#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lum n ASN 5 N 0.00 -1.30 0.00 6.41 3.02 -1.26 -4.87 115.26 117.25 1lum n ASN 5 Ca 0.00 1.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.55 1lum n ASN 5 Cb 0.00 -0.86 0.00 0.00 -0.61 0.00 0.00 39.78 38.31 1lum n ASN 5 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1lum n LEU 6 N 1.86 0.00 -1.50 3.41 4.77 -1.26 -4.85 117.00 119.43 1lum n LEU 6 Ca 0.16 0.00 -0.02 0.00 -0.03 0.00 0.00 56.01 56.11 1lum n LEU 6 Cb 0.24 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1lum n LEU 6 CO 0.51 0.00 -0.01 -1.84 -1.33 0.00 0.00 177.39 174.72 1lum n GLU 7 N -0.82 -1.66 0.00 3.23 0.28 -1.26 -4.30 120.64 116.11 1lum n GLU 7 Ca 0.00 0.01 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 1lum n GLU 7 Cb 0.00 -1.80 0.00 0.00 1.43 0.00 0.00 31.44 31.07 1lum n GLU 7 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 1lum n THR 8 N -1.13 0.00 -4.37 3.84 -2.24 -1.26 -5.03 114.28 104.10 1lum n THR 8 Ca 0.01 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 1lum n THR 8 Cb 0.20 0.89 -0.10 0.00 -2.10 0.00 0.00 70.33 69.22 1lum n THR 8 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1lum s TYR 9 N 0.00 3.11 0.27 4.78 2.02 -1.26 -4.95 117.35 121.32 1lum s TYR 9 Ca 0.00 0.03 0.14 0.00 -0.37 0.00 0.00 57.07 56.87 1lum s TYR 9 Cb 0.00 -1.86 0.79 0.00 -0.40 0.00 0.00 41.96 40.49 1lum s TYR 9 CO 0.00 0.28 1.36 1.05 -1.57 0.00 0.00 175.55 176.67 1lum h GLU 10 N 5.76 0.00 0.02 -0.62 4.11 -1.91 0.26 114.58 122.20 1lum h GLU 10 Ca -0.44 0.00 -0.37 0.00 0.07 0.00 0.00 59.36 58.62 1lum h GLU 10 Cb 1.19 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 30.37 1lum h GLU 10 CO 0.58 0.00 -2.34 -2.67 0.07 0.00 0.00 179.01 174.66 1lum n TRP 11 N -2.26 0.23 -2.15 2.06 4.27 -1.16 0.87 117.44 119.31 1lum n TRP 11 Ca -0.01 0.06 -0.39 0.00 -3.89 0.00 0.00 57.50 53.27 1lum n TRP 11 Cb 0.45 -1.03 -0.01 0.00 -1.36 0.00 0.00 31.31 29.35 1lum n TRP 11 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 1lum s TYR 12 N -2.52 2.95 -0.32 -2.67 5.04 0.93 0.49 117.35 121.25 1lum s TYR 12 Ca -0.24 1.47 -0.02 0.00 -2.44 0.00 0.00 57.07 55.84 1lum s TYR 12 Cb 0.08 -3.57 0.11 0.00 0.35 0.00 0.00 41.96 38.94 1lum s TYR 12 CO 0.71 -1.76 0.16 1.21 -1.34 0.00 0.00 175.55 174.53 1lum s ASN 13 N -0.85 3.39 0.00 4.32 3.84 1.76 -4.47 114.94 122.94 1lum s ASN 13 Ca 0.56 -1.66 0.00 0.00 0.21 0.00 0.00 52.86 51.97 1lum s ASN 13 Cb -0.36 -0.43 0.00 0.00 -0.55 0.00 0.00 41.25 39.92 1lum s ASN 13 CO 0.46 -0.39 0.00 2.29 -2.79 0.00 0.00 177.10 176.67 1lum n LYS 14 N 4.76 0.00 -1.32 0.43 2.85 -1.26 -1.83 118.16 121.79 1lum n LYS 14 Ca 0.01 0.00 -0.23 0.00 -1.05 0.00 0.00 58.31 57.03 1lum n LYS 14 Cb 0.40 0.00 -0.10 0.00 -0.65 0.00 0.00 35.03 34.68 1lum n LYS 14 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 177.40 177.80 1lum n SER 15 N 0.00 6.37 -4.69 -5.58 2.88 -1.26 -1.27 113.62 110.06 1lum n SER 15 Ca 0.00 -2.83 -0.31 0.00 -1.33 0.00 0.00 58.87 54.40 1lum n SER 15 Cb 0.00 -1.36 0.15 0.00 -0.75 0.00 0.00 64.21 62.25 1lum n SER 15 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1lum s ILE 16 N -0.31 2.26 0.04 2.46 1.01 -0.76 -4.97 121.20 120.94 1lum s ILE 16 Ca 0.63 0.09 0.07 0.00 0.00 0.00 0.00 60.65 61.44 1lum s ILE 16 Cb 0.32 -2.20 -0.02 0.00 0.01 0.00 0.00 42.46 40.56 1lum s ILE 16 CO -0.10 -0.11 -0.20 -0.55 0.00 0.00 0.00 174.94 173.98 1lum s SER 17 N -2.75 2.39 0.60 3.58 0.15 -1.26 -4.78 113.70 111.62 1lum s SER 17 Ca 0.66 -0.52 0.29 0.00 0.70 0.00 0.00 55.95 57.08 1lum s SER 17 Cb -0.22 -0.19 