#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lun n ASN 5 N 0.00 -0.08 -0.08 6.41 6.94 -1.26 -4.86 115.26 122.33 1lun n ASN 5 Ca 0.00 0.07 -0.13 0.00 -0.02 0.00 0.00 54.58 54.50 1lun n ASN 5 Cb 0.00 -0.06 -0.14 0.00 -2.36 0.00 0.00 39.78 37.22 1lun n ASN 5 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 1lun n LEU 6 N 0.12 1.13 0.00 -4.53 4.77 -1.26 -4.89 117.00 112.34 1lun n LEU 6 Ca 0.01 0.08 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 1lun n LEU 6 Cb 0.02 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.05 1lun n LEU 6 CO 0.03 0.61 0.00 -1.84 -1.33 0.00 0.00 177.39 174.87 1lun n GLU 7 N -3.00 0.00 0.00 3.23 0.28 -1.26 -2.64 120.64 117.24 1lun n GLU 7 Ca -0.32 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.68 1lun n GLU 7 Cb 1.09 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.96 1lun n GLU 7 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1lun n THR 8 N 0.00 0.00 -3.11 3.84 5.66 -1.26 -5.14 114.28 114.27 1lun n THR 8 Ca 0.00 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.61 1lun n THR 8 Cb 0.00 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 68.73 1lun n THR 8 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1lun s TYR 9 N 0.00 3.55 0.60 1.09 2.02 -1.08 -4.89 117.35 118.64 1lun s TYR 9 Ca 0.00 1.15 0.28 0.00 -0.37 0.00 0.00 57.07 58.13 1lun s TYR 9 Cb 0.00 -2.75 1.02 0.00 -0.40 0.00 0.00 41.96 39.84 1lun s TYR 9 CO 0.00 0.09 1.38 1.05 -1.57 0.00 0.00 175.55 176.50 1lun h GLU 10 N 6.80 0.00 0.00 -0.62 4.11 -1.87 1.93 114.58 124.93 1lun h GLU 10 Ca -0.40 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 58.81 1lun h GLU 10 Cb 1.19 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 1lun h GLU 10 CO 0.76 0.00 -1.45 0.11 0.07 0.00 0.00 179.01 178.50 1lun h TRP 11 N 0.00 0.00 -3.55 2.06 5.08 -1.56 3.67 115.95 121.64 1lun h TRP 11 Ca 0.48 0.00 -0.52 0.00 1.08 0.00 0.00 58.89 59.94 1lun h TRP 11 Cb 2.78 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 28.94 1lun h TRP 11 CO 0.00 0.78 0.48 -0.47 -1.28 0.00 0.00 178.44 177.96 1lun s TYR 12 N -2.77 3.58 -0.31 0.12 5.04 0.65 0.51 117.35 124.17 1lun s TYR 12 Ca -0.03 1.58 -0.03 0.00 -2.44 0.00 0.00 57.07 56.16 1lun s TYR 12 Cb 0.08 -3.29 0.11 0.00 0.35 0.00 0.00 41.96 39.21 1lun s TYR 12 CO 0.81 -0.67 0.15 -0.80 -1.34 0.00 0.00 175.55 173.71 1lun s ASN 13 N -0.08 3.42 0.77 4.32 0.01 0.35 -4.70 114.94 119.03 1lun s ASN 13 Ca 0.50 -1.58 -0.14 0.00 -0.71 0.00 0.00 52.86 50.93 1lun s ASN 13 Cb -0.30 -0.41 0.06 0.00 0.41 0.00 0.00 41.25 41.01 1lun s ASN 13 CO 0.35 -0.40 1.18 -1.59 -1.51 0.00 0.00 177.10 175.13 1lun s LYS 14 N 1.76 1.96 0.00 -0.60 0.00 -1.26 -2.61 119.74 118.99 1lun s LYS 14 Ca 0.12 1.64 0.00 0.00 0.00 0.00 0.00 55.97 57.73 1lun s LYS 14 Cb -0.18 -1.82 0.00 0.00 0.00 0.00 0.00 37.83 35.82 1lun s LYS 14 CO -0.25 -1.95 0.00 0.45 0.00 0.00 0.00 175.35 173.60 1lun n SER 15 N -3.08 -0.80 -4.64 0.03 2.88 -1.26 -4.90 113.62 101.86 1lun n SER 15 Ca 0.13 0.00 -0.30 0.00 -1.33 0.00 0.00 58.87 57.37 1lun n SER 15 Cb 0.51 -2.02 0.18 0.00 -0.75 0.00 0.00 64.21 62.13 1lun n SER 15 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1lun s ILE 16 N -0.75 2.32 0.07 2.46 1.01 -1.07 -5.06 121.20 120.18 1lun s ILE 16 Ca 0.00 0.10 0.00 0.00 0.00 0.00 0.00 60.65 60.76 1lun s ILE 16 Cb 0.00 -2.31 -0.00 0.00 0.01 0.00 0.00 42.46 40.16 1lun s ILE 16 CO 0.00 -0.14 0.01 -0.24 0.00 0.00 0.00 174.94 174.58 1lun n SER 17 N -4.29 1.47 0.04 3.58 2.88 -1.26 -4.78 113.62 111.26 1lun n SER 17 Ca 0.07 -1.36 -0.14 0.00 -1.33 0.00 0.00 58.87 