.21 -0.09 0.05 0.00 -0.84 0.00 0.00 61.79 61.12 1gif h SER 21 Cb -0.02 -0.05 -0.05 0.00 0.14 0.00 0.00 62.40 62.42 1gif h SER 21 CO -0.07 0.23 0.32 -0.08 -1.14 0.00 0.00 176.83 176.09 1gif h GLU 22 N 0.14 0.59 -0.30 3.45 4.81 -0.74 0.00 114.58 122.53 1gif h GLU 22 Ca 0.05 -0.04 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1gif h GLU 22 Cb 0.08 -0.13 -0.01 0.00 0.63 0.00 0.00 28.75 29.31 1gif h GLU 22 CO -0.01 0.39 0.17 -0.07 -0.73 0.00 0.00 179.01 178.76 1gif h LEU 23 N 0.61 0.38 -0.78 1.64 3.38 -0.92 0.21 115.31 119.82 1gif h LEU 23 Ca 0.26 -0.08 0.04 0.00 0.09 0.00 0.00 57.88 58.18 1gif h LEU 23 Cb 0.14 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 1gif h LEU 23 CO -0.16 0.35 0.49 0.74 0.09 0.00 0.00 178.44 179.95 1gif h THR 24 N 0.37 1.10 -0.21 0.22 2.02 -0.45 -0.84 112.91 115.11 1gif h THR 24 Ca 0.11 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 66.94 1gif h THR 24 Cb 0.06 0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.52 1gif h THR 24 CO -0.02 0.17 0.04 1.56 0.37 0.00 0.00 175.52 177.65 1gif h GLN 25 N 0.95 0.34 -0.62 6.66 4.20 -0.44 -1.72 115.11 124.48 1gif h GLN 25 Ca 0.32 -0.09 -0.08 0.00 0.06 0.00 0.00 58.65 58.86 1gif h GLN 25 Cb 0.05 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 27.76 1gif h GLN 25 CO -0.13 0.48 0.06 1.96 -0.67 0.00 0.00 178.83 180.53 1gif h GLN 26 N 0.15 1.05 -0.31 1.46 1.08 -0.42 -2.10 115.11 116.01 1gif h GLN 26 Ca 0.06 -0.30 -0.13 0.00 -1.45 0.00 0.00 58.65 56.83 1gif h GLN 26 Cb 0.30 -0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 1gif h GLN 26 CO 0.00 0.99 -0.35 -0.07 -0.95 0.00 0.00 178.83 178.45 1gif h LEU 27 N 0.97 0.74 -0.45 1.46 3.38 -1.15 0.27 115.31 120.54 1gif h LEU 27 Ca 0.19 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 57.86 1gif h LEU 27 Cb 0.48 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.99 1gif h LEU 27 CO 0.02 1.02 0.27 0.00 0.09 0.00 0.00 178.44 179.84 1gif h ALA 28 N 1.02 0.57 -0.36 1.53 0.00 -1.12 0.42 119.26 121.32 1gif h ALA 28 Ca 0.06 -0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1gif h ALA 28 Cb 0.88 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1gif h ALA 28 CO 0.08 -0.05 -0.22 1.96 0.00 0.00 0.00 179.25 181.01 1gif h GLN 29 N 0.53 0.69 -0.19 0.00 4.20 -1.10 0.20 115.11 119.45 1gif h GLN 29 Ca 0.18 -0.27 -0.17 0.00 0.06 0.00 0.00 58.65 58.45 1gif h GLN 29 Cb 0.02 -0.04 -0.00 0.00 0.30 0.00 0.00 27.48 27.75 1gif h GLN 29 CO -0.08 0.86 -0.57 0.00 -0.67 0.00 0.00 178.83 178.36 1gif h ALA 30 N 1.14 0.65 0.00 3.87 0.00 0.36 -3.29 119.26 121.99 1gif h ALA 30 Ca 0.09 -0.52 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1gif h ALA 30 Cb 0.71 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1gif h ALA 30 CO 0.05 0.69 -1.16 0.25 0.00 0.00 0.00 179.25 179.09 1gif n THR 31 N -3.95 0.00 -1.13 0.00 -2.24 0.14 -4.97 114.28 102.13 1gif n THR 31 Ca -0.04 -0.08 -0.03 0.00 -2.27 0.00 0.00 64.05 61.63 1gif n THR 31 Cb 0.62 0.82 -0.01 0.00 -2.10 0.00 0.00 70.33 69.66 1gif n THR 31 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1gif n GLY 32 N 1.46 0.62 3.69 