#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 -1.15 0.00 0.53 2.85 -1.26 -5.01 115.26 111.22 1lum n ASN 5 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1lum n ASN 5 Cb 0.00 0.74 0.00 0.00 1.24 0.00 0.00 39.78 41.76 1lum n ASN 5 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1lum n LEU 6 N -0.54 0.42 -2.02 1.20 -0.00 -1.26 -4.88 117.00 109.92 1lum n LEU 6 Ca 0.00 -0.42 -0.00 0.00 -0.00 0.00 0.00 56.01 55.59 1lum n LEU 6 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1lum n LEU 6 CO 0.00 0.10 0.15 -1.84 -0.00 0.00 0.00 177.39 175.81 1lum n GLU 7 N -0.09 0.10 0.00 1.47 0.28 -1.26 -0.96 120.64 120.19 1lum n GLU 7 Ca 0.00 -0.01 0.00 0.00 -0.16 0.00 0.00 57.16 56.99 1lum n GLU 7 Cb 0.37 -1.47 0.00 0.00 1.43 0.00 0.00 31.44 31.77 1lum n GLU 7 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1lum n THR 8 N 2.08 0.00 -3.09 3.84 5.66 -1.26 -4.98 114.28 116.54 1lum n THR 8 Ca 0.00 0.00 -0.39 0.00 -3.05 0.00 0.00 64.05 60.61 1lum n THR 8 Cb 0.05 0.53 -0.05 0.00 -1.55 0.00 0.00 70.33 69.30 1lum n THR 8 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1lum s TYR 9 N 0.00 3.75 0.27 1.09 2.02 -0.13 -4.89 117.35 119.46 1lum s TYR 9 Ca 0.00 1.38 0.08 0.00 -0.37 0.00 0.00 57.07 58.16 1lum s TYR 9 Cb 0.00 -2.71 0.41 0.00 -0.40 0.00 0.00 41.96 39.26 1lum s TYR 9 CO 0.00 0.36 1.09 1.49 -1.57 0.00 0.00 175.55 176.92 1lum h GLU 10 N 5.36 0.00 0.00 -0.62 4.81 -1.88 0.43 114.58 122.68 1lum h GLU 10 Ca -0.45 0.00 -0.31 0.00 -0.13 0.00 0.00 59.36 58.47 1lum h GLU 10 Cb 1.20 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.53 1lum h GLU 10 CO 0.69 0.00 -2.16 -2.67 -0.73 0.00 0.00 179.01 174.14 1lum n TRP 11 N -2.04 0.00 -2.24 0.92 4.27 -1.21 -0.18 117.44 116.96 1lum n TRP 11 Ca -0.01 0.00 -0.38 0.00 -3.89 0.00 0.00 57.50 53.22 1lum n TRP 11 Cb 0.58 -0.80 -0.01 0.00 -1.36 0.00 0.00 31.31 29.72 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 -2.41 2.98 -0.32 -2.67 5.04 0.15 0.43 117.35 120.56 1lum s TYR 12 Ca -0.20 1.52 0.01 0.00 -2.44 0.00 0.00 57.07 55.96 1lum s TYR 12 Cb 0.06 -3.45 0.14 0.00 0.35 0.00 0.00 41.96 39.07 1lum s TYR 12 CO 0.55 -1.51 0.32 -0.80 -1.34 0.00 0.00 175.55 172.77 1lum s ASN 13 N -1.10 1.55 0.00 4.32 0.01 1.63 -4.58 114.94 116.76 1lum s ASN 13 Ca 0.58 -1.07 0.00 0.00 -0.71 0.00 0.00 52.86 51.66 1lum s ASN 13 Cb -0.32 0.50 0.00 0.00 0.41 0.00 0.00 41.25 41.84 1lum s ASN 13 CO 0.40 -0.34 0.00 2.29 -1.51 0.00 0.00 177.10 177.93 1lum n LYS 14 N 4.92 0.14 0.00 -0.60 0.00 -1.26 -2.32 118.16 119.04 1lum n LYS 14 Ca 0.03 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.34 1lum n LYS 14 Cb 0.46 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.49 1lum n LYS 14 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.40 176.27 1lum n SER 15 N 0.00 0.00 -4.72 -5.58 3.41 -1.26 -3.04 113.62 102.43 1lum n SER 15 Ca 0.00 -1.24 -0.30 0.00 -0.26 0.00 0.00 58.87 57.07 1lum n SER 15 Cb 0.00 0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.09 1lum n SER 15 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1lum s ILE 16 N 2.49 2.67 0.10 -1.33 1.01 -0.98 -5.04 121.20 120.11 1lum s ILE 16 Ca 0.00 0.22 0.08 0.00 0.00 0.00 0.00 60.65 60.95 1lum s ILE 16 Cb 0.00 -2.71 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 1lum s ILE 16 CO 0.00 -0.28 -0.20 -0.55 0.00 0.00 0.00 174.94 173.90 1lum s SER 17 N -3.43 2.46 0.55 3.58 0.15 -1.26 -4.87 113.70 110.87 1lum s SER 17 Ca 0.63 -0.67 0.33 0.00 0.70 0.00 0.00 55.95 56.94 1lum s SER 17 Cb -0.18 -0.13 1.49 0.00 -1.71 0.00 0.00 66.02 65.49 1lum s SER 17 CO 0.57 0.05 1.84 0.08 1.20 0.00 0.00 173.24 176.98 1lum h ARG 18 N 4.14 0.00 -0.06 5.44 -0.00 -2.00 -0.13 114.38 121.78 1lum h ARG 18 Ca -0.45 0.00 -0.09 0.00 -0.00 0.00 0.00 59.98 59.44 1lum h ARG 18 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.15 1lum h ARG 18 CO 0.40 0.00 -0.31 0.22 -0.00 0.00 0.00 179.97 180.28 1lum h ASP 19 N 0.00 0.37 0.09 0.08 1.82 -2.00 -3.13 116.42 113.66 1lum h ASP 19 Ca 0.45 -0.66 -0.00 0.00 -0.39 0.00 0.00 57.03 56.42 1lum h ASP 19 Cb 1.89 -0.11 0.00 0.00 0.68 0.00 0.00 39.33 41.79 1lum h ASP 19 CO -0.00 0.97 -0.04 0.11 -1.61 0.00 0.00 179.24 178.66 1lum h LYS 20 N -0.21 -0.12 -0.35 0.28 6.56 -1.46 -1.63 116.57 119.65 1lum h LYS 20 Ca -0.02 0.01 0.08 0.00 -1.06 0.00 0.00 60.65 59.65 1lum h LYS 20 Cb 0.97 0.03 -0.08 0.00 -0.57 0.00 0.00 32.23 32.57 1lum h LYS 20 CO 0.06 0.23 -0.25 0.00 -2.06 0.00 0.00 179.45 177.42 1lum h ALA 21 N 0.38 -0.07 -0.77 3.86 0.00 -1.47 1.38 119.26 122.58 1lum h ALA 21 Ca -0.01 0.11 0.08 0.00 0.00 0.00 0.00 54.91 55.09 1lum h ALA 21 Cb 0.40 0.56 -0.07 0.00 0.00 0.00 0.00 17.79 18.68 1lum h ALA 21 CO 0.02 -0.65 0.43 0.93 0.00 0.00 0.00 179.25 179.98 1lum h GLU 22 N -0.21 0.73 -0.00 0.00 5.08 -1.57 1.39 114.58 119.99 1lum h GLU 22 Ca 0.17 -0.04 0.01 0.00 -1.00 0.00 0.00 59.36 58.50 1lum h GLU 22 Cb 0.48 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1lum h GLU 22 CO -0.47 0.48 -0.07 1.57 -1.00 0.00 0.00 179.01 179.53 1lum h LYS 23 N 0.75 -0.11 -0.80 2.33 2.10 0.54 1.18 116.57 122.57 1lum h LYS 23 Ca 0.36 0.01 -0.02 0.00 -2.00 0.00 0.00 60.65 59.00 1lum h LYS 23 Cb 0.29 0.03 -0.04 0.00 -0.90 0.00 0.00 32.23 31.61 1lum h LYS 23 CO -0.22 -0.07 0.43 1.37 -2.00 0.00 0.00 179.45 178.95 1lum h LEU 24 N -0.12 1.01 0.10 7.07 8.10 0.30 -2.05 115.31 129.73 1lum h LEU 24 Ca 0.03 -0.11 -0.01 0.00 0.11 0.00 0.00 57.88 57.91 1lum h LEU 24 Cb 0.15 -0.26 0.00 0.00 -0.44 0.00 0.00 40.66 40.11 1lum h LEU 24 CO -0.07 0.82 -0.05 -0.07 -4.11 0.00 0.00 178.44 174.96 1lum h LEU 25 N 1.11 -0.12 -1.92 0.17 3.38 0.26 0.18 115.31 118.38 1lum h LEU 25 Ca 0.28 -0.04 0.23 0.00 0.09 0.00 0.00 57.88 58.44 1lum h LEU 25 Cb 0.05 0.03 -0.04 0.00 0.09 0.00 0.00 40.66 40.79 1lum h LEU 25 CO -0.04 -0.04 0.59 -0.07 0.09 0.00 0.00 178.44 178.97 1lum h LEU 26 N -0.18 0.07 0.04 1.67 -0.00 0.18 0.55 115.31 117.63 1lum h LEU 26 Ca -0.01 0.01 -0.08 0.00 -0.00 0.00 0.00 57.88 57.79 1lum h LEU 26 Cb 0.15 -0.00 0.01 0.00 -0.00 0.00 0.00 40.66 40.81 1lum h LEU 26 CO 0.02 0.03 -0.34 -0.78 -0.00 0.00 0.00 178.44 177.37 1lum h ASP 27 N 0.06 0.23 0.38 -0.43 1.82 -0.62 -3.35 116.42 114.51 1lum h ASP 27 Ca 0.40 -0.89 -0.02 0.00 -0.39 0.00 0.00 57.03 56.14 1lum h ASP 27 Cb 1.50 -0.07 0.00 0.00 0.68 0.00 0.00 39.33 41.44 1lum h ASP 27 CO -0.03 1.10 -0.18 0.00 -1.61 0.00 0.00 179.24 178.52 1lum h THR 28 N -0.60 0.63 -5.35 2.25 1.03 0.57 -3.48 112.91 107.96 1lum h THR 28 Ca -0.05 -0.33 -0.11 0.00 -0.01 0.00 0.00 66.41 65.91 1lum h THR 28 Cb 1.18 0.79 0.09 0.00 -1.07 0.00 0.00 68.15 69.14 1lum h THR 28 CO 0.06 0.06 -0.37 0.61 -0.01 0.00 0.00 175.52 175.88 1lum n GLY 29 N -0.78 -1.18 2.90 2.99 0.00 0.18 -5.04 105.19 104.27 1lum n GLY 29 Ca -0.10 0.51 -0.27 0.00 0.00 0.00 0.00 46.02 46.15 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 -3.59 1.52 -0.48 1.61 3.01 -1.26 -5.03 119.74 115.52 1lum s LYS 30 Ca 0.20 -0.35 -0.36 0.00 -1.01 0.00 0.00 55.97 54.45 1lum s LYS 30 Cb -0.03 -1.74 -0.16 0.00 -1.01 0.00 