56.11 1lun n SER 17 Cb 0.54 0.13 -0.04 0.00 -0.75 0.00 0.00 64.21 64.08 1lun n SER 17 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 1lun h ARG 18 N 0.00 0.54 -0.03 -1.46 0.11 -2.01 -3.20 114.38 108.33 1lun h ARG 18 Ca -0.06 -0.51 -0.09 0.00 0.10 0.00 0.00 59.98 59.42 1lun h ARG 18 Cb 0.20 0.13 0.01 0.00 1.11 0.00 0.00 29.97 31.42 1lun h ARG 18 CO 0.10 1.14 -0.32 -0.44 0.10 0.00 0.00 179.97 180.55 1lun h ASP 19 N 0.34 0.34 0.06 0.08 5.19 -2.00 -3.22 116.42 117.21 1lun h ASP 19 Ca -0.07 -0.71 0.01 0.00 -0.62 0.00 0.00 57.03 55.65 1lun h ASP 19 Cb 1.49 -0.10 -0.02 0.00 0.18 0.00 0.00 39.33 40.88 1lun h ASP 19 CO 0.16 0.99 -0.14 0.11 -3.12 0.00 0.00 179.24 177.24 1lun h LYS 20 N -0.29 -0.27 -0.34 3.56 6.56 -1.97 0.13 116.57 123.95 1lun h LYS 20 Ca -0.03 0.02 0.07 0.00 -1.06 0.00 0.00 60.65 59.65 1lun h LYS 20 Cb 1.01 0.06 -0.08 0.00 -0.57 0.00 0.00 32.23 32.66 1lun h LYS 20 CO 0.06 -0.18 -0.17 0.00 -2.06 0.00 0.00 179.45 177.11 1lun h ALA 21 N 0.61 0.09 -0.72 3.86 0.00 -1.69 1.41 119.26 122.83 1lun h ALA 21 Ca 0.03 0.12 0.08 0.00 0.00 0.00 0.00 54.91 55.15 1lun h ALA 21 Cb 0.30 0.40 -0.07 0.00 0.00 0.00 0.00 17.79 18.43 1lun h ALA 21 CO -0.10 -0.55 0.38 0.93 0.00 0.00 0.00 179.25 179.92 1lun h GLU 22 N -0.11 0.64 0.04 0.00 5.08 -1.50 1.31 114.58 120.04 1lun h GLU 22 Ca 0.17 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.51 1lun h GLU 22 Cb 0.38 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.46 1lun h GLU 22 CO -0.41 0.42 -0.10 1.57 -1.00 0.00 0.00 179.01 179.49 1lun h LYS 23 N 0.66 -0.19 -0.63 2.33 2.10 0.23 1.36 116.57 122.43 1lun h LYS 23 Ca 0.34 0.01 0.01 0.00 -2.00 0.00 0.00 60.65 59.02 1lun h LYS 23 Cb 0.31 0.04 -0.03 0.00 -0.90 0.00 0.00 32.23 31.65 1lun h LYS 23 CO -0.24 -0.13 0.41 1.37 -2.00 0.00 0.00 179.45 178.86 1lun h LEU 24 N -0.20 0.70 -0.20 7.07 8.10 0.32 -0.10 115.31 131.00 1lun h LEU 24 Ca 0.03 -0.01 -0.00 0.00 0.11 0.00 0.00 57.88 58.00 1lun h LEU 24 Cb 0.23 -0.17 -0.01 0.00 -0.44 0.00 0.00 40.66 40.27 1lun h LEU 24 CO -0.08 0.50 0.12 -0.07 -4.11 0.00 0.00 178.44 174.80 1lun h LEU 25 N 0.83 0.23 -1.37 0.17 3.38 0.24 -2.18 115.31 116.60 1lun h LEU 25 Ca 0.24 -0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.26 1lun h LEU 25 Cb -0.06 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 1lun h LEU 25 CO -0.07 0.21 0.51 -0.07 0.09 0.00 0.00 178.44 179.12 1lun h LEU 26 N 0.24 0.63 -0.29 1.67 4.07 0.24 2.04 115.31 123.91 1lun h LEU 26 Ca 0.07 0.02 0.06 0.00 0.08 0.00 0.00 57.88 58.10 1lun h LEU 26 Cb 0.02 -0.11 -0.05 0.00 1.08 0.00 0.00 40.66 41.59 1lun h LEU 26 CO -0.01 0.37 -0.06 -0.78 -1.08 0.00 0.00 178.44 176.88 1lun h ASP 27 N 0.70 -0.23 0.00 -0.43 3.58 -0.37 -3.28 116.42 116.38 1lun h ASP 27 Ca 0.36 0.08 -0.12 0.00 0.42 0.00 0.00 57.03 57.77 1lun h ASP 27 Cb 0.48 0.16 -0.02 0.00 1.72 0.00 0.00 39.33 41.67 1lun h ASP 27 CO -0.14 -0.08 -0.90 0.00 -2.88 0.00 0.00 179.24 175.24 1lun h THR 28 N 0.02 0.49 -4.59 2.25 1.03 -1.28 -3.50 112.91 107.33 1lun h THR 28 Ca 0.14 -1.63 0.00 0.00 -0.01 0.00 0.00 66.41 64.91 1lun h THR 28 Cb 0.21 1.19 0.00 0.00 -1.07 0.00 0.00 68.15 68.48 1lun h THR 28 CO -0.28 0.17 -0.04 0.61 -0.01 0.00 0.00 175.52 175.97 1lun n GLY 29 N 1.52 -0.95 2.35 2.99 0.00 0.69 -5.07 105.19 106.71 1lun n GLY 29 Ca -0.20 0.31 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 1lun n GLY 29 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1lun n LYS 30 N -1.39 0.83 -2.83 1.61 4.01 -1.26 -4.68 118.16 114.44 1lun n LYS 30 Ca 0.01 -1.95 -0.43 0.00 -0.51 0.00 0.00 58.31 55.43 1lun n