#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lui n ASN 5 N 0.00 -5.97 -0.07 6.41 3.02 -1.26 -4.88 115.26 112.51 1lui n ASN 5 Ca 0.00 1.25 0.01 0.00 -0.03 0.00 0.00 54.58 55.80 1lui n ASN 5 Cb 0.00 -4.12 0.01 0.00 -0.61 0.00 0.00 39.78 35.06 1lui n ASN 5 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lui n LEU 6 N -3.11 0.90 -1.96 3.41 -0.00 -1.26 -4.88 117.00 110.10 1lui n LEU 6 Ca -0.03 -1.08 0.00 0.00 -0.00 0.00 0.00 56.01 54.90 1lui n LEU 6 Cb 0.42 -0.04 0.00 0.00 -0.00 0.00 0.00 43.42 43.80 1lui n LEU 6 CO 0.01 0.27 0.00 -1.84 -0.00 0.00 0.00 177.39 175.83 1lui n GLU 7 N -0.30 0.00 0.00 1.47 0.28 -1.26 -0.70 120.64 120.13 1lui n GLU 7 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 57.01 1lui n GLU 7 Cb 0.45 -1.46 0.00 0.00 1.43 0.00 0.00 31.44 31.87 1lui n GLU 7 CO 0.00 0.00 0.00 -2.37 -0.16 0.00 0.00 177.13 174.60 1lui n THR 8 N 1.90 0.00 -3.56 3.84 5.66 -1.26 -5.08 114.28 115.77 1lui n THR 8 Ca 0.00 0.00 -0.36 0.00 -3.05 0.00 0.00 64.05 60.64 1lui n THR 8 Cb 0.00 1.46 -0.08 0.00 -1.55 0.00 0.00 70.33 70.17 1lui n THR 8 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1lui s TYR 9 N 0.00 3.42 0.65 1.09 2.02 0.12 -4.93 117.35 119.73 1lui s TYR 9 Ca 0.00 0.51 0.07 0.00 -0.37 0.00 0.00 57.07 57.28 1lui s TYR 9 Cb 0.00 -2.33 0.31 0.00 -0.40 0.00 0.00 41.96 39.55 1lui s TYR 9 CO 0.00 0.19 1.15 1.49 -1.57 0.00 0.00 175.55 176.82 1lui h GLU 10 N 6.87 0.00 0.00 -0.62 4.81 -1.89 0.16 114.58 123.91 1lui h GLU 10 Ca -0.40 0.00 -0.37 0.00 -0.13 0.00 0.00 59.36 58.46 1lui h GLU 10 Cb 1.16 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 30.48 1lui h GLU 10 CO 0.74 0.00 -2.39 -2.67 -0.73 0.00 0.00 179.01 173.96 1lui n TRP 11 N -2.64 0.00 -1.77 0.92 4.27 -1.15 -0.56 117.44 116.50 1lui n TRP 11 Ca 0.02 0.00 -0.41 0.00 -3.89 0.00 0.00 57.50 53.22 1lui n TRP 11 Cb 0.98 -0.94 -0.00 0.00 -1.36 0.00 0.00 31.31 29.99 1lui n TRP 11 CO 0.00 0.00 0.00 0.98 -2.29 0.00 0.00 177.69 176.38 1lui n TYR 12 N -3.19 3.00 -3.36 -2.67 9.36 0.56 0.24 117.16 121.10 1lui n TYR 12 Ca -0.43 0.44 -0.14 0.00 3.32 0.00 0.00 57.90 61.09 1lui n TYR 12 Cb 0.97 -2.54 -0.08 0.00 -0.63 0.00 0.00 39.34 37.06 1lui n TYR 12 CO 0.00 0.00 0.00 -0.80 0.22 0.00 0.00 176.86 176.28 1lui s ASN 13 N -0.10 1.07 0.00 2.98 0.01 2.66 -4.68 114.94 116.88 1lui s ASN 13 Ca 0.54 -0.93 0.00 0.00 -0.71 0.00 0.00 52.86 51.76 1lui s ASN 13 Cb -0.48 0.73 0.00 0.00 0.41 0.00 0.00 41.25 41.91 1lui s ASN 13 CO 0.63 -0.33 0.65 1.17 -1.51 0.00 0.00 177.10 177.71 1lui n LYS 14 N 4.95 0.00 0.00 -0.60 4.81 -1.26 -3.05 118.16 123.00 1lui n LYS 14 Ca 0.03 