3.38 0.00 0.71 -4.99 105.19 110.06 1gif n GLY 32 Ca 0.03 -0.92 -0.34 0.00 0.00 0.00 0.00 46.02 44.79 1gif n GLY 32 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1gif s LYS 33 N -2.35 2.90 0.44 1.61 1.02 -1.20 -5.06 119.74 117.10 1gif s LYS 33 Ca 0.00 -0.50 -0.25 0.00 0.02 0.00 0.00 55.97 55.24 1gif s LYS 33 Cb 0.00 -2.75 -0.08 0.00 -0.52 0.00 0.00 37.83 34.48 1gif s LYS 33 CO 0.00 0.66 1.34 -1.25 -0.92 0.00 0.00 175.35 175.19 1gif s PRO 34 N -1.26 3.78 0.55 -1.68 0.04 -1.26 -4.51 135.00 130.66 1gif s PRO 34 Ca 0.17 2.23 0.31 0.00 0.04 0.00 0.00 61.00 63.76 1gif s PRO 34 Cb -0.11 -2.66 1.48 0.00 0.04 0.00 0.00 34.50 33.24 1gif s PRO 34 CO 0.07 -0.67 1.87 -1.35 0.04 0.00 0.00 177.00 176.96 1gif h PRO 35 N 2.41 0.00 -0.95 0.56 0.11 -1.92 -0.36 132.00 131.85 1gif h PRO 35 Ca -0.50 0.00 0.20 0.00 0.11 0.00 0.00 66.00 65.81 1gif h PRO 35 Cb 1.26 0.00 -0.08 0.00 0.11 0.00 0.00 31.00 32.29 1gif h PRO 35 CO 0.61 0.00 0.61 -0.56 -0.21 0.00 0.00 178.00 178.45 1gif h GLN 36 N 0.00 0.54 -0.01 1.05 -0.00 -1.97 -1.01 115.11 113.70 1gif h GLN 36 Ca 0.40 -0.03 0.00 0.00 -0.00 0.00 0.00 58.65 59.02 1gif h GLN 36 Cb 1.69 -0.12 0.00 0.00 -0.00 0.00 0.00 27.48 29.05 1gif h GLN 36 CO -0.00 0.36 -0.29 0.66 -0.00 0.00 0.00 178.83 179.55 1gif n TYR 37 N -4.60 0.00 -3.02 0.06 4.01 -0.15 -4.90 117.16 108.56 1gif n TYR 37 Ca 0.21 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.55 1gif n TYR 37 Cb 0.65 -0.12 -0.05 0.00 -0.31 0.00 0.00 39.34 39.51 1gif n TYR 37 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1gif s ILE 38 N -2.54 5.00 -0.07 -0.72 1.01 -0.39 -3.45 121.20 120.04 1gif s ILE 38 Ca 0.23 1.51 0.02 0.00 0.00 0.00 0.00 60.65 62.41 1gif s ILE 38 Cb 0.19 -4.07 -0.03 0.00 0.01 0.00 0.00 42.46 38.57 1gif s ILE 38 CO 0.54 0.26 -0.12 0.00 0.00 0.00 0.00 174.94 175.62 1gif s ALA 39 N 0.70 2.75 -0.02 9.38 0.00 -0.30 -4.98 121.76 129.28 1gif s ALA 39 Ca 0.39 -0.94 0.03 0.00 0.00 0.00 0.00 51.96 51.44 1gif s ALA 39 Cb -0.18 -1.09 0.00 0.00 0.00 0.00 0.00 23.12 21.85 1gif s ALA 39 CO 0.19 0.50 -0.10 0.08 0.00 0.00 0.00 175.76 176.43 1gif s VAL 40 N -0.54 0.88 -0.10 0.00 1.01 -1.26 -0.89 120.40 119.50 1gif s VAL 40 Ca 0.08 -0.42 -0.03 0.00 0.00 0.00 0.00 61.98 61.60 1gif s VAL 40 Cb -0.12 -0.77 0.05 0.00 0.00 0.00 0.00 36.38 35.54 1gif s VAL 40 CO 0.02 0.27 0.15 -2.28 0.00 0.00 0.00 175.10 173.25 1gif s HIS 41 N 0.09 -0.12 -0.16 5.22 5.04 -0.28 -4.98 115.29 120.10 1gif s HIS 41 Ca -0.02 0.45 -0.03 0.00 -1.54 0.00 0.00 55.06 53.92 1gif s HIS 41 Cb -0.08 -0.34 -0.02 0.00 0.04 0.00 0.00 32.58 32.18 1gif s HIS 41 CO 0.00 -0.31 -0.06 0.08 -2.34 0.00 0.00 174.74 172.12 1gif s VAL 42 N 2.27 3.62 -0.34 0.89 1.01 -1.26 -0.22 120.40 126.36 1gif s VAL 42 Ca 0.04 -0.45 0.03 0.00 0.00 0.00 0.00 61.98 61.60 1gif s VAL 42 Cb -0.13 -2.58 0.10 0.00 0.00 0.00 0.00 36.38 33.77 1gif s VAL 42 CO -0.06 0.49 0.07 -0.69 0.00 0.00 0.00 175.10 174.90 1gif s VAL 43 N 0.56 1.94 0.49 2.92 1.01 0.28 -4.96 120.40 122.65 1gif s VAL 43 Ca -0.04 -2.16 -0.03 0.00 0.00 0.00 0.00 61.98 59.76 1gif s VAL 43 Cb -0.15 -2.44 0.10 0.00 0.00 0.00 