LYS 30 Cb 0.48 -0.04 -0.04 0.00 -0.51 0.00 0.00 35.03 34.92 1lun n LYS 30 CO 0.00 0.00 0.00 -2.00 -1.11 0.00 0.00 177.40 174.29 1lun s GLU 31 N -3.53 3.40 -0.68 1.97 2.12 -1.26 0.43 118.70 121.15 1lun s GLU 31 Ca 0.32 -0.12 -0.02 0.00 0.36 0.00 0.00 54.97 55.51 1lun s GLU 31 Cb -0.03 -4.01 0.00 0.00 0.26 0.00 0.00 34.13 30.36 1lun s GLU 31 CO 0.20 -1.39 0.24 0.41 -0.54 0.00 0.00 175.26 174.18 1lun n GLY 32 N 5.06 0.15 3.60 -1.50 0.00 0.41 -4.50 105.19 108.41 1lun n GLY 32 Ca 0.03 -0.40 -0.57 0.00 0.00 0.00 0.00 46.02 45.09 1lun n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lun n ALA 33 N -2.44 -1.71 -2.94 4.61 0.00 1.85 -3.22 120.51 116.67 1lun n ALA 33 Ca -0.05 0.52 -0.34 0.00 0.00 0.00 0.00 53.44 53.56 1lun n ALA 33 Cb 0.56 -1.99 -0.11 0.00 0.00 0.00 0.00 19.45 17.90 1lun n ALA 33 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1lun s PHE 34 N 1.04 3.11 0.17 0.00 5.36 0.49 0.31 117.98 128.45 1lun s PHE 34 Ca 0.91 -0.21 0.02 0.00 -0.96 0.00 0.00 56.93 56.68 1lun s PHE 34 Cb -1.12 -2.04 -0.05 0.00 -0.34 0.00 0.00 43.02 39.47 1lun s PHE 34 CO 0.56 -0.03 0.00 1.41 -1.46 0.00 0.00 175.22 175.70 1lun s MET 35 N 0.58 1.08 0.02 10.12 -2.45 2.03 0.88 119.30 131.56 1lun s MET 35 Ca 0.00 -1.52 -0.01 0.00 -1.25 0.00 0.00 55.69 52.91 1lun s MET 35 Cb -0.14 -0.23 -0.02 0.00 1.25 0.00 0.00 34.83 35.70 1lun s MET 35 CO 0.02 -0.13 -0.01 0.08 1.05 0.00 0.00 175.02 176.03 1lun s VAL 36 N -3.68 0.11 -0.15 10.11 1.01 1.94 0.54 120.40 130.29 1lun s VAL 36 Ca 0.23 -0.91 -0.10 0.00 0.00 0.00 0.00 61.98 61.20 1lun s VAL 36 Cb 0.06 -0.33 0.05 0.00 0.00 0.00 0.00 36.38 36.16 1lun s VAL 36 CO 0.03 -0.50 0.36 0.00 0.00 0.00 0.00 175.10 174.99 1lun s ARG 37 N -1.54 0.37 0.55 2.72 1.70 0.87 0.13 118.95 123.76 1lun s ARG 37 Ca -0.15 0.64 -0.20 0.00 -0.47 0.00 0.00 55.73 55.54 1lun s ARG 37 Cb -0.09 0.04 -0.05 0.00 -0.57 0.00 0.00 34.95 34.28 1lun s ARG 37 CO -0.01 -0.12 1.24 0.34 -1.08 0.00 0.00 175.30 175.67 1lun s ASP 38 N 0.96 5.39 0.00 -2.89 -1.08 -1.26 0.47 116.67 118.25 1lun s ASP 38 Ca -0.06 2.49 0.00 0.00 -0.52 0.00 0.00 52.55 54.45 1lun s ASP 38 Cb -0.07 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.78 1lun s ASP 38 CO -0.07 -1.47 0.00 -0.24 0.52 0.00 0.00 175.17 173.91 1lun n SER 39 N -1.22 0.00 0.00 -0.34 2.88 -1.25 -4.72 113.62 108.97 1lun n SER 39 Ca 0.12 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.66 1lun n SER 39 Cb 0.48 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 1lun n SER 39 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1lun n ARG 40 N 0.00 0.00 0.00 -1.46 0.63 -1.26 -5.07 116.66 109.49 1lun n ARG 40 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 1lun n ARG 40 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 1lun n ARG 40 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 1lun n THR 41 N -0.02 0.00 0.00 5.15 5.66 -1.26 -4.14 114.28 119.66 1lun n THR 41 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1lun n THR 41 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1lun n THR 41 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1lun n PRO 42 N -0.10 0.00 0.00 1.09 -0.02 -1.26 -4.31 135.00 130.40 1lun n PRO 42 Ca 0.00 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1lun n PRO 42 Cb 0.00 -1.