1.35 0.00 -1.71 0.00 0.00 66.02 65.25 1lum s SER 17 CO 0.57 0.14 1.75 0.08 1.20 0.00 0.00 173.24 176.98 1lum h ARG 18 N 4.85 0.00 -0.05 5.44 0.11 -1.99 0.26 114.38 123.00 1lum h ARG 18 Ca -0.42 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.57 1lum h ARG 18 Cb 1.16 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.25 1lum h ARG 18 CO 0.44 0.00 -0.33 0.22 0.10 0.00 0.00 179.97 180.39 1lum h ASP 19 N 0.00 0.38 0.02 0.08 3.58 -2.01 -3.28 116.42 115.19 1lum h ASP 19 Ca 0.28 -0.68 -0.04 0.00 0.42 0.00 0.00 57.03 57.01 1lum h ASP 19 Cb 1.61 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 42.55 1lum h ASP 19 CO -0.00 1.00 -0.18 0.11 -2.88 0.00 0.00 179.24 177.29 1lum h LYS 20 N -0.21 0.08 -0.71 0.28 6.56 -0.98 -3.24 116.57 118.35 1lum h LYS 20 Ca -0.03 -0.12 0.16 0.00 -1.06 0.00 0.00 60.65 59.60 1lum h LYS 20 Cb 1.01 0.04 -0.11 0.00 -0.57 0.00 0.00 32.23 32.59 1lum h LYS 20 CO 0.07 0.98 0.10 0.00 -2.06 0.00 0.00 179.45 178.54 1lum h ALA 21 N 0.11 0.83 -0.57 3.86 0.00 -1.17 0.83 119.26 123.15 1lum h ALA 21 Ca -0.03 0.19 -0.02 0.00 0.00 0.00 0.00 54.91 55.05 1lum h ALA 21 Cb 1.07 0.29 -0.03 0.00 0.00 0.00 0.00 17.79 19.12 1lum h ALA 21 CO 0.03 -0.37 0.27 0.93 0.00 0.00 0.00 179.25 180.11 1lum h GLU 22 N 0.19 0.83 0.20 0.00 5.08 -1.71 0.98 114.58 120.16 1lum h GLU 22 Ca 0.39 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.62 1lum h GLU 22 Cb 0.67 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.77 1lum h GLU 22 CO -0.55 0.68 -0.10 0.87 -1.00 0.00 0.00 179.01 178.91 1lum h LYS 23 N 0.78 -0.26 -0.32 2.33 1.79 -0.82 1.01 116.57 121.07 1lum h LYS 23 Ca 0.20 0.02 0.06 0.00 -2.18 0.00 0.00 60.65 58.74 1lum h LYS 23 Cb 0.13 0.06 -0.05 0.00 -1.58 0.00 0.00 32.23 30.79 1lum h LYS 23 CO -0.02 -0.13 0.01 1.37 -1.08 0.00 0.00 179.45 179.59 1lum h LEU 24 N -0.33 -0.11 0.12 2.94 8.10 0.81 -0.18 115.31 126.66 1lum h LEU 24 Ca -0.03 0.07 0.02 0.00 0.11 0.00 0.00 57.88 58.05 1lum h LEU 24 Cb 0.25 0.12 -0.03 0.00 -0.44 0.00 0.00 40.66 40.56 1lum h LEU 24 CO 0.05 -0.02 -0.24 -0.07 -4.11 0.00 0.00 178.44 174.04 1lum h LEU 25 N 0.10 -0.69 -1.80 0.17 3.38 0.15 0.27 115.31 116.89 1lum h LEU 25 Ca 0.15 0.08 0.06 0.00 0.09 0.00 0.00 57.88 58.26 1lum h LEU 25 Cb 0.20 0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.21 1lum h LEU 25 CO -0.25 -0.33 0.46 -0.07 0.09 0.00 0.00 178.44 178.34 1lum h LEU 26 N -0.45 0.00 0.21 1.67 -0.00 0.18 0.43 115.31 117.34 1lum h LEU 26 Ca 0.03 0.00 -0.31 0.00 -0.00 0.00 0.00 57.88 57.59 1lum h LEU 26 Cb 0.47 0.00 0.04 0.00 -0.00 0.00 0.00 40.66 41.17 1lum h LEU 26 CO -0.14 0.00 -1.35 -0.78 -0.00 0.00 0.00 178.44 176.17 1lum h ASP 27 N 0.00 0.83 0.37 -0.43 1.82 0.13 -3.34 116.42 115.80 1lum h ASP 27 Ca 0.10 -0.89 -0.01 0.00 -0.39 0.00 0.00 57.03 55.84 1lum h ASP 27 Cb 1.03 -0.27 -0.01 0.00 0.68 0.00 0.00 39.33 40.76 1lum h ASP 27 CO -0.00 1.66 -0.26 0.71 -1.61 0.00 0.00 179.24 179.74 1lum h THR 28 N 0.14 0.46 -0.23 2.25 1.35 0.11 -3.48 112.91 113.51 1lum h THR 28 Ca -0.23 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.63 1lum h THR 28 Cb 2.05 0.46 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 1lum h THR 28 CO 0.26 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.14 1lum n GLY 29 N -1.39 1.04 3.46 5.82 0.00 -1.01 -5.09 105.19 108.02 1lum n GLY 29 Ca -0.10 -0.46 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 1lum n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lum s LYS 30 N -2.75 1.81 -0.48 1.61 3.01 -1.26 -4.96 119.74 116.71 1lum s LYS 30 Ca 0.00 -1.15 -0.25 0.00 -1.01 0.00 0.00 55.97 53.56 1lum s LYS 30 Cb 0.00 -2.10 0.03 0.00 -1.01 0.00 0.00 37.83 34.75 1lum s LYS 30 CO 0.00 0.49 0.94 -1.83 0.51 0.00 0.00 175.35 175.46 1lum s GLU 31 N -1.93 3.50 0.00 1.68 -1.05 -1.26 -3.09 118.70 116.55 1lum s GLU 31 Ca 0.16 0.09 0.00 0.00 -0.15 0.00 0.00 54.97 55.08 1lum s GLU 31 Cb -0.10 -3.95 0.00 0.00 -0.44 0.00 0.00 34.13 29.64 1lum s GLU 31 CO 0.08 -1.28 0.00 0.41 0.95 0.00 0.00 175.26 175.42 1lum n GLY 32 N 4.97 0.84 3.55 -3.83 0.00 1.66 -4.74 105.19 107.64 1lum n GLY 32 Ca 0.06 -0.26 -0.53 0.00 0.00 0.00 0.00 46.02 45.29 1lum n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lum n ALA 33 N -1.21 -1.87 -2.85 4.61 0.00 1.32 -2.68 120.51 117.83 1lum n ALA 33 Ca 0.00 0.52 -0.33 0.00 0.00 0.00 0.00 53.44 53.63 1lum n ALA 33 Cb 0.00 -1.93 -0.13 0.00 0.00 0.00 0.00 19.45 17.39 1lum n ALA 33 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1lum s PHE 34 N 0.04 2.87 0.11 0.00 5.36 0.53 0.29 117.98 127.18 1lum s PHE 34 Ca 0.82 -0.35 -0.07 0.00 -0.96 0.00 0.00 56.93 56.37 1lum s PHE 34 Cb -1.02 -1.81 -0.01 0.00 -0.34 0.00 0.00 43.02 39.84 1lum s PHE 34 CO 0.52 -0.00 0.16 1.41 -1.46 0.00 0.00 175.22 175.85 1lum s MET 35 N -0.05 0.90 0.06 10.12 -2.45 2.06 1.11 119.30 131.05 1lum s MET 35 Ca -0.01 -1.12 0.06 0.00 -1.25 0.00 0.00 55.69 53.37 1lum s MET 35 Cb -0.14 0.32 -0.03 0.00 1.25 0.00 0.00 34.83 36.23 1lum s MET 35 CO 0.03 -0.28 -0.17 0.08 1.05 0.00 0.00 175.02 175.73 1lum s VAL 36 N -3.92 1.34 -0.11 10.11 1.01 1.83 0.62 120.40 131.29 1lum s VAL 36 Ca 0.11 -1.21 -0.05 0.00 0.00 0.00 0.00 61.98 60.83 1lum s VAL 36 Cb 0.05 -1.22 0.05 0.00 0.00 0.00 0.00 36.38 35.27 1lum s VAL 36 CO -0.06 -0.01 0.23 -0.13 0.00 0.00 0.00 175.10 175.13 1lum s ARG 37 N -1.42 0.15 0.54 2.72 3.00 1.83 0.48 118.95 126.26 1lum s ARG 37 Ca 0.03 0.60 -0.20 0.00 0.00 0.00 0.00 55.73 56.16 1lum s ARG 37 Cb -0.09 -0.11 -0.08 0.00 0.00 0.00 0.00 34.95 34.67 1lum s ARG 37 CO 0.02 -0.23 0.82 -3.47 0.00 0.00 0.00 175.30 172.45 1lum n ASP 38 N 4.78 0.25 -3.77 0.23 2.03 -0.40 0.34 116.55 120.01 1lum n ASP 38 Ca -0.16 0.84 -0.13 0.00 0.52 0.00 0.00 54.79 55.86 1lum n ASP 38 Cb 0.51 -1.30 -0.10 0.00 -0.72 0.00 0.00 41.12 39.51 1lum n ASP 38 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1lum s SER 39 N -1.10 -0.27 0.00 1.67 0.15 -1.24 -4.63 113.70 108.28 1lum s SER 39 Ca 0.70 0.43 0.06 0.00 0.70 0.00 0.00 55.95 57.84 1lum s SER 39 Cb -0.46 0.52 0.34 0.00 -1.71 0.00 0.00 66.02 64.71 1lum s SER 39 CO 0.52 -0.22 1.00 -1.14 1.20 0.00 0.00 173.24 174.60 1lum n ARG 40 N 2.38 0.13 -0.61 5.44 0.00 -1.26 -4.41 116.66 118.31 1lum n ARG 40 Ca -0.16 0.16 -0.02 0.00 -0.00 0.00 0.00 57.85 57.83 1lum n ARG 40 Cb 0.57 -1.50 0.02 0.00 0.00 0.00 0.00 32.46 31.55 1lum n ARG 40 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 1lum n THR 41 N -1.20 0.00 0.00 5.15 5.66 -1.26 -4.30 114.28 118.33 1lum n THR 41 Ca 0.04 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.04 1lum n THR 41 Cb 0.04 -0.05 0.00 0.00 -1.55 0.00 0.00 70.33 68.77 1lum n THR 41 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1lum n PRO 42 N 2.08 0.00 0.00 1.09 -0.04 -1.26 -4.22 135.00 132.65 1lum n PRO 42 Ca 0.01 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1lum n PRO 42 Cb 0.03 -1.13 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 1lum n PRO 42 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lum n GLY 43 N -0.30 1.53 0.00 0.55 0.00 -1.26 -4.99 105.19 100.71 1lum n GLY 43 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1lum n GLY 43 