0.00 37.83 34.89 1lum s LYS 30 CO 0.73 -0.32 1.87 -1.91 0.51 0.00 0.00 175.35 176.23 1lum n GLU 31 N 4.92 0.00 -0.72 1.68 2.13 -1.26 0.27 120.64 127.65 1lum n GLU 31 Ca -0.12 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.70 1lum n GLU 31 Cb 0.49 -1.27 0.00 0.00 0.27 0.00 0.00 31.44 30.93 1lum n GLU 31 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1lum n GLY 32 N 6.23 0.87 3.61 8.31 0.00 0.21 -4.57 105.19 119.85 1lum n GLY 32 Ca 0.48 -0.53 -0.56 0.00 0.00 0.00 0.00 46.02 45.41 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 -0.67 0.13 -2.90 4.61 0.00 1.35 -2.60 120.51 120.42 1lum n ALA 33 Ca 0.00 0.27 -0.34 0.00 0.00 0.00 0.00 53.44 53.37 1lum n ALA 33 Cb 0.10 -2.28 -0.11 0.00 0.00 0.00 0.00 19.45 17.16 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 4.62 3.10 0.08 0.00 5.36 0.78 0.42 117.98 132.34 1lum s PHE 34 Ca 1.03 -0.16 0.01 0.00 -0.96 0.00 0.00 56.93 56.85 1lum s PHE 34 Cb -1.07 -1.98 -0.04 0.00 -0.34 0.00 0.00 43.02 39.59 1lum s PHE 34 CO 0.62 0.05 -0.06 1.41 -1.46 0.00 0.00 175.22 175.78 1lum s MET 35 N 0.29 0.72 0.04 10.12 -2.45 1.23 0.57 119.30 129.82 1lum s MET 35 Ca -0.01 -1.16 0.02 0.00 -1.25 0.00 0.00 55.69 53.29 1lum s MET 35 Cb -0.13 -0.16 -0.02 0.00 1.25 0.00 0.00 34.83 35.77 1lum s MET 35 CO 0.02 -0.02 -0.08 0.08 1.05 0.00 0.00 175.02 176.08 1lum s VAL 36 N -3.08 0.55 -0.14 10.11 1.01 1.50 0.54 120.40 130.89 1lum s VAL 36 Ca 0.05 -1.02 -0.10 0.00 0.00 0.00 0.00 61.98 60.90 1lum s VAL 36 Cb 0.02 -0.61 0.04 0.00 0.00 0.00 0.00 36.38 35.83 1lum s VAL 36 CO -0.04 -0.34 0.36 0.00 0.00 0.00 0.00 175.10 175.07 1lum s ARG 37 N -1.48 0.38 0.55 2.72 1.70 2.03 0.46 118.95 125.31 1lum s ARG 37 Ca -0.09 0.59 -0.20 0.00 -0.47 0.00 0.00 55.73 55.56 1lum s ARG 37 Cb -0.09 0.09 -0.07 0.00 -0.57 0.00 0.00 34.95 34.30 1lum s ARG 37 CO 0.00 -0.10 0.85 -3.47 -1.08 0.00 0.00 175.30 171.51 1lum n ASP 38 N 3.50 0.38 -1.92 -2.89 -0.08 -1.17 0.49 116.55 114.86 1lum n ASP 38 Ca -0.18 0.84 0.00 0.00 -1.51 0.00 0.00 54.79 53.94 1lum n ASP 38 Cb 0.56 -1.32 0.00 0.00 2.34 0.00 0.00 41.12 42.70 1lum n ASP 38 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1lum n SER 39 N -0.14 1.16 -0.02 1.67 2.88 -0.20 -4.57 113.62 114.40 1lum n SER 39 Ca 0.12 -0.96 -0.03 0.00 -1.33 0.00 0.00 58.87 56.67 1lum n SER 39 Cb 0.45 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.89 1lum n SER 39 CO 0.00 0.00 0.00 -1.14 -1.23 0.00 0.00 175.04 172.67 1lum n ARG 40 N -0.40 1.16 0.00 -1.46 3.00 -1.26 -4.81 116.66 112.89 1lum n ARG 40 Ca 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 57.85 57.87 1lum n ARG 40 Cb 0.00 -1.09 0.00 0.00 0.00 0.00 0.00 32.46 31.37 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 -2.48 0.00 0.00 5.15 5.66 -1.26 -4.12 114.28 117.23 1lum n THR 41 Ca -0.08 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.92 1lum n THR 41 Cb 0.60 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.38 1lum n THR 41 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1lum n PRO 42 N 0.00 0.00 0.00 1.09 -0.02 -1.26 -4.28 135.00 130.53 1lum n PRO 42 Ca 0.00 0.01 0.00 0.00 -2.02 0.00 0.00 63.50 61.49 1lum n PRO 42 Cb 0.00 -1.65 0.00 0.00 -0.02 0.00 0.00 33.50 31.83 1lum n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lum n GLY 43 N -0.70 1.52 3.40 -1.23 0.00 -1.26 -5.03 105.19 101.89 1lum n GLY 43 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -4.12 2.61 5.66 -1.26 -4.64 114.28 111.80 1lum n THR 44 Ca 0.00 -0.21 -0.28 0.00 -3.05 0.00 0.00 64.05 