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.93 1lun n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lun n GLY 43 N -0.60 1.62 0.60 -1.23 0.00 -1.26 -5.02 105.19 99.30 1lun n GLY 43 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1lun n GLY 43 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1lun n THR 44 N -0.65 0.00 -4.30 2.61 5.66 -1.26 -5.03 114.28 111.31 1lun n THR 44 Ca 0.00 -0.21 -0.16 0.00 -3.05 0.00 0.00 64.05 60.63 1lun n THR 44 Cb 0.00 -1.54 -0.10 0.00 -1.55 0.00 0.00 70.33 67.14 1lun n THR 44 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1lun s TYR 45 N -0.72 1.50 0.12 1.09 1.51 -1.25 -3.74 117.35 115.84 1lun s TYR 45 Ca 0.11 -0.70 -0.00 0.00 -1.01 0.00 0.00 57.07 55.47 1lun s TYR 45 Cb -0.00 -0.75 -0.04 0.00 -0.11 0.00 0.00 41.96 41.06 1lun s TYR 45 CO 0.07 0.19 0.28 0.99 -1.11 0.00 0.00 175.55 175.97 1lun s THR 46 N -3.19 5.31 -0.21 -0.71 2.01 1.67 0.18 115.64 120.71 1lun s THR 46 Ca 0.21 -0.40 0.01 0.00 0.31 0.00 0.00 61.69 61.81 1lun s THR 46 Cb 0.02 -3.67 0.05 0.00 0.01 0.00 0.00 72.50 68.90 1lun s THR 46 CO 0.04 0.01 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.22 1lun s VAL 47 N -1.65 1.49 -0.45 3.82 1.01 2.47 0.30 120.40 127.39 1lun s VAL 47 Ca 0.36 -1.01 -0.22 0.00 0.00 0.00 0.00 61.98 61.11 1lun s VAL 47 Cb -0.12 -1.66 0.03 0.00 0.00 0.00 0.00 36.38 34.63 1lun s VAL 47 CO 0.28 0.06 0.75 -0.55 0.00 0.00 0.00 175.10 175.64 1lun s SER 48 N 1.44 6.38 -0.15 3.32 0.15 2.12 0.53 113.70 127.49 1lun s SER 48 Ca -0.03 -0.21 -0.04 0.00 0.70 0.00 0.00 55.95 56.38 1lun s SER 48 Cb -0.17 -2.37 -0.03 0.00 -1.71 0.00 0.00 66.02 61.74 1lun s SER 48 CO -0.07 -0.90 -0.03 0.68 1.20 0.00 0.00 173.24 174.11 1lun s VAL 49 N 3.19 3.94 -0.05 4.45 -7.23 0.51 0.53 120.40 125.73 1lun s VAL 49 Ca 0.28 -0.34 0.05 0.00 -1.81 0.00 0.00 61.98 60.16 1lun s VAL 49 Cb -0.13 -2.72 -0.01 0.00 0.56 0.00 0.00 36.38 34.08 1lun s VAL 49 CO 0.21 0.50 -0.22 0.12 -0.31 0.00 0.00 175.10 175.40 1lun s PHE 50 N 0.31 2.17 -0.22 2.82 2.19 0.91 0.29 117.98 126.45 1lun s PHE 50 Ca -0.03 -0.64 -0.10 0.00 0.33 0.00 0.00 56.93 56.48 1lun s PHE 50 Cb -0.14 -1.43 -0.05 0.00 -1.31 0.00 0.00 43.02 40.09 1lun s PHE 50 CO 0.03 -0.20 0.14 0.99 1.83 0.00 0.00 175.22 178.01 1lun s THR 51 N -0.09 5.37 0.64 0.12 2.01 -0.31 0.50 115.64 123.88 1lun s THR 51 Ca -0.04 0.18 -0.18 0.00 0.31 0.00 0.00 61.69 61.97 1lun s THR 51 Cb -0.13 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.87 1lun s THR 51 CO 0.03 0.39 0.92 2.29 -0.69 0.00 0.00 174.62 177.57 1lun n LYS 52 N 3.90 0.75 0.00 4.92 -0.00 0.17 -3.32 118.16 124.58 1lun n LYS 52 Ca -0.16 0.30 0.00 0.00 -0.00 0.00 0.00 58.31 58.46 1lun n LYS 52 Cb 0.52 -2.14 0.00 0.00 -0.00 0.00 0.00 35.03 33.41 1lun n LYS 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1lun n ALA 53 N -1.96 0.00 -1.89 0.58 0.00 -1.26 -3.95 120.51 112.03 1lun n ALA 53 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.58 1lun n ALA 53 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1lun n ALA 53 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1lun n ILE 54 N -1.46 0.00 0.00 0.00 -6.64 -1.26 -4.39 119.36 105.61 1lun n ILE 54 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 1lun n ILE 54 Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 1lun n ILE 54 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1lun n ILE 55 N 0.00 0.00 -0.69 7.28 0.13 -1.26 0.39 119.36 125.21 1lun n ILE 55 Ca 0.00 0.00 0.08 0.00 -1.10 0.00 0.00 62.75 61.73 1lun n ILE 55 Cb 0.00 0.00 0.37 0.00 -0.84 0.00 0.00 39.64 39.17 1lun n ILE 55 CO 0.00 0.00 0.00 -1.54 2.80 0.00 0.00 176.55 177.81 1lun n SER 56 N 0.71 5.12 0.00 9.51 3.41 -1.26 -5.03 113.62 126.08 1lun n SER 56 Ca 0.00 -2.64 0.00 0.00 -0.26 0.00 0.00 58.87 55.97 1lun n SER 56 Cb 0.00 -0.63 0.00 0.00 -0.26 0.00 0.00 64.21 63.32 1lun n SER 56 