0.00 36.38 33.90 1gif s VAL 43 CO 0.03 -0.63 0.68 -0.81 0.00 0.00 0.00 175.10 174.36 1gif n PRO 44 N 4.34 -0.07 -2.16 2.72 -0.04 -1.26 -1.01 135.00 137.53 1gif n PRO 44 Ca 0.03 -1.61 -0.19 0.00 -0.04 0.00 0.00 63.50 61.68 1gif n PRO 44 Cb 0.42 -0.52 -0.03 0.00 -0.04 0.00 0.00 33.50 33.32 1gif n PRO 44 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1gif n ASP 45 N -3.08 -5.44 -4.86 3.54 8.00 0.17 -4.81 116.55 110.07 1gif n ASP 45 Ca 0.10 0.16 -0.31 0.00 0.71 0.00 0.00 54.79 55.45 1gif n ASP 45 Cb 0.37 -4.62 -0.03 0.00 -0.02 0.00 0.00 41.12 36.81 1gif n ASP 45 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1gif s GLN 46 N -4.63 3.84 -0.50 -1.24 -1.52 -0.37 -4.95 119.66 110.29 1gif s GLN 46 Ca 0.00 0.67 -0.22 0.00 -1.95 0.00 0.00 55.36 53.86 1gif s GLN 46 Cb 0.00 -2.28 0.04 0.00 -0.22 0.00 0.00 33.01 30.55 1gif s GLN 46 CO 0.00 -0.15 0.78 -1.17 -0.25 0.00 0.00 175.29 174.50 1gif s LEU 47 N -3.99 4.43 0.19 2.90 2.96 -1.26 -4.21 118.68 119.70 1gif s LEU 47 Ca 0.54 -0.46 -0.11 0.00 -0.22 0.00 0.00 54.13 53.89 1gif s LEU 47 Cb -0.10 -2.74 -0.00 0.00 0.50 0.00 0.00 46.19 43.85 1gif s LEU 47 CO 0.32 -1.01 0.36 -0.04 -1.32 0.00 0.00 176.35 174.66 1gif s MET 48 N 3.30 1.29 0.00 1.98 -1.94 -1.26 -5.07 119.30 117.60 1gif s MET 48 Ca 0.25 -1.17 -0.12 0.00 -1.71 0.00 0.00 55.69 52.93 1gif s MET 48 Cb -0.14 0.41 0.02 0.00 2.01 0.00 0.00 34.83 37.13 1gif s MET 48 CO 0.18 -0.50 0.26 0.00 -0.01 0.00 0.00 175.02 174.95 1gif s ALA 49 N -3.98 -0.63 -0.09 3.03 0.00 -1.26 -4.73 121.76 114.10 1gif s ALA 49 Ca 0.18 0.12 -0.03 0.00 0.00 0.00 0.00 51.96 52.24 1gif s ALA 49 Cb 0.02 0.14 0.04 0.00 0.00 0.00 0.00 23.12 23.31 1gif s ALA 49 CO 0.02 -0.28 0.05 0.12 0.00 0.00 0.00 175.76 175.68 1gif s PHE 50 N -1.62 0.34 -0.88 0.00 2.19 -0.67 -4.71 117.98 112.62 1gif s PHE 50 Ca -0.12 -0.10 0.00 0.00 0.33 0.00 0.00 56.93 57.04 1gif s PHE 50 Cb -0.05 -0.67 0.00 0.00 -1.31 0.00 0.00 43.02 41.00 1gif s PHE 50 CO 0.02 -0.34 0.00 0.41 1.83 0.00 0.00 175.22 177.14 1gif n GLY 51 N 5.23 1.02 2.10 13.12 0.00 -1.26 -2.18 105.19 123.22 1gif n GLY 51 Ca -0.06 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1gif n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gif n GLY 52 N -1.92 0.57 3.41 -0.02 0.00 -1.26 -5.01 105.19 100.96 1gif n GLY 52 Ca -0.08 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.65 1gif n GLY 52 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1gif s SER 53 N -2.13 3.38 -0.28 1.61 0.15 -0.93 -5.02 113.70 110.49 1gif s SER 53 Ca 0.00 -0.78 0.11 0.00 0.70 0.00 0.00 55.95 55.98 1gif s SER 53 Cb 0.00 -0.25 0.64 0.00 -1.71 0.00 0.00 66.02 64.71 1gif s SER 53 CO 0.00 0.16 1.64 -1.54 1.20 0.00 0.00 173.24 174.70 1gif n SER 54 N 0.69 4.12 -4.71 5.45 3.41 -1.26 -1.68 113.62 119.64 1gif n SER 54 Ca -0.16 -3.28 -0.31 0.00 -0.26 0.00 0.00 58.87 54.86 1gif n SER 54 Cb 0.54 -0.67 0.14 0.00 -0.26 0.00 0.00 64.21 63.96 1gif n SER 54 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1gif s GLU 55 N -3.01 1.43 0.15 4.33 0.41 -1.26 -4.85 118.70 115.90 1gif s GLU 55 Ca 0.50 1.28 -0.34 0.00 -0.41 0.00 0.00 