60.50 1lum n THR 44 Cb 0.00 -0.66 -0.07 0.00 -1.55 0.00 0.00 70.33 68.05 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 -2.37 3.02 -0.11 1.09 1.51 -1.06 -1.03 117.35 118.40 1lum s TYR 45 Ca 0.58 -0.04 -0.05 0.00 -1.01 0.00 0.00 57.07 56.55 1lum s TYR 45 Cb -0.19 -1.50 -0.04 0.00 -0.11 0.00 0.00 41.96 40.12 1lum s TYR 45 CO 0.66 0.51 0.07 0.99 -1.11 0.00 0.00 175.55 176.67 1lum s THR 46 N -1.56 4.88 -0.22 -0.71 2.01 1.81 0.51 115.64 122.36 1lum s THR 46 Ca 0.28 -0.03 0.01 0.00 0.31 0.00 0.00 61.69 62.27 1lum s THR 46 Cb -0.11 -3.10 0.05 0.00 0.01 0.00 0.00 72.50 69.35 1lum s THR 46 CO 0.20 0.60 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.95 1lum s VAL 47 N -0.86 1.72 -0.40 3.82 1.01 1.80 0.53 120.40 128.01 1lum s VAL 47 Ca 0.13 -1.18 -0.21 0.00 0.00 0.00 0.00 61.98 60.73 1lum s VAL 47 Cb -0.12 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.43 1lum s VAL 47 CO 0.03 0.07 0.64 -0.55 0.00 0.00 0.00 175.10 175.29 1lum s SER 48 N 1.34 6.37 -0.29 3.32 0.15 2.15 0.50 113.70 127.24 1lum s SER 48 Ca -0.04 -0.09 -0.06 0.00 0.70 0.00 0.00 55.95 56.46 1lum s SER 48 Cb -0.18 -2.32 0.01 0.00 -1.71 0.00 0.00 66.02 61.82 1lum s SER 48 CO -0.07 -0.69 0.07 0.68 1.20 0.00 0.00 173.24 174.43 1lum s VAL 49 N 2.77 3.86 -0.23 4.45 -7.23 0.64 0.38 120.40 125.04 1lum s VAL 49 Ca 0.24 -0.75 -0.08 0.00 -1.81 0.00 0.00 61.98 59.57 1lum s VAL 49 Cb -0.14 -3.01 -0.04 0.00 0.56 0.00 0.00 36.38 33.75 1lum s VAL 49 CO 0.17 0.07 0.10 0.12 -0.31 0.00 0.00 175.10 175.25 1lum s PHE 50 N 1.48 3.18 -0.03 2.82 2.19 1.41 0.26 117.98 129.28 1lum s PHE 50 Ca 0.02 -0.10 0.07 0.00 0.33 0.00 0.00 56.93 57.25 1lum s PHE 50 Cb -0.17 -2.22 -0.02 0.00 -1.31 0.00 0.00 43.02 39.30 1lum s PHE 50 CO 0.02 -0.12 -0.26 0.99 1.83 0.00 0.00 175.22 177.68 1lum s THR 51 N 1.20 2.05 0.93 0.12 2.01 1.11 0.41 115.64 123.46 1lum s THR 51 Ca 0.05 -1.09 -0.11 0.00 0.31 0.00 0.00 61.69 60.85 1lum s THR 51 Cb -0.14 -1.71 0.15 0.00 0.01 0.00 0.00 72.50 70.80 1lum s THR 51 CO 0.04 0.58 1.09 -0.54 -0.69 0.00 0.00 174.62 175.10 1lum s LYS 52 N -0.43 0.98 0.00 4.92 3.01 -1.26 0.18 119.74 127.13 1lum s LYS 52 Ca 0.05 1.01 0.00 0.00 -1.01 0.00 0.00 55.97 56.02 1lum s LYS 52 Cb -0.11 -1.76 0.00 0.00 -1.01 0.00 0.00 37.83 34.94 1lum s LYS 52 CO 0.01 -2.49 0.00 0.00 0.51 0.00 0.00 175.35 173.38 1lum n ALA 53 N -4.08 0.00 0.00 5.17 0.00 -1.26 -4.38 120.51 115.95 1lum n ALA 53 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.52 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 -0.89 0.00 0.00 0.00 177.50 176.61 1lum n ILE 54 N 0.00 0.00 0.00 0.00 2.08 -1.26 -1.18 119.36 119.00 1lum n ILE 54 Ca 0.00 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.31 1lum n ILE 54 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 39.64 38.89 1lum n ILE 54 CO 0.00 0.00 0.00 2.30 0.56 0.00 0.00 176.55 179.41 1lum n ILE 55 N 0.00 0.00 0.18 1.39 -0.00 -1.26 -4.99 119.36 114.68 1lum n ILE 55 Ca 0.00 0.00 -0.14 0.00 -0.00 0.00 0.00 62.75 62.61 1lum n ILE 55 Cb 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 39.64 39.56 1lum n ILE 55 CO 0.00 0.00 0.00 0.28 -0.00 0.00 0.00 176.55 176.83 1lum h SER 56 N 0.00 -0.39 0.00 7.28 0.02 -2.05 -3.46 113.55 114.95 1lum h SER 56 Ca 0.00 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.80 1lum h SER 56 Cb 0.00 0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.64 1lum h SER 56 CO 0.00 -0.04 0.00 -1.84 -1.14 0.00 0.00 176.83 173.81 1lum n GLU 57 N -5.16 0.00 0.03 3.45 0.28 -1.26 -5.02 