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1lun n GLU 57 N 0.91 0.00 0.00 4.33 0.00 1.27 -5.08 120.64 122.07 1lun n GLU 57 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.42 1lun n GLU 57 Cb 1.01 0.00 0.00 0.00 0.00 0.00 0.00 31.44 32.45 1lun n GLU 57 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 1lun n ASN 58 N 0.00 0.00 -4.50 -1.84 5.03 -1.26 -4.22 115.26 108.46 1lun n ASN 58 Ca 0.00 0.00 -0.43 0.00 0.87 0.00 0.00 54.58 55.02 1lun n ASN 58 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 38.72 1lun n ASN 58 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1lun s PRO 59 N 0.00 3.27 -0.19 3.52 0.04 -1.25 -4.71 135.00 135.67 1lun s PRO 59 Ca 0.00 -0.42 -0.04 0.00 0.04 0.00 0.00 61.00 60.58 1lun s PRO 59 Cb 0.00 -4.09 -0.02 0.00 0.04 0.00 0.00 34.50 30.43 1lun s PRO 59 CO 0.00 -1.53 -0.03 0.00 0.04 0.00 0.00 177.00 175.48 1lun s ILE 61 N 0.94 5.14 -0.12 0.00 1.09 -1.26 -1.16 121.20 125.84 1lun s ILE 61 Ca 0.00 0.11 0.00 0.00 -1.10 0.00 0.00 60.65 59.67 1lun s ILE 61 Cb -0.14 -3.44 -0.02 0.00 -1.06 0.00 0.00 42.46 37.80 1lun s ILE 61 CO 0.01 0.27 -0.13 -0.54 -0.10 0.00 0.00 174.94 174.45 1lun s LYS 62 N 1.68 3.32 -0.54 2.79 1.02 0.86 -4.89 119.74 123.97 1lun s LYS 62 Ca 0.07 -0.69 -0.20 0.00 0.02 0.00 0.00 55.97 55.17 1lun s LYS 62 Cb -0.16 -2.61 0.07 0.00 -0.52 0.00 0.00 37.83 34.62 1lun s LYS 62 CO 0.09 0.24 0.70 -1.01 -0.92 0.00 0.00 175.35 174.45 1lun s HIS 63 N 0.27 2.99 -0.29 3.18 3.76 -1.25 0.19 115.29 124.15 1lun s HIS 63 Ca -0.10 -0.59 -0.15 0.00 -0.15 0.00 0.00 55.06 54.07 1lun s HIS 63 Cb -0.16 -3.75 -0.03 0.00 1.11 0.00 0.00 32.58 29.75 1lun s HIS 63 CO 0.05 -1.17 0.36 0.71 -0.85 0.00 0.00 174.74 173.85 1lun s TYR 64 N 2.86 3.23 0.17 1.40 2.02 2.05 -4.75 117.35 124.32 1lun s TYR 64 Ca 0.16 0.31 -0.15 0.00 -0.37 0.00 0.00 57.07 57.02 1lun s TYR 64 Cb -0.20 -2.59 -0.07 0.00 -0.40 0.00 0.00 41.96 38.70 1lun s TYR 64 CO 0.11 -0.27 0.59 -1.58 -1.57 0.00 0.00 175.55 172.82 1lun s HIS 65 N 2.05 3.60 -0.57 2.71 2.46 -1.26 0.59 115.29 124.88 1lun s HIS 65 Ca 0.14 1.12 -0.22 0.00 0.47 0.00 0.00 55.06 56.57 1lun s HIS 65 Cb -0.16 -2.42 0.06 0.00 -0.13 0.00 0.00 32.58 29.93 1lun s HIS 65 CO 0.10 0.40 0.84 0.42 -2.47 0.00 0.00 174.74 174.04 1lun s ILE 66 N -1.49 4.53 0.58 0.89 -1.09 0.48 -4.29 121.20 120.82 1lun s ILE 66 Ca 0.39 -0.19 -0.19 0.00 -2.23 0.00 0.00 60.65 58.44 1lun s ILE 66 Cb -0.15 -4.51 -0.04 0.00 -1.58 0.00 0.00 42.46 36.18 1lun s ILE 66 CO 0.19 -1.12 1.18 -0.75 -1.23 0.00 0.00 174.94 173.21 1lun s LYS 67 N 3.53 3.07 -0.07 2.79 2.47 2.47 -3.96 119.74 130.04 1lun s LYS 67 Ca 0.23 1.74 0.03 0.00 -1.56 0.00 0.00 55.97 56.41 1lun s LYS 67 Cb -0.16 -1.95 -0.02 0.00 -1.46 0.00 0.00 37.83 34.23 1lun s LYS 67 CO 0.14 -1.10 -0.14 -1.21 0.16 0.00 0.00 175.35 173.20 1lun s GLU 68 N -3.35 2.69 -0.29 4.03 2.02 -1.17 0.37 118.70 123.00 1lun s GLU 68 Ca 0.76 -0.68 -0.01 0.00 0.02 0.00 0.00 54.97 55.05 1lun s GLU 68 Cb -0.28 -2.44 0.13 0.00 0.10 0.00 0.00 34.13 31.64 1lun s GLU 68 CO 0.32 0.54 0.26 0.95 0.02 0.00 0.00 175.26 177.35 1lun s THR 69 N -0.52 -0.33 0.00 3.63 -4.23 2.76 -4.86 115.64 112.09 1lun s THR 69 Ca 0.07 -0.53 -0.00 0.00 -1.18 0.00 0.00 61.69 60.05 1lun s THR 69 Cb -0.12 -0.97 -0.01 0.00 1.34 0.00 0.00 72.50 72.75 1lun s THR 69 CO 0.02 -0.51 0.44 0.59 -0.54 0.00 0.00 174.62 174.61 1lun n ASN 70 N 5.30 -0.81 -1.37 3.99 3.02 -1.26 -3.48 115.26 120.65 1lun n ASN 70 Ca -0.03 -0.53 0.00 0.00 -0.03 0.00 0.00 54.58 53.99 1lun n ASN 70 Cb 0.46 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.62 1lun