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1lum n THR 44 N -0.73 0.00 -4.35 2.61 5.66 -1.26 -5.05 114.28 111.16 1lum n THR 44 Ca 0.00 0.00 -0.19 0.00 -3.05 0.00 0.00 64.05 60.81 1lum n THR 44 Cb 0.00 -0.92 -0.10 0.00 -1.55 0.00 0.00 70.33 67.76 1lum n THR 44 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1lum s TYR 45 N 1.47 1.74 0.04 1.09 1.51 -1.26 -3.63 117.35 118.31 1lum s TYR 45 Ca 0.00 -0.57 -0.01 0.00 -1.01 0.00 0.00 57.07 55.48 1lum s TYR 45 Cb 0.00 -0.81 -0.04 0.00 -0.11 0.00 0.00 41.96 41.00 1lum s TYR 45 CO 0.00 0.37 0.21 0.99 -1.11 0.00 0.00 175.55 176.01 1lum s THR 46 N -2.96 5.39 -0.27 -0.71 2.01 1.05 0.18 115.64 120.34 1lum s THR 46 Ca 0.23 -0.29 0.02 0.00 0.31 0.00 0.00 61.69 61.97 1lum s THR 46 Cb -0.01 -3.60 0.06 0.00 0.01 0.00 0.00 72.50 68.96 1lum s THR 46 CO 0.07 0.20 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.42 1lum s VAL 47 N -1.46 2.27 -0.45 3.82 1.01 2.37 0.49 120.40 128.46 1lum s VAL 47 Ca 0.33 -1.63 -0.28 0.00 0.00 0.00 0.00 61.98 60.40 1lum s VAL 47 Cb -0.13 -2.35 0.03 0.00 0.00 0.00 0.00 36.38 33.93 1lum s VAL 47 CO 0.25 -0.06 1.06 -0.55 0.00 0.00 0.00 175.10 175.80 1lum s SER 48 N 1.11 6.63 -0.13 3.32 0.15 2.69 0.56 113.70 128.03 1lum s SER 48 Ca -0.08 0.43 -0.00 0.00 0.70 0.00 0.00 55.95 57.00 1lum s SER 48 Cb -0.20 -2.52 -0.02 0.00 -1.71 0.00 0.00 66.02 61.58 1lum s SER 48 CO -0.05 -1.13 -0.12 0.68 1.20 0.00 0.00 173.24 173.82 1lum s VAL 49 N 4.11 3.12 -0.05 4.45 -7.23 0.57 0.53 120.40 125.91 1lum s VAL 49 Ca 0.44 -0.64 0.04 0.00 -1.81 0.00 0.00 61.98 60.01 1lum s VAL 49 Cb -0.09 -2.31 -0.00 0.00 0.56 0.00 0.00 36.38 34.54 1lum s VAL 49 CO 0.28 0.52 -0.16 0.12 -0.31 0.00 0.00 175.10 175.55 1lum s PHE 50 N 0.35 1.61 -0.12 2.82 2.19 0.84 0.40 117.98 126.07 1lum s PHE 50 Ca -0.10 -0.48 -0.08 0.00 0.33 0.00 0.00 56.93 56.60 1lum s PHE 50 Cb -0.16 -1.10 -0.04 0.00 -1.31 0.00 0.00 43.02 40.41 1lum s PHE 50 CO 0.06 -0.18 0.15 0.99 1.83 0.00 0.00 175.22 178.07 1lum s THR 51 N 0.15 5.48 0.67 0.12 2.01 2.70 0.47 115.64 127.24 1lum s THR 51 Ca -0.06 0.24 -0.11 0.00 0.31 0.00 0.00 61.69 62.08 1lum s THR 51 Cb -0.12 -3.42 -0.01 0.00 0.01 0.00 0.00 72.50 68.97 1lum s THR 51 CO 0.02 0.61 1.05 -0.54 -0.69 0.00 0.00 174.62 175.08 1lum s LYS 52 N -0.99 3.14 0.00 4.92 -0.14 -1.23 -1.98 119.74 123.45 1lum s LYS 52 Ca 0.15 0.79 0.00 0.00 -1.36 0.00 0.00 55.97 55.56 1lum s LYS 52 Cb -0.12 -2.02 0.00 0.00 -1.68 0.00 0.00 37.83 34.00 1lum s LYS 52 CO 0.04 -0.92 0.00 0.00 -0.76 0.00 0.00 175.35 173.72 1lum n ALA 53 N -2.99 0.00 0.00 5.17 0.00 -1.26 -3.27 120.51 118.16 1lum n ALA 53 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 1lum n ALA 53 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.99 1lum n ALA 53 CO 0.00 0.00 0.00 1.51 0.00 0.00 0.00 177.50 179.01 1lum n ILE 54 N 0.00 0.00 0.00 0.00 3.06 -1.26 -4.88 119.36 116.28 1lum n ILE 54 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1lum n ILE 54 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 1lum n ILE 54 CO 0.00 0.00 0.00 2.30 -2.50 0.00 0.00 176.55 176.35 1lum n ILE 55 N 0.03 0.00 0.10 9.51 -0.00 -1.26 -4.94 119.36 122.80 1lum n ILE 55 Ca 0.00 0.00 0.06 0.00 -0.00 0.00 0.00 62.75 62.81 1lum n ILE 55 Cb 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 39.64 39.76 1lum n ILE 55 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 1lum n SER 56 N 0.00 2.59 0.00 7.28 2.88 -1.26 -5.04 113.62 120.07 1lum n SER 56 Ca 0.00 -1.79 0.00 0.00 -1.33 0.00 0.00 58.87 55.75 1lum n SER 56 Cb 0.00 -0.15 0.00 0.00 -0.75 0.00 0.00 