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 57.86 1lui n LYS 14 Cb 0.47 -1.25 0.00 0.00 0.02 0.00 0.00 35.03 34.27 1lui n LYS 14 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1lui n SER 15 N -1.66 0.00 -4.60 3.14 2.88 -1.26 -4.11 113.62 108.01 1lui n SER 15 Ca 0.00 0.33 -0.30 0.00 -1.33 0.00 0.00 58.87 57.57 1lui n SER 15 Cb 0.00 -0.33 0.20 0.00 -0.75 0.00 0.00 64.21 63.33 1lui n SER 15 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 1lui s ILE 16 N -2.63 2.13 0.25 2.46 1.01 -1.17 -5.07 121.20 118.17 1lui s ILE 16 Ca 0.00 0.04 0.01 0.00 0.00 0.00 0.00 60.65 60.70 1lui s ILE 16 Cb 0.00 -2.12 -0.00 0.00 0.01 0.00 0.00 42.46 40.35 1lui s ILE 16 CO 0.00 -0.05 0.04 -0.24 0.00 0.00 0.00 174.94 174.69 1lui n SER 17 N -4.48 1.86 0.03 3.58 2.88 -1.26 -4.88 113.62 111.34 1lui n SER 17 Ca 0.08 -2.19 -0.15 0.00 -1.33 0.00 0.00 58.87 55.28 1lui n SER 17 Cb 0.53 0.39 -0.04 0.00 -0.75 0.00 0.00 64.21 64.34 1lui n SER 17 CO 0.00 0.00 0.00 0.08 -1.23 0.00 0.00 175.04 173.89 1lui h ARG 18 N 0.00 0.57 -0.06 -1.46 0.11 -2.00 -3.14 114.38 108.41 1lui h ARG 18 Ca -0.20 -0.53 -0.08 0.00 0.10 0.00 0.00 59.98 59.27 1lui h ARG 18 Cb 0.67 0.13 0.00 0.00 1.11 0.00 0.00 29.97 31.89 1lui h ARG 18 CO 0.32 1.15 -0.29 0.22 0.10 0.00 0.00 179.97 181.47 1lui h ASP 19 N 0.36 0.35 -0.01 0.08 3.58 -2.00 -3.23 116.42 115.56 1lui h ASP 19 Ca -0.07 -0.66 0.02 0.00 0.42 0.00 0.00 57.03 56.74 1lui h ASP 19 Cb 1.47 -0.10 -0.02 0.00 1.72 0.00 0.00 39.33 42.40 1lui h ASP 19 CO 0.16 0.95 -0.08 0.11 -2.88 0.00 0.00 179.24 177.51 1lui h LYS 20 N -0.22 -0.13 -0.40 0.28 6.56 -1.98 -0.75 116.57 119.93 1lui h LYS 20 Ca -0.02 0.01 0.08 0.00 -1.06 0.00 0.00 60.65 59.66 1lui h LYS 20 Cb 0.95 0.03 -0.09 0.00 -0.57 0.00 0.00 32.23 32.55 1lui h LYS 20 CO 0.06 -0.09 -0.22 0.00 -2.06 0.00 0.00 179.45 177.14 1lui h ALA 21 N 0.86 0.04 -0.59 3.86 0.00 -1.67 1.27 119.26 123.03 1lui h ALA 21 Ca 0.03 0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.14 1lui h ALA 21 Cb 0.18 0.52 -0.06 0.00 0.00 0.00 0.00 17.79 18.43 1lui h ALA 21 CO -0.09 -0.60 0.28 0.93 0.00 0.00 0.00 179.25 179.78 1lui h GLU 22 N -0.15 0.51 0.00 0.00 5.08 -1.52 1.33 114.58 119.82 1lui h GLU 22 Ca 0.19 -0.03 0.02 0.00 -1.00 0.00 0.00 59.36 58.54 1lui h GLU 22 Cb 0.46 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1lui h GLU 22 CO -0.49 0.34 -0.12 1.57 -1.00 0.00 0.00 179.01 179.31 1lui h LYS 23 N 0.52 -0.19 -0.61 2.33 2.10 0.92 1.28 116.57 122.91 1lui h LYS 23 Ca 0.28 0.01 -0.01 0.00 -2.00 0.00 0.00 60.65 58.93 1lui h LYS 23 Cb 0.24 0.04 -0.03 0.00 -0.90 0.00 0.00 32.23 31.58 1lui h LYS 23 CO -0.22 -0.13 0.36 1.37 -2.00 