54.97 56.00 1gif s GLU 55 Cb 0.41 -1.79 -0.16 0.00 -1.78 0.00 0.00 34.13 30.80 1gif s GLU 55 CO 0.10 -2.25 1.21 -2.30 -0.49 0.00 0.00 175.26 171.52 1gif n PRO 56 N -3.95 1.17 -3.93 0.39 -0.02 -1.26 -4.82 135.00 122.58 1gif n PRO 56 Ca 0.10 0.42 -0.10 0.00 -2.02 0.00 0.00 63.50 61.90 1gif n PRO 56 Cb 0.53 -1.95 -0.02 0.00 -0.02 0.00 0.00 33.50 32.04 1gif n PRO 56 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1gif s ALA 58 N -3.24 -1.17 -0.12 0.00 0.00 -1.00 -3.21 121.76 113.02 1gif s ALA 58 Ca 0.19 0.96 0.02 0.00 0.00 0.00 0.00 51.96 53.13 1gif s ALA 58 Cb -0.03 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.82 1gif s ALA 58 CO 0.12 -0.27 -0.18 -0.51 0.00 0.00 0.00 175.76 174.91 1gif s LEU 59 N -0.68 1.90 0.20 0.00 1.43 -0.17 -1.72 118.68 119.64 1gif s LEU 59 Ca -0.08 -0.51 0.02 0.00 -1.03 0.00 0.00 54.13 52.53 1gif s LEU 59 Cb -0.03 -1.25 -0.05 0.00 0.03 0.00 0.00 46.19 44.89 1gif s LEU 59 CO 0.04 0.05 0.03 0.00 0.23 0.00 0.00 176.35 176.70 1gif s SER 61 N -3.21 0.04 -0.12 0.00 1.04 -0.51 -0.62 113.70 110.31 1gif s SER 61 Ca 0.28 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.55 1gif s SER 61 Cb 0.07 0.20 0.02 0.00 0.10 0.00 0.00 66.02 66.40 1gif s SER 61 CO 0.07 -0.29 -0.11 -0.22 0.98 0.00 0.00 173.24 173.67 1gif s LEU 62 N -1.10 1.41 -0.09 2.42 2.96 0.42 -1.24 118.68 123.46 1gif s LEU 62 Ca -0.12 -0.36 0.03 0.00 -0.22 0.00 0.00 54.13 53.45 1gif s LEU 62 Cb -0.07 -0.96 -0.01 0.00 0.50 0.00 0.00 46.19 45.65 1gif s LEU 62 CO 0.01 -0.08 -0.18 -1.00 -1.32 0.00 0.00 176.35 173.79 1gif s HIS 63 N 1.48 2.67 -0.00 5.38 3.76 0.19 -1.13 115.29 127.64 1gif s HIS 63 Ca 0.02 -0.63 -0.08 0.00 -0.15 0.00 0.00 55.06 54.22 1gif s HIS 63 Cb -0.13 -1.73 0.00 0.00 1.11 0.00 0.00 32.58 31.83 1gif s HIS 63 CO -0.07 -0.17 0.15 0.45 -0.85 0.00 0.00 174.74 174.25 1gif s SER 64 N 0.03 -0.00 -0.67 1.40 0.15 -0.26 -0.72 113.70 113.63 1gif s SER 64 Ca -0.06 -0.16 -0.21 0.00 0.70 0.00 0.00 55.95 56.22 1gif s SER 64 Cb -0.15 0.22 0.09 0.00 -1.71 0.00 0.00 66.02 64.47 1gif s SER 64 CO 0.05 -0.36 0.91 -0.63 1.20 0.00 0.00 173.24 174.41 1gif s ILE 65 N -1.30 4.52 0.04 6.45 1.01 -1.26 0.13 121.20 130.78 1gif s ILE 65 Ca -0.14 -0.70 0.00 0.00 0.00 0.00 0.00 60.65 59.82 1gif s ILE 65 Cb -0.07 -4.64 0.00 0.00 0.01 0.00 0.00 42.46 37.76 1gif s ILE 65 CO 0.02 -1.37 0.00 0.61 0.00 0.00 0.00 174.94 174.19 1gif n GLY 66 N 5.33 -1.39 2.21 6.18 0.00 -1.26 -4.78 105.19 111.48 1gif n GLY 66 Ca -0.02 -1.49 -0.07 0.00 0.00 0.00 0.00 46.02 44.43 1gif n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1gif n LYS 67 N -1.46 -0.51 -5.13 1.61 4.76 -1.26 -4.91 118.16 111.26 1gif n LYS 67 Ca 0.00 0.75 -0.30 0.00 -2.87 0.00 0.00 58.31 55.90 1gif n LYS 67 Cb 0.07 -4.57 -0.16 0.00 -1.84 0.00 0.00 35.03 28.53 1gif n LYS 67 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1gif s ILE 68 N -2.27 1.87 0.00 -0.18 -1.09 -1.26 -4.86 121.20 113.40 1gif s ILE 68 Ca 0.00 -0.95 0.00 0.00 -2.23 0.00 0.00 60.65 57.47 1gif s ILE 68 Cb 0.00 -1.59 0.00 0.00 -1.58 0.00 0.00 42.46 39.29 1gif s ILE 68 CO 0.00 0.52 0.00 0.61 -1.23 0.00 