64.21 63.31 1lum n SER 56 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1lum n GLU 57 N 0.63 0.00 0.00 -1.46 -0.58 -1.26 -5.09 120.64 112.88 1lum n GLU 57 Ca 0.10 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1lum n GLU 57 Cb 0.38 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.25 1lum n GLU 57 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 1lum n ASN 58 N 0.00 0.00 -4.65 1.62 5.03 -1.26 -4.76 115.26 111.24 1lum n ASN 58 Ca 0.00 0.00 -0.42 0.00 0.87 0.00 0.00 54.58 55.03 1lum n ASN 58 Cb 0.00 0.00 -0.04 0.00 -1.02 0.00 0.00 39.78 38.72 1lum n ASN 58 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1lum s PRO 59 N 0.00 4.21 -0.00 3.52 0.04 -1.20 -4.52 135.00 137.05 1lum s PRO 59 Ca 0.00 0.96 0.02 0.00 0.04 0.00 0.00 61.00 62.01 1lum s PRO 59 Cb 0.00 -3.62 -0.01 0.00 0.04 0.00 0.00 34.50 30.91 1lum s PRO 59 CO 0.00 -0.46 -0.06 0.00 0.04 0.00 0.00 177.00 176.52 1lum s ILE 61 N -0.22 2.43 -0.20 0.00 1.09 -1.25 0.62 121.20 123.67 1lum s ILE 61 Ca 0.02 -2.17 -0.08 0.00 -1.10 0.00 0.00 60.65 57.32 1lum s ILE 61 Cb -0.03 -2.71 -0.04 0.00 -1.06 0.00 0.00 42.46 38.62 1lum s ILE 61 CO -0.00 -0.51 0.08 -0.54 -0.10 0.00 0.00 174.94 173.86 1lum s LYS 62 N 0.98 3.93 -0.55 2.79 -0.14 1.33 -4.86 119.74 123.23 1lum s LYS 62 Ca 0.07 -0.36 -0.20 0.00 -1.36 0.00 0.00 55.97 54.12 1lum s LYS 62 Cb -0.20 -3.27 0.06 0.00 -1.68 0.00 0.00 37.83 32.74 1lum s LYS 62 CO -0.07 0.17 0.74 -1.01 -0.76 0.00 0.00 175.35 174.42 1lum s HIS 63 N 0.66 2.95 -0.37 3.18 3.76 -1.25 0.21 115.29 124.43 1lum s HIS 63 Ca 0.04 -0.50 -0.20 0.00 -0.15 0.00 0.00 55.06 54.25 1lum s HIS 63 Cb -0.13 -3.81 0.01 0.00 1.11 0.00 0.00 32.58 29.76 1lum s HIS 63 CO 0.02 -1.21 0.62 0.71 -0.85 0.00 0.00 174.74 174.02 1lum s TYR 64 N 3.07 3.14 0.28 1.40 2.02 2.26 -4.70 117.35 124.81 1lum s TYR 64 Ca 0.18 0.22 -0.24 0.00 -0.37 0.00 0.00 57.07 56.87 1lum s TYR 64 Cb -0.18 -3.15 -0.09 0.00 -0.40 0.00 0.00 41.96 38.13 1lum s TYR 64 CO 0.12 -0.67 0.85 -1.58 -1.57 0.00 0.00 175.55 172.71 1lum s HIS 65 N 2.68 3.69 -0.54 2.71 2.46 -1.26 0.58 115.29 125.61 1lum s HIS 65 Ca 0.23 1.63 -0.23 0.00 0.47 0.00 0.00 55.06 57.16 1lum s HIS 65 Cb -0.15 -2.80 0.04 0.00 -0.13 0.00 0.00 32.58 29.54 1lum s HIS 65 CO 0.16 0.28 0.90 0.42 -2.47 0.00 0.00 174.74 174.02 1lum s ILE 66 N -1.55 4.45 0.44 0.89 -1.09 0.49 -4.35 121.20 120.48 1lum s ILE 66 Ca 0.47 0.19 -0.25 0.00 -2.23 0.00 0.00 60.65 58.83 1lum s ILE 66 Cb -0.18 -4.50 -0.08 0.00 -1.58 0.00 0.00 42.46 36.11 1lum s ILE 66 CO 0.23 -1.07 1.29 -0.75 -1.23 0.00 0.00 174.94 173.42 1lum s LYS 67 N 3.77 3.80 -0.07 2.79 2.47 1.97 -4.04 119.74 130.42 1lum s LYS 67 Ca 0.28 2.12 0.03 0.00 -1.56 0.00 0.00 55.97 56.84 1lum s LYS 67 Cb -0.13 -2.62 -0.02 0.00 -1.46 0.00 0.00 37.83 33.60 1lum s LYS 67 CO 0.18 -0.62 -0.16 -1.21 0.16 0.00 0.00 175.35 173.71 1lum s GLU 68 N -2.42 2.76 -0.35 4.03 2.02 -1.15 0.43 118.70 124.01 1lum s GLU 68 Ca 0.60 -0.73 0.01 0.00 0.02 0.00 0.00 54.97 54.88 1lum s GLU 68 Cb -0.37 -2.41 0.14 0.00 0.10 0.00 0.00 34.13 31.59 1lum s GLU 68 CO 0.47 0.47 0.28 -0.08 0.02 0.00 0.00 175.26 176.41 1lum s THR 69 N -0.33 -0.09 0.00 3.63 -1.32 1.90 -4.87 115.64 114.56 1lum s THR 69 Ca 0.03 -1.32 0.00 0.00 -1.21 0.00 0.00 61.69 59.18 1lum s THR 69 Cb -0.13 -0.91 0.00 0.00 -1.51 0.00 0.00 72.50 69.95 1lum s THR 69 CO 0.02 -0.79 0.40 0.59 -2.21 0.00 0.00 174.62 172.63 1lum n ASN 70 N 4.22 -0.79 0.00 8.08 3.02 -1.26 -3.55 115.26 124.98 1lum n ASN 70 Ca 0.10 -0.47 0.00 0.00 -0.03 0.00 0.00 54.58 54.19 1lum n ASN 70 Cb 0.41 -0.11 