120.64 112.95 1lum n GLU 57 Ca -0.10 0.00 0.11 0.00 -0.16 0.00 0.00 57.16 57.02 1lum n GLU 57 Cb 0.27 0.00 0.06 0.00 1.43 0.00 0.00 31.44 33.20 1lum n GLU 57 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1lum n ASN 58 N 0.00 0.63 -3.92 -1.84 4.13 -0.91 -4.97 115.26 108.38 1lum n ASN 58 Ca 0.00 -0.16 -0.25 0.00 1.68 0.00 0.00 54.58 55.84 1lum n ASN 58 Cb 0.00 0.64 0.09 0.00 -1.54 0.00 0.00 39.78 38.98 1lum n ASN 58 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1lum n PRO 59 N -1.95 -1.04 -4.31 3.52 -0.02 -0.32 -4.61 135.00 126.27 1lum n PRO 59 Ca 0.02 -0.30 -0.18 0.00 -2.02 0.00 0.00 63.50 61.02 1lum n PRO 59 Cb 0.43 -1.31 -0.14 0.00 -0.02 0.00 0.00 33.50 32.46 1lum n PRO 59 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1lum s ILE 61 N -0.48 1.84 -0.23 0.00 1.09 -1.23 0.36 121.20 122.54 1lum s ILE 61 Ca 0.01 -1.65 -0.09 0.00 -1.10 0.00 0.00 60.65 57.82 1lum s ILE 61 Cb -0.05 -2.15 -0.05 0.00 -1.06 0.00 0.00 42.46 39.15 1lum s ILE 61 CO 0.00 -0.27 0.13 -0.54 -0.10 0.00 0.00 174.94 174.16 1lum s LYS 62 N 1.20 4.02 -0.53 2.79 1.02 0.73 -4.78 119.74 124.19 1lum s LYS 62 Ca -0.01 -0.30 -0.19 0.00 0.02 0.00 0.00 55.97 55.49 1lum s LYS 62 Cb -0.19 -3.44 0.07 0.00 -0.52 0.00 0.00 37.83 33.76 1lum s LYS 62 CO -0.08 0.10 0.62 -1.01 -0.92 0.00 0.00 175.35 174.05 1lum s HIS 63 N 0.91 3.06 -0.24 3.18 3.76 -1.23 0.23 115.29 124.97 1lum s HIS 63 Ca 0.06 -0.72 -0.18 0.00 -0.15 0.00 0.00 55.06 54.07 1lum s HIS 63 Cb -0.13 -3.63 -0.03 0.00 1.11 0.00 0.00 32.58 29.90 1lum s HIS 63 CO 0.03 -1.08 0.50 0.71 -0.85 0.00 0.00 174.74 174.06 1lum s TYR 64 N 2.50 3.30 -0.64 1.40 2.02 1.87 -4.70 117.35 123.10 1lum s TYR 64 Ca 0.12 0.66 -0.23 0.00 -0.37 0.00 0.00 57.07 57.26 1lum s TYR 64 Cb -0.21 -2.69 0.07 0.00 -0.40 0.00 0.00 41.96 38.73 1lum s TYR 64 CO 0.09 -0.21 0.94 -1.01 -1.57 0.00 0.00 175.55 173.80 1lum s HIS 65 N 2.05 2.71 -0.60 2.71 3.76 -1.25 0.49 115.29 125.15 1lum s HIS 65 Ca 0.22 -0.49 -0.32 0.00 -0.15 0.00 0.00 55.06 54.31 1lum s HIS 65 Cb -0.15 -4.23 -0.14 0.00 1.11 0.00 0.00 32.58 29.16 1lum s HIS 65 CO 0.09 -1.58 2.40 -0.89 -0.85 0.00 0.00 174.74 173.91 1lum n ILE 66 N 5.94 0.04 -1.94 0.60 2.08 1.93 -4.67 119.36 123.34 1lum n ILE 66 Ca -0.03 -0.29 -0.41 0.00 0.56 0.00 0.00 62.75 62.58 1lum n ILE 66 Cb 0.46 -1.46 -0.01 0.00 -0.75 0.00 0.00 39.64 37.87 1lum n ILE 66 CO 0.00 0.00 0.00 -0.75 0.56 0.00 0.00 176.55 176.36 1lum s LYS 67 N 7.57 4.18 -0.07 0.38 2.47 1.67 -2.57 119.74 133.37 1lum s LYS 67 Ca 1.16 2.40 0.03 0.00 -1.56 0.00 0.00 55.97 58.00 1lum s LYS 67 Cb -0.88 -2.98 -0.02 0.00 -1.46 0.00 0.00 37.83 32.49 1lum s LYS 67 CO 0.45 -0.41 -0.15 -1.21 0.16 0.00 0.00 175.35 174.20 1lum s GLU 68 N -2.00 2.77 0.09 4.03 2.02 -1.02 0.26 118.70 124.84 1lum s GLU 68 Ca 0.52 -0.71 0.03 0.00 0.02 0.00 0.00 54.97 54.83 1lum s GLU 68 Cb -0.43 -2.44 -0.03 0.00 0.10 0.00 0.00 34.13 31.32 1lum s GLU 68 CO 0.58 0.48 -0.09 0.95 0.02 0.00 0.00 175.26 177.20 1lum s THR 69 N -0.36 0.84 -0.04 3.63 -4.23 1.67 -4.89 115.64 112.26 1lum s THR 69 Ca 0.04 -1.56 -0.00 0.00 -1.18 0.00 0.00 61.69 58.98 1lum s THR 69 Cb -0.12 -1.26 -0.01 0.00 1.34 0.00 0.00 72.50 72.45 1lum s THR 69 CO 0.02 -0.55 0.87 -0.46 -0.54 0.00 0.00 174.62 173.96 1lum n ASN 70 N 0.67 0.36 0.00 3.99 0.23 -1.26 -3.85 115.26 115.41 1lum n ASN 70 Ca -0.17 -1.78 0.00 0.00 -0.53 0.00 0.00 54.58 52.10 1lum n ASN 70 Cb 0.57 -0.30 0.00 0.00 -2.08 0.00 0.00 39.78 37.97 1lum n ASN 70 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 