n ASN 70 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1lun n ASP 71 N 3.42 0.00 -3.20 6.41 -0.08 -1.23 -5.01 116.55 116.86 1lun n ASP 71 Ca 0.01 0.00 -0.23 0.00 -1.51 0.00 0.00 54.79 53.06 1lun n ASP 71 Cb 0.21 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.61 1lun n ASP 71 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1lun n SER 72 N 0.00 0.73 -0.10 1.67 3.41 -1.26 -4.67 113.62 113.39 1lun n SER 72 Ca 0.00 -2.86 -0.22 0.00 -0.26 0.00 0.00 58.87 55.54 1lun n SER 72 Cb 0.00 -0.63 -0.12 0.00 -0.26 0.00 0.00 64.21 63.20 1lun n SER 72 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1lun n PRO 73 N 1.04 0.65 -0.25 4.33 -0.04 -1.26 -5.09 135.00 134.38 1lun n PRO 73 Ca 0.23 0.24 0.00 0.00 -0.04 0.00 0.00 63.50 63.93 1lun n PRO 73 Cb 0.55 -1.57 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 1lun n PRO 73 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1lun n LYS 74 N -3.65 0.00 -0.13 0.54 4.01 -1.26 -4.73 118.16 112.94 1lun n LYS 74 Ca -0.44 0.00 -0.28 0.00 -0.51 0.00 0.00 58.31 57.08 1lun n LYS 74 Cb 0.95 0.00 -0.10 0.00 -0.51 0.00 0.00 35.03 35.37 1lun n LYS 74 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1lun n ARG 75 N -0.00 0.57 -3.25 1.97 1.74 1.78 -3.53 116.66 115.95 1lun n ARG 75 Ca 0.00 0.25 -0.33 0.00 -0.77 0.00 0.00 57.85 57.00 1lun n ARG 75 Cb 0.00 -1.46 -0.06 0.00 -1.02 0.00 0.00 32.46 29.92 1lun n ARG 75 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1lun s TYR 76 N -2.49 3.42 -0.04 -1.55 2.02 1.65 0.63 117.35 120.99 1lun s TYR 76 Ca -0.38 1.10 -0.31 0.00 -0.37 0.00 0.00 57.07 57.12 1lun s TYR 76 Cb 0.14 -2.43 0.11 0.00 -0.40 0.00 0.00 41.96 39.38 1lun s TYR 76 CO 0.48 0.19 1.14 1.52 -1.57 0.00 0.00 175.55 177.31 1lun s TYR 77 N -1.87 -0.14 -0.35 2.71 1.13 1.16 0.27 117.35 120.27 1lun s TYR 77 Ca 0.50 0.01 0.15 0.00 -1.41 0.00 0.00 57.07 56.32 1lun s TYR 77 Cb -0.11 0.55 0.44 0.00 -1.10 0.00 0.00 41.96 41.74 1lun s TYR 77 CO 0.19 -0.40 0.95 1.33 -2.51 0.00 0.00 175.55 175.11 1lun n VAL 78 N -0.32 1.13 0.00 -3.49 0.24 -1.26 0.59 118.33 115.22 1lun n VAL 78 Ca -0.05 -3.56 0.00 0.00 -2.04 0.00 0.00 64.34 58.69 1lun n VAL 78 Cb 0.61 0.23 0.00 0.00 -1.47 0.00 0.00 33.84 33.21 1lun n VAL 78 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lun n ALA 79 N -0.09 0.00 -1.98 2.33 0.00 -1.26 -4.86 120.51 114.64 1lun n ALA 79 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1lun n ALA 79 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.22 1lun n ALA 79 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1lun n GLU 80 N 0.00 -2.43 -1.91 0.00 1.02 -1.26 -4.74 120.64 111.32 1lun n GLU 80 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1lun n GLU 80 Cb 0.00 -3.57 0.00 0.00 -0.02 0.00 0.00 31.44 27.85 1lun n GLU 80 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 1lun n LYS 81 N -1.89 1.70 0.00 3.49 0.00 -1.26 -5.01 118.16 115.20 1lun n LYS 81 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 1lun n LYS 81 Cb 0.36 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.39 1lun n LYS 81 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.40 178.06 1lun n TYR 82 N 0.00 0.00 -4.18 5.58 4.02 -1.26 -4.63 117.16 116.69 1lun n TYR 82 Ca 0.00 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.56 1lun n TYR 82 Cb 0.00 0.00 -0.08 0.00 -0.02 0.00 0.00 39.34 39.24 1lun n TYR 82 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1lun s VAL 83 N 0.00 4.47 0.14 -0.72 1.01 -1.25 -4.42 120.40 119.62 1lun s VAL 83 Ca 0.00 -0.50 0.03 0.00 0.00 0.00 0.00 61.98 61.51 1lun s VAL 83 