0.00 0.00 -0.61 0.00 0.00 39.78 39.47 1lum n ASN 70 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1lum n ASP 71 N 2.32 0.11 -3.16 6.41 -0.08 -1.22 -4.99 116.55 115.95 1lum n ASP 71 Ca 0.00 0.00 -0.22 0.00 -1.51 0.00 0.00 54.79 53.06 1lum n ASP 71 Cb 0.20 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 43.60 1lum n ASP 71 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 1lum n SER 72 N 0.00 -0.00 -0.04 1.67 3.41 -1.26 -4.64 113.62 112.75 1lum n SER 72 Ca 0.00 -2.76 -0.20 0.00 -0.26 0.00 0.00 58.87 55.65 1lum n SER 72 Cb 0.00 -0.46 -0.13 0.00 -0.26 0.00 0.00 64.21 63.36 1lum n SER 72 CO 0.00 0.00 0.00 -0.81 -0.16 0.00 0.00 175.04 174.07 1lum n PRO 73 N 1.34 0.72 -1.09 4.33 -0.04 -1.26 -5.07 135.00 133.93 1lum n PRO 73 Ca 0.20 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.89 1lum n PRO 73 Cb 0.55 -1.65 0.00 0.00 -0.04 0.00 0.00 33.50 32.36 1lum n PRO 73 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1lum n LYS 74 N -3.39 -0.11 -0.06 0.54 4.01 -1.26 -4.65 118.16 113.23 1lum n LYS 74 Ca -0.36 -0.06 -0.09 0.00 -0.51 0.00 0.00 58.31 57.30 1lum n LYS 74 Cb 1.03 0.10 -0.03 0.00 -0.51 0.00 0.00 35.03 35.62 1lum n LYS 74 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 1lum n ARG 75 N -0.24 0.42 -3.12 1.97 1.85 0.84 -3.39 116.66 114.99 1lum n ARG 75 Ca 0.00 0.17 -0.35 0.00 -1.00 0.00 0.00 57.85 56.67 1lum n ARG 75 Cb 0.00 -1.23 -0.06 0.00 -1.05 0.00 0.00 32.46 30.12 1lum n ARG 75 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1lum s TYR 76 N -2.67 3.57 -0.25 2.89 2.02 0.58 0.51 117.35 124.00 1lum s TYR 76 Ca -0.24 1.33 -0.31 0.00 -0.37 0.00 0.00 57.07 57.48 1lum s TYR 76 Cb 0.04 -2.59 0.17 0.00 -0.40 0.00 0.00 41.96 39.18 1lum s TYR 76 CO 0.34 0.27 1.27 1.52 -1.57 0.00 0.00 175.55 177.38 1lum s TYR 77 N -1.65 -0.11 -0.53 2.71 1.13 1.49 0.29 117.35 120.68 1lum s TYR 77 Ca 0.46 0.16 0.06 0.00 -1.41 0.00 0.00 57.07 56.34 1lum s TYR 77 Cb -0.15 0.49 0.23 0.00 -1.10 0.00 0.00 41.96 41.43 1lum s TYR 77 CO 0.20 -0.12 0.57 1.33 -2.51 0.00 0.00 175.55 175.03 1lum n VAL 78 N 0.41 0.71 0.00 -3.49 0.24 -1.26 0.52 118.33 115.46 1lum n VAL 78 Ca -0.01 -4.50 0.00 0.00 -2.04 0.00 0.00 64.34 57.78 1lum n VAL 78 Cb 0.58 -2.00 0.00 0.00 -1.47 0.00 0.00 33.84 30.95 1lum n VAL 78 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lum n ALA 79 N 1.49 0.00 -1.70 2.33 0.00 -1.26 -4.77 120.51 116.60 1lum n ALA 79 Ca 0.25 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.66 1lum n ALA 79 Cb 0.45 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.89 1lum n ALA 79 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1lum n GLU 80 N 0.00 -1.83 0.00 0.00 1.02 -1.26 -4.74 120.64 113.83 1lum n GLU 80 Ca 0.00 0.17 0.00 0.00 -0.02 0.00 0.00 57.16 57.31 1lum n GLU 80 Cb 0.00 -4.43 0.00 0.00 -0.02 0.00 0.00 31.44 26.99 1lum n GLU 80 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1lum n LYS 81 N -1.80 0.00 -3.92 3.49 5.02 -1.26 -4.96 118.16 114.73 1lum n LYS 81 Ca -0.03 0.00 -0.30 0.00 -2.02 0.00 0.00 58.31 55.96 1lum n LYS 81 Cb 0.29 -0.29 -0.16 0.00 -0.02 0.00 0.00 35.03 34.85 1lum n LYS 81 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1lum s TYR 82 N -0.01 2.34 0.27 2.13 1.51 -1.26 -5.10 117.35 117.23 1lum s TYR 82 Ca 0.00 -1.75 -0.16 0.00 -1.01 0.00 0.00 57.07 54.15 1lum s TYR 82 Cb 0.00 -1.60 -0.08 0.00 -0.11 0.00 0.00 41.96 40.16 1lum s TYR 82 CO 0.00 -0.78 0.70 0.08 -1.11 0.00 0.00 175.55 174.44 1lum s VAL 83 N 1.41 4.68 0.27 0.71 1.01 -1.25 -4.44 120.40 122.80 1lum s VAL 83 Ca -0.04 1.00 0.02 0.00 