0.00 174.94 174.84 1gif n GLY 69 N 3.12 0.10 0.07 6.18 0.00 -1.26 -4.97 105.19 108.43 1gif n GLY 69 Ca -0.18 -1.04 -0.02 0.00 0.00 0.00 0.00 46.02 44.78 1gif n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gif n GLY 70 N -0.43 -2.75 0.17 -0.02 0.00 -1.26 0.29 105.19 101.19 1gif n GLY 70 Ca 0.00 0.63 -0.09 0.00 0.00 0.00 0.00 46.02 46.57 1gif n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gif h ALA 71 N -0.65 0.65 -0.73 4.61 0.00 -2.00 -3.05 119.26 118.08 1gif h ALA 71 Ca 0.03 -0.59 -0.04 0.00 0.00 0.00 0.00 54.91 54.31 1gif h ALA 71 Cb 0.07 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1gif h ALA 71 CO -0.16 0.76 0.31 1.96 0.00 0.00 0.00 179.25 182.12 1gif h GLN 72 N 0.26 1.09 -0.40 0.00 7.50 -1.75 -2.66 115.11 119.14 1gif h GLN 72 Ca -0.02 -0.19 -0.01 0.00 0.50 0.00 0.00 58.65 58.93 1gif h GLN 72 Cb 1.25 -0.18 -0.02 0.00 0.05 0.00 0.00 27.48 28.58 1gif h GLN 72 CO 0.12 0.88 0.20 -0.91 -1.50 0.00 0.00 178.83 177.62 1gif h ASN 73 N 1.05 0.49 -0.35 1.46 2.35 -0.11 0.68 115.58 121.15 1gif h ASN 73 Ca 0.25 -0.03 -0.02 0.00 -0.55 0.00 0.00 56.30 55.94 1gif h ASN 73 Cb 0.19 -0.12 -0.02 0.00 0.05 0.00 0.00 38.32 38.42 1gif h ASN 73 CO -0.02 0.41 0.12 -0.09 -1.65 0.00 0.00 177.43 176.20 1gif h ARG 74 N 0.56 0.53 -0.15 0.81 2.43 -1.39 0.40 114.38 117.57 1gif h ARG 74 Ca 0.14 -0.11 -0.18 0.00 -0.81 0.00 0.00 59.98 59.03 1gif h ARG 74 Cb 0.04 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.51 1gif h ARG 74 CO -0.02 0.54 -0.65 0.66 -1.51 0.00 0.00 179.97 178.99 1gif h SER 75 N 0.41 0.64 -0.68 -3.80 4.64 -1.02 -1.36 113.55 112.38 1gif h SER 75 Ca 0.11 -0.38 -0.01 0.00 -0.47 0.00 0.00 61.79 61.05 1gif h SER 75 Cb 0.22 -0.19 -0.03 0.00 -0.31 0.00 0.00 62.40 62.09 1gif h SER 75 CO -0.01 1.12 0.40 1.88 -0.87 0.00 0.00 176.83 179.35 1gif h TYR 76 N 0.40 0.92 -0.45 4.77 0.05 -0.73 -0.74 116.97 121.20 1gif h TYR 76 Ca -0.01 -0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.75 1gif h TYR 76 Cb 1.22 -0.30 -0.02 0.00 1.01 0.00 0.00 36.73 38.63 1gif h TYR 76 CO 0.05 0.63 0.22 0.77 -1.05 0.00 0.00 178.16 178.79 1gif h SER 77 N 0.96 0.58 -0.27 3.88 0.02 -0.51 0.68 113.55 118.90 1gif h SER 77 Ca 0.25 -0.12 -0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1gif h SER 77 Cb -0.01 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.37 1gif h SER 77 CO -0.04 0.53 0.15 0.50 -1.14 0.00 0.00 176.83 176.83 1gif h LYS 78 N 0.58 0.37 0.60 3.45 1.63 -1.00 0.23 116.57 122.43 1gif h LYS 78 Ca 0.16 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.88 1gif h LYS 78 Cb 0.10 -0.07 0.01 0.00 -0.60 0.00 0.00 32.23 31.66 1gif h LYS 78 CO -0.02 0.32 -0.29 1.25 -3.45 0.00 0.00 179.45 177.26 1gif h LEU 79 N 0.33 -0.69 -0.45 5.20 5.85 -0.70 -1.10 115.31 123.75 1gif h LEU 79 Ca 0.10 0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.76 1gif h LEU 79 Cb 0.05 0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 1gif h LEU 79 CO -0.02 -0.45 0.07 -0.07 -0.34 0.00 0.00 178.44 177.64 1gif h LEU 80 N -0.88 0.71 -1.35 2.25 3.38 0.40 -0.66 115.31 119.17 1gif h LEU 80 Ca -0.08 -0.26 -0.05 0.00 0.09 0.00 