1lum n ASP 71 N 3.89 0.00 -0.70 0.53 5.68 -1.04 -4.86 116.55 120.06 1lum n ASP 71 Ca 0.03 0.00 0.05 0.00 -0.50 0.00 0.00 54.79 54.37 1lum n ASP 71 Cb 0.03 0.00 0.10 0.00 -1.14 0.00 0.00 41.12 40.12 1lum n ASP 71 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 1lum n SER 72 N 0.35 1.34 -1.12 -1.12 7.64 -1.26 -4.59 113.62 114.86 1lum n SER 72 Ca 0.00 -2.85 0.00 0.00 1.01 0.00 0.00 58.87 57.03 1lum n SER 72 Cb 0.00 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 62.82 1lum n SER 72 CO 0.00 0.00 0.00 -0.81 -3.01 0.00 0.00 175.04 171.22 1lum n PRO 73 N -0.55 3.54 -0.85 1.43 -0.04 -1.26 -5.18 135.00 132.08 1lum n PRO 73 Ca 0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.57 1lum n PRO 73 Cb 0.80 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.26 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 0.00 -1.33 -0.08 0.54 4.01 -1.26 -4.92 118.16 115.12 1lum n LYS 74 Ca 0.00 1.30 -0.17 0.00 -0.51 0.00 0.00 58.31 58.93 1lum n LYS 74 Cb 0.00 -1.01 -0.06 0.00 -0.51 0.00 0.00 35.03 33.45 1lum n LYS 74 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1lum n ARG 75 N 0.42 0.36 -3.77 1.97 1.74 1.72 -2.50 116.66 116.60 1lum n ARG 75 Ca 0.00 0.16 -0.34 0.00 -0.77 0.00 0.00 57.85 56.89 1lum n ARG 75 Cb 0.00 -1.10 -0.05 0.00 -1.02 0.00 0.00 32.46 30.29 1lum n ARG 75 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1lum s TYR 76 N -2.33 3.57 -0.18 -1.55 2.02 1.77 0.47 117.35 121.11 1lum s TYR 76 Ca -0.23 0.55 -0.29 0.00 -0.37 0.00 0.00 57.07 56.73 1lum s TYR 76 Cb 0.09 -1.97 0.12 0.00 -0.40 0.00 0.00 41.96 39.80 1lum s TYR 76 CO 0.30 0.61 0.99 1.52 -1.57 0.00 0.00 175.55 177.40 1lum s TYR 77 N -1.31 -0.41 -0.44 2.71 1.13 0.73 0.30 117.35 120.06 1lum s TYR 77 Ca 0.28 0.79 0.09 0.00 -1.41 0.00 0.00 57.07 56.81 1lum s TYR 77 Cb -0.13 0.43 0.40 0.00 -1.10 0.00 0.00 41.96 41.55 1lum s TYR 77 CO 0.16 -0.33 0.99 1.33 -2.51 0.00 0.00 175.55 175.19 1lum n VAL 78 N 1.11 1.93 0.00 -3.49 0.24 -1.26 0.47 118.33 117.32 1lum n VAL 78 Ca -0.11 -4.66 0.00 0.00 -2.04 0.00 0.00 64.34 57.53 1lum n VAL 78 Cb 0.57 -0.76 0.00 0.00 -1.47 0.00 0.00 33.84 32.18 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 -0.23 0.00 -1.97 2.33 0.00 -1.26 -4.83 120.51 114.55 1lum n ALA 79 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1lum n ALA 79 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 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 -2.45 -4.43 0.00 1.02 -1.26 -4.75 120.64 108.78 1lum n GLU 80 Ca 0.00 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.93 1lum n GLU 80 Cb 0.00 -3.37 -0.10 0.00 -0.02 0.00 0.00 31.44 27.94 1lum n GLU 80 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1lum s LYS 81 N -3.69 1.62 0.00 3.49 2.36 -1.26 -4.98 119.74 117.28 1lum s LYS 81 Ca 0.00 -1.91 0.00 0.00 -2.55 0.00 0.00 55.97 51.51 1lum s LYS 81 Cb 0.00 -0.71 0.00 0.00 -1.05 0.00 0.00 37.83 36.07 1lum s LYS 81 CO 0.00 -0.24 0.00 0.66 1.55 0.00 0.00 175.35 177.32 1lum n TYR 82 N -0.66 0.00 -3.56 4.03 4.01 -1.26 -4.42 117.16 115.30 1lum n TYR 82 Ca -0.02 0.00 -0.35 0.00 -0.16 0.00 0.00 57.90 57.37 1lum n TYR 82 Cb 0.66 0.00 -0.05 0.00 -0.31 0.00 0.00 39.34 39.64 1lum n TYR 82 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1lum s VAL 83 N 0.00 5.08 0.27 -0.72 1.01 -1.26 -4.50 120.40 120.28 1lum s VAL 83 Ca 0.00 0.47 0.04 0.00 0.00 0.00 0.00 61.98 62.49 1lum s VAL 83 Cb 0.00 -3.65 -0.03 0.00 0.00 0.00 0.00 36.38 32.69 1lum s VAL 83 CO 0.00 0.28 0.21 -0.36 0.00 0.00 0.00 