Cb 0.00 -3.03 -0.01 0.00 0.00 0.00 0.00 36.38 33.34 1lun s VAL 83 CO 0.00 0.36 0.12 0.49 0.00 0.00 0.00 175.10 176.07 1lun n PHE 84 N 1.27 -0.33 -0.55 5.22 3.01 0.76 -4.04 117.46 122.80 1lun n PHE 84 Ca -0.14 -1.15 0.07 0.00 1.01 0.00 0.00 57.45 57.24 1lun n PHE 84 Cb 0.53 0.12 0.22 0.00 -0.01 0.00 0.00 39.48 40.34 1lun n PHE 84 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1lun n ASP 85 N -2.46 3.55 -3.64 4.37 2.03 -1.26 0.49 116.55 119.63 1lun n ASP 85 Ca 0.03 -2.45 -0.05 0.00 0.52 0.00 0.00 54.79 52.84 1lun n ASP 85 Cb 0.25 -0.40 -0.06 0.00 -0.72 0.00 0.00 41.12 40.19 1lun n ASP 85 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1lun s SER 86 N -1.34 -0.17 0.22 1.67 0.01 -1.26 -4.91 113.70 107.93 1lun s SER 86 Ca 0.34 0.29 -0.07 0.00 1.31 0.00 0.00 55.95 57.82 1lun s SER 86 Cb 0.23 0.28 0.35 0.00 0.21 0.00 0.00 66.02 67.09 1lun s SER 86 CO 0.14 -0.09 1.74 0.40 0.41 0.00 0.00 173.24 175.84 1lun h ILE 87 N 2.91 0.72 -0.44 1.44 5.03 -1.94 0.83 117.51 126.05 1lun h ILE 87 Ca -0.22 -0.14 0.08 0.00 -0.12 0.00 0.00 64.86 64.46 1lun h ILE 87 Cb 1.19 0.26 -0.07 0.00 -3.03 0.00 0.00 36.82 35.16 1lun h ILE 87 CO 0.19 0.08 -0.02 1.55 -0.68 0.00 0.00 178.15 179.26 1lun h PRO 88 N 0.42 0.08 -0.20 2.37 0.13 -1.95 8.48 132.00 141.33 1lun h PRO 88 Ca 0.35 -0.01 -0.09 0.00 -0.87 0.00 0.00 66.00 65.39 1lun h PRO 88 Cb 0.48 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.59 1lun h PRO 88 CO -0.35 0.06 -0.21 -0.07 -0.23 0.00 0.00 178.00 177.19 1lun h LEU 89 N 0.09 0.53 -1.27 1.56 4.07 -1.73 4.80 115.31 123.35 1lun h LEU 89 Ca 0.22 -0.48 0.07 0.00 0.08 0.00 0.00 57.88 57.76 1lun h LEU 89 Cb 0.32 -0.15 -0.05 0.00 1.08 0.00 0.00 40.66 41.86 1lun h LEU 89 CO -0.38 0.91 0.53 0.25 -1.08 0.00 0.00 178.44 178.67 1lun h LEU 90 N 0.16 0.78 0.09 1.67 6.46 0.22 1.50 115.31 126.18 1lun h LEU 90 Ca 0.03 0.01 -0.14 0.00 -0.12 0.00 0.00 57.88 57.65 1lun h LEU 90 Cb 0.76 -0.16 0.02 0.00 -0.73 0.00 0.00 40.66 40.55 1lun h LEU 90 CO 0.05 0.49 -0.62 0.40 -0.62 0.00 0.00 178.44 178.14 1lun h ILE 91 N 0.88 1.55 -0.98 4.05 1.08 1.86 -2.38 117.51 123.57 1lun h ILE 91 Ca 0.35 -2.41 0.11 0.00 -0.39 0.00 0.00 64.86 62.53 1lun h ILE 91 Cb 0.25 3.12 -0.08 0.00 -3.07 0.00 0.00 36.82 37.05 1lun h ILE 91 CO -0.13 0.67 0.61 1.56 -0.69 0.00 0.00 178.15 180.17 1lun h GLN 92 N -0.44 0.96 -0.41 2.37 1.08 1.03 2.04 115.11 121.74 1lun h GLN 92 Ca -0.10 -0.06 -0.07 0.00 -1.45 0.00 0.00 58.65 56.97 1lun h GLN 92 Cb 1.46 -0.22 -0.01 0.00 -0.05 0.00 0.00 27.48 28.66 1lun h GLN 92 CO 0.12 0.63 -0.01 0.10 -0.95 0.00 0.00 178.83 178.72 1lun h TYR 93 N 0.98 0.81 -0.11 2.96 -0.00 0.20 -2.18 116.97 119.64 1lun h TYR 93 Ca 0.48 -0.15 -0.04 0.00 0.00 0.00 0.00 58.73 59.02 1lun h TYR 93 Cb 0.44 -0.21 -0.00 0.00 0.00 0.00 0.00 36.73 36.95 1lun h TYR 93 CO -0.01 0.82 -0.09 0.45 -0.00 0.00 0.00 178.16 179.33 1lun h HIS 94 N 0.57 0.30 -1.05 0.10 3.86 -0.47 -2.50 115.15 115.97 1lun h HIS 94 Ca 0.12 -0.08 0.28 0.00 -1.16 0.00 0.00 60.37 59.52 1lun h HIS 94 Cb 0.50 -0.07 -0.10 0.00 1.06 0.00 0.00 27.41 28.81 1lun h HIS 94 CO 0.04 0.64 0.67 1.96 0.86 0.00 0.00 177.93 182.11 1lun h GLN 95 N -0.12 0.37 0.00 2.45 4.20 0.34 -3.27 115.11 119.08 1lun h GLN 95 Ca 0.02 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1lun h GLN 95 Cb 0.58 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.28 1lun h GLN 95 CO 0.02 0.25 0.00 0.66 -0.67 0.00 0.00 178.83 179.09 1lun n TYR 96 N -4.65 0.00 0.00 2.96 4.01 -0.83 -4.74 117.16 113.91 1lun n TYR 96 Ca 0.26 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 