0.00 57.88 57.58 1gif h LEU 80 Cb 0.65 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.19 1gif h LEU 80 CO 0.14 0.79 -0.07 0.00 0.09 0.00 0.00 178.44 179.39 1gif h GLY 82 N 0.76 0.99 1.25 0.00 0.00 -0.48 -0.67 103.07 104.92 1gif h GLY 82 Ca 0.07 -0.54 -0.14 0.00 0.00 0.00 0.00 47.33 46.72 1gif h GLY 82 CO 0.02 0.51 -0.31 1.41 0.00 0.00 0.00 176.54 178.16 1gif h LEU 83 N 0.86 0.87 -1.34 3.11 3.38 -0.34 -1.25 115.31 120.61 1gif h LEU 83 Ca 0.21 -0.36 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 1gif h LEU 83 Cb 0.20 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 1gif h LEU 83 CO -0.02 1.11 -0.06 -0.07 0.09 0.00 0.00 178.44 179.49 1gif h LEU 84 N 0.71 0.34 -0.12 1.67 3.38 -1.15 0.64 115.31 120.78 1gif h LEU 84 Ca 0.08 -0.06 -0.06 0.00 0.09 0.00 0.00 57.88 57.92 1gif h LEU 84 Cb 0.86 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 41.52 1gif h LEU 84 CO 0.08 0.45 -0.17 0.00 0.09 0.00 0.00 178.44 178.89 1gif h ALA 85 N 1.59 0.18 -0.02 1.53 0.00 -0.86 0.16 119.26 121.85 1gif h ALA 85 Ca 0.07 -0.34 -0.22 0.00 0.00 0.00 0.00 54.91 54.42 1gif h ALA 85 Cb 0.34 -0.04 0.02 0.00 0.00 0.00 0.00 17.79 18.11 1gif h ALA 85 CO 0.02 0.09 -0.84 0.93 0.00 0.00 0.00 179.25 179.45 1gif h GLU 86 N -0.08 0.60 0.09 0.00 5.08 -0.86 -0.76 114.58 118.65 1gif h GLU 86 Ca 0.01 -0.62 -0.31 0.00 -1.00 0.00 0.00 59.36 57.45 1gif h GLU 86 Cb 0.72 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.12 1gif h GLU 86 CO 0.04 1.23 -1.61 0.00 -1.00 0.00 0.00 179.01 177.67 1gif h ARG 87 N 0.21 0.19 -0.01 2.33 2.47 0.21 -3.38 114.38 116.40 1gif h ARG 87 Ca -0.10 -0.32 0.00 0.00 -1.26 0.00 0.00 59.98 58.30 1gif h ARG 87 Cb 1.51 0.12 0.00 0.00 -1.65 0.00 0.00 29.97 29.95 1gif h ARG 87 CO 0.17 1.00 -0.48 1.28 0.56 0.00 0.00 179.97 182.50 1gif n LEU 88 N -3.37 1.10 -1.64 3.04 4.77 0.01 -4.69 117.00 116.23 1gif n LEU 88 Ca -0.18 -0.63 -0.13 0.00 -0.03 0.00 0.00 56.01 55.03 1gif n LEU 88 Cb 1.04 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 42.14 1gif n LEU 88 CO 0.48 0.23 -0.10 0.54 -1.33 0.00 0.00 177.39 177.21 1gif n ARG 89 N -0.73 -1.80 -3.71 3.23 5.12 0.34 -4.95 116.66 114.16 1gif n ARG 89 Ca 0.04 0.59 -0.36 0.00 -1.93 0.00 0.00 57.85 56.20 1gif n ARG 89 Cb 0.26 -4.76 -0.07 0.00 -1.16 0.00 0.00 32.46 26.73 1gif n ARG 89 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1gif s ILE 90 N -2.75 5.39 0.18 0.55 1.01 -0.79 -4.95 121.20 119.85 1gif s ILE 90 Ca 0.07 0.29 -0.31 0.00 0.00 0.00 0.00 60.65 60.71 1gif s ILE 90 Cb -0.03 -3.50 -0.09 0.00 0.01 0.00 0.00 42.46 38.85 1gif s ILE 90 CO 0.09 0.47 1.44 -0.55 0.00 0.00 0.00 174.94 176.39 1gif s SER 91 N 0.05 6.72 0.60 3.58 0.15 -1.26 -3.58 113.70 119.96 1gif s SER 91 Ca 0.12 2.53 0.31 0.00 0.70 0.00 0.00 55.95 59.60 1gif s SER 91 Cb -0.12 -2.60 1.77 0.00 -1.71 0.00 0.00 66.02 63.36 1gif s SER 91 CO 0.01 -0.70 2.16 -0.65 1.20 0.00 0.00 173.24 175.26 1gif h PRO 92 N 6.02 0.00 -0.13 5.44 0.11 -1.96 -0.12 132.00 141.36 1gif h PRO 92 Ca -0.44 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1gif h PRO 92 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1gif