175.10 175.24 1lum s PHE 84 N -1.40 1.50 -0.34 5.22 0.40 0.86 -4.66 117.98 119.56 1lum s PHE 84 Ca 0.33 -1.54 0.08 0.00 -0.60 0.00 0.00 56.93 55.21 1lum s PHE 84 Cb -0.14 -0.65 0.65 0.00 0.51 0.00 0.00 43.02 43.39 1lum s PHE 84 CO 0.18 -0.76 1.74 -0.40 0.70 0.00 0.00 175.22 176.68 1lum n ASP 85 N -0.99 3.92 0.00 1.36 5.75 -1.26 0.48 116.55 125.81 1lum n ASP 85 Ca 0.05 -3.45 0.00 0.00 -0.01 0.00 0.00 54.79 51.38 1lum n ASP 85 Cb 0.64 -0.73 0.00 0.00 -1.03 0.00 0.00 41.12 39.99 1lum n ASP 85 CO 0.00 0.00 0.00 -0.24 -0.11 0.00 0.00 177.20 176.85 1lum n SER 86 N -0.71 0.00 -0.21 -1.12 2.88 -1.26 -4.88 113.62 108.33 1lum n SER 86 Ca 0.44 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.98 1lum n SER 86 Cb 1.36 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 64.94 1lum n SER 86 CO 0.00 0.00 0.00 0.40 -1.23 0.00 0.00 175.04 174.21 1lum h ILE 87 N 0.11 0.79 -0.44 2.46 1.08 -1.95 0.92 117.51 120.49 1lum h ILE 87 Ca 0.00 -0.15 0.08 0.00 -0.39 0.00 0.00 64.86 64.40 1lum h ILE 87 Cb 0.00 0.30 -0.07 0.00 -3.07 0.00 0.00 36.82 33.98 1lum h ILE 87 CO 0.00 0.08 -0.01 1.55 -0.69 0.00 0.00 178.15 179.08 1lum h PRO 88 N 0.44 0.10 0.17 2.37 0.13 -1.95 10.45 132.00 143.71 1lum h PRO 88 Ca 0.31 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.43 1lum h PRO 88 Cb 0.37 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.48 1lum h PRO 88 CO -0.30 0.06 -0.08 1.37 -0.23 0.00 0.00 178.00 178.83 1lum h LEU 89 N 0.10 -0.19 -1.57 1.56 -0.00 -1.78 5.66 115.31 119.09 1lum h LEU 89 Ca 0.22 -0.27 0.15 0.00 -0.00 0.00 0.00 57.88 57.97 1lum h LEU 89 Cb 0.32 0.05 -0.05 0.00 -0.00 0.00 0.00 40.66 40.98 1lum h LEU 89 CO -0.37 0.19 0.50 0.25 -0.00 0.00 0.00 178.44 179.02 1lum h LEU 90 N -0.61 0.40 0.02 0.17 7.12 0.17 0.87 115.31 123.46 1lum h LEU 90 Ca -0.02 0.02 -0.05 0.00 0.13 0.00 0.00 57.88 57.96 1lum h LEU 90 Cb 0.45 -0.06 0.00 0.00 -0.53 0.00 0.00 40.66 40.53 1lum h LEU 90 CO 0.04 0.21 -0.25 0.40 -0.13 0.00 0.00 178.44 178.71 1lum h ILE 91 N 0.43 1.68 -0.79 4.05 1.08 2.34 -3.22 117.51 123.08 1lum h ILE 91 Ca 0.37 -2.37 0.14 0.00 -0.39 0.00 0.00 64.86 62.61 1lum h ILE 91 Cb 0.84 3.27 -0.09 0.00 -3.07 0.00 0.00 36.82 37.77 1lum h ILE 91 CO -0.12 0.61 0.35 1.56 -0.69 0.00 0.00 178.15 179.86 1lum h GLN 92 N -0.89 0.50 -0.40 2.37 1.08 1.29 0.18 115.11 119.24 1lum h GLN 92 Ca -0.05 -0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.10 1lum h GLN 92 Cb 1.14 -0.11 -0.02 0.00 -0.05 0.00 0.00 27.48 28.44 1lum h GLN 92 CO 0.01 0.33 0.20 0.10 -0.95 0.00 0.00 178.83 178.52 1lum h TYR 93 N 0.51 0.58 -0.23 2.96 -0.00 0.59 -2.87 116.97 118.51 1lum h TYR 93 Ca 0.43 -0.03 -0.01 0.00 -0.00 0.00 0.00 58.73 59.12 1lum h TYR 93 Cb 0.63 -0.18 -0.01 0.00 -0.00 0.00 0.00 36.73 37.17 1lum h TYR 93 CO -0.13 0.47 0.10 0.45 -0.00 0.00 0.00 178.16 179.04 1lum h HIS 94 N 0.51 0.35 0.00 0.10 3.86 -1.21 4.99 115.15 123.75 1lum h HIS 94 Ca 0.14 -0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.32 1lum h HIS 94 Cb 0.11 -0.10 0.00 0.00 1.06 0.00 0.00 27.41 28.47 1lum h HIS 94 CO -0.01 0.37 0.52 1.96 0.86 0.00 0.00 177.93 181.63 1lum h GLN 95 N 0.22 0.00 0.00 2.45 4.20 -0.19 -3.02 115.11 118.77 1lum h GLN 95 Ca 0.08 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1lum h GLN 95 Cb 0.17 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.95 1lum h GLN 95 CO -0.01 0.00 0.00 0.66 -0.67 0.00 0.00 178.83 178.81 1lum n TYR 96 N -2.42 -0.83 -0.51 2.96 4.02 -0.69 -4.50 117.16 115.19 1lum n TYR 96 Ca -0.01 0.15 -0.19 