0.00 0.00 0.00 61.98 62.95 1lum s VAL 83 Cb -0.19 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.46 1lum s VAL 83 CO -0.07 -0.02 0.24 -0.36 0.00 0.00 0.00 175.10 174.89 1lum s PHE 84 N -1.78 1.35 -2.06 5.22 0.40 0.83 -4.22 117.98 117.71 1lum s PHE 84 Ca 0.49 -1.45 0.27 0.00 -0.60 0.00 0.00 56.93 55.64 1lum s PHE 84 Cb -0.13 -0.54 0.93 0.00 0.51 0.00 0.00 43.02 43.79 1lum s PHE 84 CO 0.19 -0.79 1.67 -3.47 0.70 0.00 0.00 175.22 173.52 1lum n ASP 85 N -0.88 1.16 -3.60 1.36 2.03 -1.26 0.22 116.55 115.58 1lum n ASP 85 Ca 0.04 -1.12 -0.11 0.00 0.52 0.00 0.00 54.79 54.12 1lum n ASP 85 Cb 0.64 0.06 -0.06 0.00 -0.72 0.00 0.00 41.12 41.04 1lum n ASP 85 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1lum s SER 86 N -2.28 -0.46 0.27 1.67 0.15 -1.26 -4.88 113.70 106.90 1lum s SER 86 Ca 0.31 0.69 -0.00 0.00 0.70 0.00 0.00 55.95 57.65 1lum s SER 86 Cb 0.20 0.63 0.52 0.00 -1.71 0.00 0.00 66.02 65.67 1lum s SER 86 CO 0.44 -0.29 1.81 0.40 1.20 0.00 0.00 173.24 176.79 1lum h ILE 87 N 3.11 0.86 -0.44 6.45 5.03 -1.90 0.65 117.51 131.27 1lum h ILE 87 Ca -0.24 -0.29 0.08 0.00 -0.12 0.00 0.00 64.86 64.29 1lum h ILE 87 Cb 1.16 -0.06 -0.07 0.00 -3.03 0.00 0.00 36.82 34.82 1lum h ILE 87 CO 0.22 0.15 0.00 1.55 -0.68 0.00 0.00 178.15 179.40 1lum h PRO 88 N 0.85 0.11 -0.08 2.37 0.13 -1.96 8.54 132.00 141.96 1lum h PRO 88 Ca 0.47 -0.01 -0.05 0.00 -0.87 0.00 0.00 66.00 65.55 1lum h PRO 88 Cb 0.52 -0.03 -0.00 0.00 0.13 0.00 0.00 31.00 31.63 1lum h PRO 88 CO -0.29 0.07 -0.13 -0.07 -0.23 0.00 0.00 178.00 177.35 1lum h LEU 89 N 0.12 0.26 -1.36 1.56 4.07 -1.73 4.13 115.31 122.36 1lum h LEU 89 Ca 0.22 -0.54 0.13 0.00 0.08 0.00 0.00 57.88 57.77 1lum h LEU 89 Cb 0.32 -0.08 -0.06 0.00 1.08 0.00 0.00 40.66 41.92 1lum h LEU 89 CO -0.36 0.75 0.54 0.25 -1.08 0.00 0.00 178.44 178.54 1lum h LEU 90 N -0.21 0.60 0.08 1.67 6.46 0.14 1.42 115.31 125.47 1lum h LEU 90 Ca 0.01 0.03 -0.12 0.00 -0.12 0.00 0.00 57.88 57.68 1lum h LEU 90 Cb 0.70 -0.09 0.01 0.00 -0.73 0.00 0.00 40.66 40.55 1lum h LEU 90 CO 0.03 0.32 -0.52 0.40 -0.62 0.00 0.00 178.44 178.05 1lum h ILE 91 N 0.65 1.59 -0.58 4.05 1.08 1.87 -3.02 117.51 123.16 1lum h ILE 91 Ca 0.41 -2.39 0.10 0.00 -0.39 0.00 0.00 64.86 62.58 1lum h ILE 91 Cb 0.66 3.17 -0.03 0.00 -3.07 0.00 0.00 36.82 37.55 1lum h ILE 91 CO -0.17 0.66 0.39 1.56 -0.69 0.00 0.00 178.15 179.90 1lum h GLN 92 N -0.53 0.35 -0.35 2.37 1.08 0.94 2.74 115.11 121.71 1lum h GLN 92 Ca -0.09 -0.02 -0.09 0.00 -1.45 0.00 0.00 58.65 57.00 1lum h GLN 92 Cb 1.38 -0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.72 1lum h GLN 92 CO 0.10 0.23 -0.15 0.10 -0.95 0.00 0.00 178.83 178.16 1lum h TYR 93 N 0.36 0.82 -0.03 2.96 -0.00 0.18 -1.86 116.97 119.40 1lum h TYR 93 Ca 0.27 -0.20 -0.23 0.00 0.00 0.00 0.00 58.73 58.57 1lum h TYR 93 Cb 0.57 -0.19 0.02 0.00 0.00 0.00 0.00 36.73 37.13 1lum h TYR 93 CO -0.00 0.91 -0.89 0.45 -0.00 0.00 0.00 178.16 178.63 1lum h HIS 94 N 0.49 0.96 -0.69 0.10 -0.00 -0.76 -2.81 115.15 112.44 1lum h HIS 94 Ca 0.08 -0.50 0.15 0.00 -0.00 0.00 0.00 60.37 60.10 1lum h HIS 94 Cb 0.68 -0.12 -0.11 0.00 -0.00 0.00 0.00 27.41 27.86 1lum h HIS 94 CO 0.06 1.33 0.09 1.96 -0.00 0.00 0.00 177.93 181.36 1lum h GLN 95 N 0.31 0.18 0.00 2.45 7.50 0.48 -3.34 115.11 122.70 1lum h GLN 95 Ca -0.10 -0.01 0.00 0.00 0.50 0.00 0.00 58.65 59.04 1lum h GLN 95 Cb 1.54 -0.04 0.00 0.00 0.05 0.00 0.00 27.48 29.03 1lum h GLN 95 CO 0.18 0.12 0.00 0.66 -1.50 0.00 0.00 178.83 178.29 1lum n TYR 96 N -5.23 0.00 0.00 2.96 4.02 -0.71 -4.83 117.16 113.38 1lum n TYR 96 