0.00 0.00 179.45 178.83 1lui h LEU 24 N -0.20 0.75 -0.43 7.07 8.10 0.25 0.43 115.31 131.27 1lui h LEU 24 Ca 0.04 -0.07 -0.01 0.00 0.11 0.00 0.00 57.88 57.96 1lui h LEU 24 Cb 0.25 -0.19 -0.02 0.00 -0.44 0.00 0.00 40.66 40.26 1lui h LEU 24 CO -0.12 0.60 0.25 -0.07 -4.11 0.00 0.00 178.44 174.99 1lui h LEU 25 N 0.83 0.53 -0.34 0.17 3.38 0.24 0.76 115.31 120.90 1lui h LEU 25 Ca 0.22 -0.07 -0.04 0.00 0.09 0.00 0.00 57.88 58.08 1lui h LEU 25 Cb -0.00 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1lui h LEU 25 CO -0.04 0.45 0.06 -0.07 0.09 0.00 0.00 178.44 178.93 1lui h LEU 26 N 0.57 0.53 -1.32 1.67 3.38 0.21 -1.96 115.31 118.40 1lui h LEU 26 Ca 0.15 -0.26 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 1lui h LEU 26 Cb 0.03 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 1lui h LEU 26 CO -0.03 0.65 -0.19 0.44 0.09 0.00 0.00 178.44 179.40 1lui h ASP 27 N 0.39 0.00 0.16 -0.43 5.19 0.11 -3.14 116.42 118.70 1lui h ASP 27 Ca 0.10 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.50 1lui h ASP 27 Cb 0.35 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.86 1lui h ASP 27 CO 0.01 0.19 -0.08 0.00 -3.12 0.00 0.00 179.24 176.24 1lui h THR 28 N 0.00 0.97 -3.41 0.35 1.03 0.10 -3.50 112.91 108.45 1lui h THR 28 Ca -0.00 -0.90 0.00 0.00 -0.01 0.00 0.00 66.41 65.50 1lui h THR 28 Cb 0.64 1.49 0.00 0.00 -1.07 0.00 0.00 68.15 69.21 1lui h THR 28 CO 0.03 0.20 -0.10 0.61 -0.01 0.00 0.00 175.52 176.24 1lui n GLY 29 N 0.09 -1.02 3.36 2.99 0.00 -0.78 -5.08 105.19 104.75 1lui n GLY 29 Ca -0.09 0.12 -0.15 0.00 0.00 0.00 0.00 46.02 45.90 1lui n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lui s LYS 30 N -1.20 0.81 -0.51 1.61 3.01 -1.26 -5.03 119.74 117.17 1lui s LYS 30 Ca 0.04 0.06 -0.27 0.00 -1.01 0.00 0.00 55.97 54.79 1lui s LYS 30 Cb -0.01 0.37 0.03 0.00 -1.01 0.00 0.00 37.83 37.21 1lui s LYS 30 CO 0.14 -0.23 1.04 -2.00 0.51 0.00 0.00 175.35 174.81 1lui s GLU 31 N -1.14 3.53 0.00 1.68 2.56 -1.26 -2.76 118.70 121.30 1lui s GLU 31 Ca -0.11 0.19 0.00 0.00 0.00 0.00 0.00 54.97 55.04 1lui s GLU 31 Cb -0.03 -3.97 0.00 0.00 2.00 0.00 0.00 34.13 32.13 1lui s GLU 31 CO 0.06 -1.42 0.00 0.41 -0.56 0.00 0.00 175.26 173.76 1lui n GLY 32 N 4.98 0.39 3.56 -1.50 0.00 -0.11 -4.47 105.19 108.04 1lui n GLY 32 Ca 0.07 -1.03 -0.48 0.00 0.00 0.00 0.00 46.02 44.58 1lui n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lui n ALA 33 N 0.40 -0.95 -2.41 4.61 0.00 1.57 -2.64 120.51 121.08 1lui n ALA 33 Ca 0.00 0.45 -0.31 0.00 0.00 0.00 0.00 53.44 53.58 1lui n ALA 33 Cb 0.14 -1.98 -0.14 0.00 0.00 0.00 0.00 19.45 17.47 1lui n ALA 33 