58.00 1lun n TYR 96 Cb 0.91 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.94 1lun n TYR 96 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1lun n ASN 97 N 0.00 0.00 -0.49 7.72 3.02 -0.95 -4.63 115.26 119.93 1lun n ASN 97 Ca 0.00 0.00 -0.01 0.00 -0.03 0.00 0.00 54.58 54.54 1lun n ASN 97 Cb 0.00 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.16 1lun n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lun n GLY 98 N 0.00 0.54 3.12 7.41 0.00 -1.26 -5.03 105.19 109.97 1lun n GLY 98 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 1lun n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lun n GLY 99 N 0.00 -0.11 0.00 -0.02 0.00 -1.26 -4.72 105.19 99.08 1lun n GLY 99 Ca -0.06 0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1lun n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lun n GLY 100 N 4.80 0.00 1.31 -0.02 0.00 -1.26 -3.88 105.19 106.14 1lun n GLY 100 Ca 0.14 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.18 1lun n GLY 100 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1lun n LEU 101 N 0.00 -0.92 -0.01 0.99 4.32 -1.26 0.38 117.00 120.50 1lun n LEU 101 Ca 0.00 1.62 0.00 0.00 -0.02 0.00 0.00 56.01 57.61 1lun n LEU 101 Cb 0.00 -2.48 0.01 0.00 -1.62 0.00 0.00 43.42 39.33 1lun n LEU 101 CO 0.00 -0.58 0.02 1.33 -1.22 0.00 0.00 177.39 176.94 1lun n VAL 102 N -2.56 -0.01 -2.65 4.08 0.24 -1.26 -2.17 118.33 114.00 1lun n VAL 102 Ca -0.01 0.05 -0.04 0.00 -2.04 0.00 0.00 64.34 62.30 1lun n VAL 102 Cb 0.30 -0.07 0.05 0.00 -1.47 0.00 0.00 33.84 32.64 1lun n VAL 102 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1lun n THR 103 N -3.55 0.00 -3.91 3.34 -2.24 -1.24 -4.90 114.28 101.78 1lun n THR 103 Ca 0.01 -0.84 -0.33 0.00 -2.27 0.00 0.00 64.05 60.62 1lun n THR 103 Cb 0.02 0.75 0.01 0.00 -2.10 0.00 0.00 70.33 69.01 1lun n THR 103 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1lun n ARG 104 N -0.63 -1.08 -3.28 -0.78 1.85 0.16 -3.14 116.66 109.76 1lun n ARG 104 Ca -0.15 0.51 -0.16 0.00 -1.00 0.00 0.00 57.85 57.05 1lun n ARG 104 Cb 0.72 -2.30 0.02 0.00 -1.05 0.00 0.00 32.46 29.84 1lun n ARG 104 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1lun n LEU 105 N -3.49 -3.61 -0.00 2.89 7.99 -1.23 -2.68 117.00 116.86 1lun n LEU 105 Ca -0.25 0.24 -0.07 0.00 -0.01 0.00 0.00 56.01 55.92 1lun n LEU 105 Cb 0.65 -1.78 -0.13 0.00 -0.11 0.00 0.00 43.42 42.06 1lun n LEU 105 CO 0.68 -1.00 -0.41 -0.09 -1.51 0.00 0.00 177.39 175.06 1lun h ARG 106 N 2.88 0.00 -0.74 3.23 9.65 -1.51 -3.29 114.38 124.60 1lun h ARG 106 Ca -0.23 0.00 0.03 0.00 -1.10 0.00 0.00 59.98 58.68 1lun h ARG 106 Cb 1.11 0.00 -0.19 0.00 -1.39 0.00 0.00 29.97 29.50 1lun h ARG 106 CO 0.11 0.50 -0.31 -0.47 2.80 0.00 0.00 179.97 182.60 1lun s TYR 107 N -2.67 -1.32 -0.33 2.20 5.04 -1.24 -4.95 117.35 114.08 1lun s TYR 107 Ca -0.04 0.39 -0.33 0.00 -2.44 0.00 0.00 57.07 54.65 1lun s TYR 107 Cb 0.08 0.24 -0.10 0.00 0.35 0.00 0.00 41.96 42.53 1lun s TYR 107 CO 0.82 -0.85 2.21 -0.35 -1.34 0.00 0.00 175.55 176.04 1lun n PRO 108 N 4.55 1.25 -2.55 4.97 -0.04 -1.19 0.18 135.00 142.18 1lun n PRO 108 Ca 0.08 0.33 -0.42 0.00 -0.04 0.00 0.00 63.50 63.46 1lun n PRO 108 Cb 0.58 -2.64 -0.03 0.00 -0.04 0.00 0.00 33.50 31.36 1lun n PRO 108 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1lun s VAL 109 N 7.70 4.24 -0.58 0.52 1.01 5.15 -3.39 120.40 135.05 1lun s VAL 109 Ca 1.08 1.71 0.04 0.00 0.00 0.00 0.00 61.98 64.80 1lun s VAL 109 Cb -0.73 -4.09 0.15 0.00 0.00 0.00 0.00 36.38 31.71 1lun s VAL 109 CO 0.45 0.19 0.36 0.00 0.00 0.00 0.00 175.10 176.11