h PRO 92 CO 0.84 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 178.23 1gif n ASP 93 N -3.70 0.77 -0.80 -2.05 5.75 -1.26 -2.91 116.55 112.35 1gif n ASP 93 Ca -0.00 -1.90 0.02 0.00 -0.01 0.00 0.00 54.79 52.90 1gif n ASP 93 Cb 0.24 -0.09 0.20 0.00 -1.03 0.00 0.00 41.12 40.44 1gif n ASP 93 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1gif n ARG 94 N -0.12 1.73 -4.25 0.11 1.74 -0.06 -5.01 116.66 110.79 1gif n ARG 94 Ca 0.07 -3.32 -0.17 0.00 -0.77 0.00 0.00 57.85 53.66 1gif n ARG 94 Cb 0.14 -1.69 -0.15 0.00 -1.02 0.00 0.00 32.46 29.73 1gif n ARG 94 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1gif s VAL 95 N -3.30 0.55 -0.02 1.55 1.01 -1.14 -2.37 120.40 116.67 1gif s VAL 95 Ca 0.40 -0.29 0.07 0.00 0.00 0.00 0.00 61.98 62.16 1gif s VAL 95 Cb 0.38 -0.47 -0.02 0.00 0.00 0.00 0.00 36.38 36.28 1gif s VAL 95 CO -0.05 0.16 -0.22 -0.31 0.00 0.00 0.00 175.10 174.68 1gif s TYR 96 N -0.12 2.03 -0.11 5.22 2.02 -0.70 -5.01 117.35 120.69 1gif s TYR 96 Ca 0.02 -0.42 0.00 0.00 -0.37 0.00 0.00 57.07 56.30 1gif s TYR 96 Cb -0.03 -1.31 0.02 0.00 -0.40 0.00 0.00 41.96 40.24 1gif s TYR 96 CO -0.00 -0.06 -0.10 0.42 -1.57 0.00 0.00 175.55 174.24 1gif s ILE 97 N -0.45 1.13 -0.15 2.71 1.01 -1.26 -0.49 121.20 123.71 1gif s ILE 97 Ca 0.07 -0.39 -0.11 0.00 0.00 0.00 0.00 60.65 60.22 1gif s ILE 97 Cb -0.09 -1.10 -0.05 0.00 0.01 0.00 0.00 42.46 41.23 1gif s ILE 97 CO -0.00 0.38 0.23 0.20 0.00 0.00 0.00 174.94 175.74 1gif s ASN 98 N 1.41 6.40 -0.17 3.58 0.01 0.21 -4.96 114.94 121.41 1gif s ASN 98 Ca -0.00 0.47 -0.04 0.00 -0.71 0.00 0.00 52.86 52.57 1gif s ASN 98 Cb -0.13 -2.14 -0.03 0.00 0.41 0.00 0.00 41.25 39.36 1gif s ASN 98 CO -0.05 0.21 -0.02 -0.31 -1.51 0.00 0.00 177.10 175.42 1gif s TYR 99 N -0.04 3.04 -0.11 2.20 2.02 -1.26 -0.44 117.35 122.76 1gif s TYR 99 Ca 0.14 -0.33 0.02 0.00 -0.37 0.00 0.00 57.07 56.53 1gif s TYR 99 Cb -0.13 -2.00 0.02 0.00 -0.40 0.00 0.00 41.96 39.45 1gif s TYR 99 CO 0.03 -0.09 -0.15 0.71 -1.57 0.00 0.00 175.55 174.49 1gif s TYR 100 N 0.55 1.93 -0.46 2.71 2.02 -0.29 -4.98 117.35 118.84 1gif s TYR 100 Ca -0.02 -0.92 -0.19 0.00 -0.37 0.00 0.00 57.07 55.58 1gif s TYR 100 Cb -0.14 -1.41 0.04 0.00 -0.40 0.00 0.00 41.96 40.05 1gif s TYR 100 CO 0.02 -0.48 0.55 0.34 -1.57 0.00 0.00 175.55 174.41 1gif s ASP 101 N 1.04 6.24 0.12 2.29 -1.08 -1.26 -1.10 116.67 122.92 1gif s ASP 101 Ca -0.06 -0.70 -0.11 0.00 -0.52 0.00 0.00 52.55 51.17 1gif s ASP 101 Cb -0.15 -2.27 -0.06 0.00 -1.46 0.00 0.00 42.92 38.98 1gif s ASP 101 CO -0.02 -0.74 0.46 -0.04 0.52 0.00 0.00 175.17 175.34 1gif s MET 102 N 2.46 3.82 0.05 4.34 -1.94 0.34 -4.92 119.30 123.45 1gif s MET 102 Ca 0.15 0.27 -0.27 0.00 -1.71 0.00 0.00 55.69 54.13 1gif s MET 102 Cb -0.17 -2.94 -0.05 0.00 2.01 0.00 0.00 34.83 33.68 1gif s MET 102 CO 0.14 0.51 0.84 1.21 -0.01 0.00 0.00 175.02 177.71 1gif s ASN 103 N -1.84 7.29 0.39 3.03 3.84 -1.26 -4.09 114.94 122.30 1gif s ASN 103 Ca 0.36 1.54 0.14 0.00 0.21 0.00 0.00 52.86 55.11 1gif s ASN 103 Cb -0.14 -2.51 0.97 0.00 -0.55 0.00 0.00 41.25 39.02 1gif s ASN 103 CO 0.19 -0.05 1.87 0.00 -2.79 0.00 0.00 177.10 176.31 1gif h ALA 104 N 5.88 2.03 0.00 1.71 0.00 -1.93 -0.08 119.26 126.87 1gif h ALA 104 Ca -0.43 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1gif h ALA 104 Cb 1.21 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1gif h ALA 104 CO 0.72 -0.29 0.00 0.00 0.00 0.00 0.00 179.25 179.68 1gif n ALA 105 N -2.48 1.64 -0.53 0.00 0.00 -1.26 -2.74 120.51 115.14 1gif n ALA 105 Ca 0.18 0.02 0.10 0.00 0.00 0.00 0.00 53.44 53.75 1gif n ALA 105 Cb 0.58 -1.31 0.35 0.00 0.00 0.00 0.00 19.45 19.07 1gif n ALA 105 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1gif n ASN 106 N -1.88 4.47 -4.01 0.00 3.02 -0.04 -4.82 115.26 112.00 1gif n ASN 106 Ca 0.03 -2.27 -0.31 0.00 -0.03 0.00 0.00 54.58 51.99 1gif n ASN 106 Cb 0.19 -0.55 -0.15 0.00 -0.61 0.00 0.00 39.78 38.66 1gif n ASN 106 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1gif s VAL 107 N -1.52 1.87 0.12 2.41 1.01 -1.11 -4.95 120.40 118.25 1gif s VAL 107 Ca 0.51 -1.40 -0.15 0.00 0.00 0.00 0.00 61.98 60.93 1gif s VAL 107 Cb 0.30 -2.03 -0.07 0.00 0.00 0.00 0.00 36.38 34.58 1gif s VAL 107 CO 0.28 -0.02 0.55 -0.83 0.00 0.00 0.00 175.10 175.08 1gif s GLY 108 N 1.25 2.51 -0.28 4.51 0.00 -1.26 -1.84 107.32 112.21 1gif s GLY 108 Ca -0.07 -0.10 -0.22 0.00 0.00 0.00 0.00 44.72 44.34 1gif s GLY 108 CO -0.06 0.22 0.84 0.86 0.00 0.00 0.00 173.10 174.97 1gif s TRP 109 N -1.37 -0.72 -1.25 1.90 -0.00 0.43 -4.97 118.94 112.97 1gif s TRP 109 Ca 0.35 1.63 -0.10 0.00 -0.00 0.00 0.00 56.10 57.98 1gif s TRP 109 Cb -0.16 0.38 -0.01 0.00 -0.00 0.00 0.00 33.47 33.69 1gif s TRP 109 CO 0.19 -0.35 0.67 -1.71 -0.00 0.00 0.00 176.95 175.75 1gif n ASN 110 N 3.02 -3.09 0.00 5.86 5.15 -1.26 -1.91 115.26 123.03 1gif n ASN 110 Ca -0.15 -0.97 0.00 0.00 -0.60 0.00 0.00 54.58 52.86 1gif n ASN 110 Cb 0.56 -3.48 0.00 0.00 -0.53 0.00 0.00 39.78 36.33 1gif n ASN 110 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1gif n ASN 111 N -2.86 -3.14 0.00 1.20 3.02 -1.26 -4.90 115.26 107.32 1gif n ASN 111 Ca -0.20 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.35 1gif n ASN 111 Cb 0.64 -2.36 0.00 0.00 -0.61 0.00 0.00 39.78 37.45 1gif n ASN 111 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1gif n SER 112 N -0.44 0.00 -4.35 6.41 2.88 -0.80 -5.18 113.62 112.13 1gif n SER 112 Ca 0.00 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.29 1gif n SER 112 Cb 0.22 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.59 1gif n SER 112 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1gif s THR 113 N -1.69 0.96 0.00 2.46 -4.23 -1.26 -0.43 115.64 111.44 1gif s THR 113 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 1gif s THR 113 Cb 0.00 -2.53 0.00 0.00 1.34 0.00 0.00 72.50 71.31 1gif s THR 113 CO 0.00 0.00 0.00 0.49 -0.54 0.00 0.00 174.62 174.57 1gif n PHE 114 N -0.87 -0.90 -1.25 3.99 3.72 -0.76 -4.85 117.46 116.54 1gif n PHE 114 Ca -0.06 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1gif n PHE 114 Cb 0.66 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.20 1gif n PHE 114 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71