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1lui s PHE 34 N -0.39 2.52 0.13 0.00 5.36 0.66 0.17 117.98 126.43 1lui s PHE 34 Ca 0.71 -0.29 -0.12 0.00 -0.96 0.00 0.00 56.93 56.27 1lui s PHE 34 Cb -0.85 -1.52 0.01 0.00 -0.34 0.00 0.00 43.02 40.32 1lui s PHE 34 CO 0.54 0.14 0.31 1.41 -1.46 0.00 0.00 175.22 176.16 1lui s MET 35 N -0.97 1.04 0.03 10.12 -2.45 1.51 0.75 119.30 129.32 1lui s MET 35 Ca 0.12 -0.94 0.01 0.00 -1.25 0.00 0.00 55.69 53.63 1lui s MET 35 Cb -0.10 0.40 -0.02 0.00 1.25 0.00 0.00 34.83 36.36 1lui s MET 35 CO 0.02 -0.38 -0.04 0.08 1.05 0.00 0.00 175.02 175.74 1lui s VAL 36 N -3.87 0.24 -0.12 10.11 1.01 0.67 0.56 120.40 128.99 1lui s VAL 36 Ca 0.08 -1.03 -0.05 0.00 0.00 0.00 0.00 61.98 60.98 1lui s VAL 36 Cb 0.03 -0.46 0.06 0.00 0.00 0.00 0.00 36.38 36.01 1lui s VAL 36 CO -0.08 -0.51 0.27 0.00 0.00 0.00 0.00 175.10 174.78 1lui s ARG 37 N -1.69 0.19 0.58 2.72 1.70 1.12 0.62 118.95 124.17 1lui s ARG 37 Ca -0.12 0.68 -0.20 0.00 -0.47 0.00 0.00 55.73 55.62 1lui s ARG 37 Cb -0.09 -0.05 -0.04 0.00 -0.57 0.00 0.00 34.95 34.20 1lui s ARG 37 CO -0.01 -0.23 1.29 0.34 -1.08 0.00 0.00 175.30 175.60 1lui s ASP 38 N 1.96 5.14 0.48 -2.89 2.15 -1.25 0.48 116.67 122.74 1lui s ASP 38 Ca -0.03 2.60 0.02 0.00 0.43 0.00 0.00 52.55 55.57 1lui s ASP 38 Cb -0.11 -2.62 -0.03 0.00 -0.30 0.00 0.00 42.92 39.86 1lui s ASP 38 CO -0.09 -1.64 0.01 -0.44 -0.17 0.00 0.00 175.17 172.84 1lui s SER 39 N -1.26 3.95 -0.99 -0.34 0.01 -1.21 -4.72 113.70 109.14 1lui s SER 39 Ca 0.75 -1.60 -0.01 0.00 1.31 0.00 0.00 55.95 56.41 1lui s SER 39 Cb -0.36 0.34 0.32 0.00 0.21 0.00 0.00 66.02 66.53 1lui s SER 39 CO 0.41 -0.78 1.69 0.54 0.41 0.00 0.00 173.24 175.51 1lui n ARG 40 N -1.17 5.09 -0.02 12.44 5.12 -1.26 -4.74 116.66 132.12 1lui n ARG 40 Ca -0.15 -4.68 0.00 0.00 -1.93 0.00 0.00 57.85 51.09 1lui n ARG 40 Cb 0.67 -2.45 0.00 0.00 -1.16 0.00 0.00 32.46 29.52 1lui n ARG 40 CO 0.00 0.00 0.00 -2.37 -1.93 0.00 0.00 177.63 173.33 1lui n THR 41 N 0.09 0.00 0.00 0.55 5.66 -1.26 -4.96 114.28 114.37 1lui n THR 41 Ca 0.43 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.43 1lui n THR 41 Cb 0.28 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.06 1lui n THR 41 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1lui n PRO 42 N 0.00 0.00 0.00 1.09 -0.02 -1.26 -4.38 135.00 130.43 1lui n PRO 42 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1lui n PRO 42 Cb 0.00 -1.86 0.00 0.00 -0.02 0.00 0.00 33.50 31.62 1lui n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1lui n GLY 43 N -0.89 1.50 1.18 -1.23 0.00 -1.26 -5.06 105.19 99.43 1lui n GLY 43 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 