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 1lum n TYR 96 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.74 1lum n TYR 96 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1lum n ASN 97 N 0.00 0.00 0.00 7.72 3.02 -1.06 -4.80 115.26 120.14 1lum n ASN 97 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1lum n ASN 97 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1lum n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lum n GLY 98 N 0.00 -1.81 3.69 7.41 0.00 -1.26 -5.03 105.19 108.19 1lum n GLY 98 Ca 0.00 0.77 -0.42 0.00 0.00 0.00 0.00 46.02 46.37 1lum n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lum n GLY 99 N 0.00 1.72 0.30 -0.02 0.00 -1.26 -4.76 105.19 101.17 1lum n GLY 99 Ca 0.00 0.73 0.23 0.00 0.00 0.00 0.00 46.02 46.98 1lum n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lum n GLY 100 N 4.29 -0.43 0.68 -0.02 0.00 -1.26 -1.22 105.19 107.24 1lum n GLY 100 Ca 0.18 0.32 -0.08 0.00 0.00 0.00 0.00 46.02 46.44 1lum n GLY 100 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1lum n LEU 101 N -2.99 -0.76 0.00 0.99 4.32 -1.26 -4.22 117.00 113.08 1lum n LEU 101 Ca 0.20 0.14 0.00 0.00 -0.02 0.00 0.00 56.01 56.33 1lum n LEU 101 Cb 0.86 -0.18 0.00 0.00 -1.62 0.00 0.00 43.42 42.48 1lum n LEU 101 CO 0.18 -1.00 0.00 0.55 -1.22 0.00 0.00 177.39 175.90 1lum n VAL 102 N -0.31 0.00 -2.69 4.08 3.14 -1.26 -0.43 118.33 120.86 1lum n VAL 102 Ca 0.02 0.00 -0.03 0.00 -2.96 0.00 0.00 64.34 61.37 1lum n VAL 102 Cb 0.10 0.00 0.12 0.00 -1.06 0.00 0.00 33.84 32.99 1lum n VAL 102 CO 0.00 0.00 0.00 0.35 -6.46 0.00 0.00 176.83 170.72 1lum n THR 103 N -3.17 0.15 -3.98 1.55 -2.24 -1.26 -4.95 114.28 100.38 1lum n THR 103 Ca 0.00 -1.36 -0.32 0.00 -2.27 0.00 0.00 64.05 60.10 1lum n THR 103 Cb 0.00 1.02 -0.02 0.00 -2.10 0.00 0.00 70.33 69.23 1lum n THR 103 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 1lum n ARG 104 N -1.21 -0.60 -3.20 -0.78 -4.01 0.43 -1.58 116.66 105.71 1lum n ARG 104 Ca -0.11 -0.02 -0.16 0.00 -1.04 0.00 0.00 57.85 56.51 1lum n ARG 104 Cb 0.86 -2.13 0.01 0.00 -3.04 0.00 0.00 32.46 28.17 1lum n ARG 104 CO 0.00 0.00 0.00 1.28 -3.04 0.00 0.00 177.63 175.87 1lum n LEU 105 N -4.06 -5.48 0.02 2.89 7.99 -1.25 -3.33 117.00 113.79 1lum n LEU 105 Ca -0.15 0.01 -0.15 0.00 -0.01 0.00 0.00 56.01 55.70 1lum n LEU 105 Cb 0.48 -2.69 -0.04 0.00 -0.11 0.00 0.00 43.42 41.06 1lum n LEU 105 CO 0.62 -1.11 0.25 0.08 -1.51 0.00 0.00 177.39 175.72 1lum h ARG 106 N 1.34 0.60 -0.85 3.23 -0.00 -1.07 -3.36 114.38 114.27 1lum h ARG 106 Ca -0.23 -0.54 0.02 0.00 -0.00 0.00 0.00 59.98 59.23 1lum h ARG 106 Cb 1.16 0.13 -0.20 0.00 -0.00 0.00 0.00 29.97 31.06 1lum h ARG 106 CO 0.25 1.16 -0.34 -0.47 -0.00 0.00 0.00 179.97 180.57 1lum s TYR 107 N -3.56 -1.53 -0.37 4.08 5.04 -1.22 -4.92 117.35 114.87 1lum s TYR 107 Ca -0.08 0.59 -0.36 0.00 -2.44 0.00 0.00 57.07 54.78 1lum s TYR 107 Cb 0.09 0.27 -0.12 0.00 0.35 0.00 0.00 41.96 42.55 1lum s TYR 107 CO 0.88 -0.96 2.20 -0.35 -1.34 0.00 0.00 175.55 175.98 1lum n PRO 108 N 4.85 0.95 -3.35 4.97 -0.04 -1.14 0.20 135.00 141.44 1lum n PRO 108 Ca 0.08 0.25 -0.39 0.00 -0.04 0.00 0.00 63.50 63.40 1lum n PRO 108 Cb 0.56 -2.37 -0.08 0.00 -0.04 0.00 0.00 33.50 31.58 1lum n PRO 108 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1lum s VAL 109 N 7.29 5.17 -0.52 0.52 1.01 8.29 -2.96 120.40 139.20 1lum s VAL 109 Ca 1.11 0.72 0.03 0.00 0.00 0.00 0.00 61.98 63.85 1lum s VAL 109 Cb -0.92 -3.75 0.14 0.00 0.00 0.00 0.00 36.38 31.86 1lum s VAL 109 CO 0.50 0.20 0.30 0.00 0.00 0.00 0.00 175.10 176.11