0.00 -0.01 0.00 0.00 57.90 57.84 1lum n TYR 96 Cb 0.55 0.23 0.16 0.00 -0.02 0.00 0.00 39.34 40.26 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 -3.27 -3.06 -3.71 7.72 5.03 1.62 -4.88 115.26 114.72 1lum n ASN 97 Ca 0.00 -0.41 -0.39 0.00 0.87 0.00 0.00 54.58 54.64 1lum n ASN 97 Cb 0.00 -0.78 0.00 0.00 -1.02 0.00 0.00 39.78 37.98 1lum n ASN 97 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1lum n GLY 98 N 2.40 5.61 3.71 7.41 0.00 -1.26 -4.62 105.19 118.44 1lum n GLY 98 Ca 0.06 -2.65 -0.42 0.00 0.00 0.00 0.00 46.02 43.01 1lum n GLY 98 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1lum s GLY 99 N -1.81 2.81 0.30 -0.02 0.00 -1.26 -4.86 107.32 102.46 1lum s GLY 99 Ca 0.37 0.55 0.23 0.00 0.00 0.00 0.00 44.72 45.87 1lum s GLY 99 CO -0.02 1.75 0.78 0.61 0.00 0.00 0.00 173.10 176.21 1lum n GLY 100 N 2.95 -0.49 2.68 0.20 0.00 -1.26 -3.15 105.19 106.13 1lum n GLY 100 Ca 0.07 0.32 -0.34 0.00 0.00 0.00 0.00 46.02 46.07 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 -2.83 -2.38 -0.03 0.99 4.32 -1.26 -4.49 117.00 111.32 1lum n LEU 101 Ca 0.21 0.65 0.03 0.00 -0.02 0.00 0.00 56.01 56.88 1lum n LEU 101 Cb 0.99 -0.72 0.05 0.00 -1.62 0.00 0.00 43.42 42.13 1lum n LEU 101 CO 0.21 -3.45 0.10 1.33 -1.22 0.00 0.00 177.39 174.35 1lum n VAL 102 N -0.85 -0.04 -1.87 4.08 0.24 -1.26 -2.10 118.33 116.52 1lum n VAL 102 Ca 0.09 0.20 -0.03 0.00 -2.04 0.00 0.00 64.34 62.55 1lum n VAL 102 Cb 0.33 -0.31 -0.02 0.00 -1.47 0.00 0.00 33.84 32.36 1lum n VAL 102 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1lum n THR 103 N -3.35 0.00 -2.71 3.34 5.66 -1.26 -4.95 114.28 111.00 1lum n THR 103 Ca 0.03 -0.07 -0.04 0.00 -3.05 0.00 0.00 64.05 60.92 1lum n THR 103 Cb 0.11 0.33 0.01 0.00 -1.55 0.00 0.00 70.33 69.23 1lum n THR 103 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 1lum n ARG 104 N -0.11 -2.74 -3.17 1.09 1.74 -0.89 -3.58 116.66 109.00 1lum n ARG 104 Ca -0.15 2.33 -0.02 0.00 -0.77 0.00 0.00 57.85 59.24 1lum n ARG 104 Cb 0.52 -5.31 -0.00 0.00 -1.02 0.00 0.00 32.46 26.65 1lum n ARG 104 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1lum n LEU 105 N 0.14 -0.03 -0.13 0.55 7.99 -1.14 -2.18 117.00 122.19 1lum n LEU 105 Ca 0.06 -0.07 0.10 0.00 -0.01 0.00 0.00 56.01 56.09 1lum n LEU 105 Cb 0.23 -0.09 0.43 0.00 -0.11 0.00 0.00 43.42 43.89 1lum n LEU 105 CO 0.44 0.04 1.20 -0.09 -1.51 0.00 0.00 177.39 177.46 1lum h ARG 106 N 1.82 0.55 -0.65 3.23 2.43 -1.62 -3.02 114.38 117.11 1lum h ARG 106 Ca -0.04 -0.03 0.13 0.00 -0.81 0.00 0.00 59.98 59.23 1lum h ARG 106 Cb 0.08 -0.12 -0.20 0.00 -0.42 0.00 0.00 29.97 29.30 1lum h ARG 106 CO 0.03 0.36 -0.17 -0.47 -1.51 0.00 0.00 179.97 178.21 1lum s TYR 107 N -5.52 -1.17 0.54 2.20 5.04 -1.07 -4.99 117.35 112.38 1lum s TYR 107 Ca -0.09 0.80 -0.22 0.00 -2.44 0.00 0.00 57.07 55.13 1lum s TYR 107 Cb 0.20 0.25 -0.05 0.00 0.35 0.00 0.00 41.96 42.70 1lum s TYR 107 CO 0.76 -0.67 1.34 -0.35 -1.34 0.00 0.00 175.55 175.28 1lum n PRO 108 N 5.32 1.67 -4.36 4.97 -0.04 -1.23 0.28 135.00 141.61 1lum n PRO 108 Ca 0.04 0.61 -0.27 0.00 -0.04 0.00 0.00 63.50 63.85 1lum n PRO 108 Cb 0.55 -2.54 -0.12 0.00 -0.04 0.00 0.00 33.50 31.34 1lum n PRO 108 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1lum s VAL 109 N -1.29 2.07 -0.41 0.52 -7.23 2.33 -4.45 120.40 111.94 1lum s VAL 109 Ca 0.71 -1.75 0.01 0.00 -1.81 0.00 0.00 61.98 59.15 1lum s VAL 109 Cb -0.42 -1.87 0.14 0.00 0.56 0.00 0.00 36.38 34.78 1lum s VAL 109 CO 0.50 -0.02 0.22 0.00 -0.31 0.00 0.00 175.10 175.49