1lui n GLY 43 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1lui n THR 44 N -0.76 0.00 -4.12 2.61 5.66 -1.26 -4.95 114.28 111.46 1lui n THR 44 Ca 0.00 -0.22 -0.11 0.00 -3.05 0.00 0.00 64.05 60.67 1lui n THR 44 Cb 0.00 -1.37 -0.10 0.00 -1.55 0.00 0.00 70.33 67.30 1lui n THR 44 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1lui s TYR 45 N -1.76 0.77 0.12 1.09 1.51 -1.24 -3.32 117.35 114.52 1lui s TYR 45 Ca 0.23 -0.79 -0.02 0.00 -1.01 0.00 0.00 57.07 55.49 1lui s TYR 45 Cb -0.02 -0.46 -0.05 0.00 -0.11 0.00 0.00 41.96 41.33 1lui s TYR 45 CO 0.17 -0.15 0.31 0.99 -1.11 0.00 0.00 175.55 175.77 1lui s THR 46 N -2.88 5.27 -0.22 -0.71 2.01 1.74 0.28 115.64 121.13 1lui s THR 46 Ca 0.04 -0.25 0.00 0.00 0.31 0.00 0.00 61.69 61.79 1lui s THR 46 Cb 0.00 -3.66 0.06 0.00 0.01 0.00 0.00 72.50 68.91 1lui s THR 46 CO -0.03 0.02 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.18 1lui s VAL 47 N -1.65 1.35 -0.28 3.82 1.01 2.50 0.36 120.40 127.50 1lui s VAL 47 Ca 0.38 -1.04 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 1lui s VAL 47 Cb -0.12 -1.62 -0.01 0.00 0.00 0.00 0.00 36.38 34.63 1lui s VAL 47 CO 0.27 -0.07 0.76 -0.55 0.00 0.00 0.00 175.10 175.51 1lui s SER 48 N 1.49 6.68 -0.15 3.32 0.15 2.29 0.46 113.70 127.93 1lui s SER 48 Ca -0.04 0.74 0.01 0.00 0.70 0.00 0.00 55.95 57.37 1lui s SER 48 Cb -0.18 -2.39 0.02 0.00 -1.71 0.00 0.00 66.02 61.75 1lui s SER 48 CO -0.07 -0.53 -0.19 0.68 1.20 0.00 0.00 173.24 174.33 1lui s VAL 49 N 2.82 1.91 0.01 4.45 -7.23 0.61 0.44 120.40 123.41 1lui s VAL 49 Ca 0.31 -0.87 0.02 0.00 -1.81 0.00 0.00 61.98 59.63 1lui s VAL 49 Cb -0.15 -1.73 -0.01 0.00 0.56 0.00 0.00 36.38 35.06 1lui s VAL 49 CO 0.10 0.52 -0.06 0.72 -0.31 0.00 0.00 175.10 176.07 1lui s PHE 50 N 1.13 0.51 -0.28 2.82 -0.71 0.44 0.21 117.98 122.11 1lui s PHE 50 Ca -0.00 -0.25 -0.03 0.00 -1.04 0.00 0.00 56.93 55.60 1lui s PHE 50 Cb -0.14 -0.32 0.09 0.00 -1.21 0.00 0.00 43.02 41.44 1lui s PHE 50 CO -0.08 -0.04 0.11 0.99 -1.34 0.00 0.00 175.22 174.86 1lui s THR 51 N -0.64 0.19 -0.32 -4.49 2.01 -0.76 0.45 115.64 112.08 1lui s THR 51 Ca -0.03 -0.84 -0.21 0.00 0.31 0.00 0.00 61.69 60.92 1lui s THR 51 Cb -0.05 -1.10 -0.10 0.00 0.01 0.00 0.00 72.50 71.25 1lui s THR 51 CO 0.00 -0.64 1.17 0.29 -0.69 0.00 0.00 174.62 174.75 1lui n LYS 52 N 5.15 0.00 -3.44 4.92 5.02 -1.11 -4.15 118.16 124.55 1lui n LYS 52 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 1lui n LYS 52 Cb 0.43 -0.77 0.00 0.00 -0.02 0.00 0.00 35.03 34.68 1lui n LYS 52 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1lui n ALA 53 N 4.22 0.00 0.00 7.82 0.00 -1.26 -4.96 120.51 126.33 1lui n ALA 53 Ca 0.30 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.74 1lui n ALA 53 Cb -0.01 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.44 1lui n ALA 53 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 1lui n ILE 54 N 1.37 0.00 -0.32 0.00 -0.00 -1.26 -3.22 119.36 115.93 1lui n ILE 54 Ca 0.00 0.00 0.27 0.00 -0.00 0.00 0.00 62.75 63.02 1lui n ILE 54 Cb 0.00 0.00 0.59 0.00 -0.00 0.00 0.00 39.64 40.23 1lui n ILE 54 CO 0.00 0.00 0.00 0.40 -0.00 0.00 0.00 176.55 176.95 1lui h ILE 55 N 1.22 0.47 0.00 1.39 2.04 -2.03 -2.30 117.51 118.31 1lui h ILE 55 Ca 0.00 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1lui h ILE 55 Cb 0.00 0.19 0.00 0.00 -0.74 0.00 0.00 36.82 36.27 1lui h ILE 55 CO 0.00 0.05 -0.35 -1.54 0.00 0.00 0.00 178.15 176.31 1lui n SER 56 N -4.50 0.46 -2.40 1.72 3.41 -1.26 -5.05 113.62 105.99 1lui n SER 56 Ca 0.26 -2.09 -0.05 0.00 -0.26 0.00 0.00 58.87 56.73 1lui n SER 56 Cb 1.01 -0.21 0.01 0.00 -0.26 0.00 0.00 64.21 64.75 1lui n SER 56 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1lui n GLU 57 N -0.26 -1.66 0.08 4.33 2.13 -0.87 -4.98 120.64 119.42 1lui n GLU 57 Ca 0.03 1.63 -0.13 0.00 0.66 0.00 0.00 57.16 59.35 1lui n GLU 57 Cb 0.66 -4.29 -0.08 0.00 0.27 0.00 0.00 31.44 27.99 1lui n GLU 57 CO 0.00 0.00 0.00 -0.91 -0.41 0.00 0.00 177.13 175.81 1lui h ASN 58 N 1.40 -0.20 0.00 4.31 2.35 -1.85 -3.49 115.58 118.10 1lui h ASN 58 Ca 0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 1lui h ASN 58 Cb 0.62 0.05 0.00 0.00 0.05 0.00 0.00 38.32 39.05 1lui h ASN 58 CO 0.13 0.20 0.00 -0.81 -1.65 0.00 0.00 177.43 175.30 1lui n PRO 59 N -5.02 3.44 -2.98 0.81 -0.04 -1.26 -5.01 135.00 124.94 1lui n PRO 59 Ca -0.09 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 62.93 1lui n PRO 59 Cb 0.24 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.69 1lui n PRO 59 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1lui s ILE 61 N 2.02 3.66 -0.17 0.00 -1.09 -1.25 -1.84 121.20 122.52 1lui s ILE 61 Ca 0.35 -1.72 -0.07 0.00 -2.23 0.00 0.00 60.65 56.98 1lui s ILE 61 Cb -0.05 -3.35 -0.04 0.00 -1.58 0.00 0.00 42.46 37.44 1lui s ILE 61 CO -0.06 -0.56 0.05 -0.75 -1.23 0.00 0.00 174.94 172.39 1lui s LYS 62 N 1.27 3.88 -0.44 2.79 2.47 0.57 -4.86 119.74 125.43 1lui s LYS 62 Ca 0.04 -0.35 -0.15 0.00 -1.56 0.00 0.00 55.97 53.95 1lui s LYS 62 Cb -0.23 -3.16 0.05 0.00 -1.46 0.00 0.00 37.83 33.02 1lui s LYS 62 CO -0.01 0.31 0.34 -1.01 0.16 0.00 0.00 175.35 175.14 1lui s HIS 63 N 0.24 3.25 -0.27 4.03 3.76 -1.24 0.23 115.29 125.28 1lui s HIS 63 Ca 0.03 -0.78 -0.14 0.00 -0.15 0.00 0.00 55.06 54.02 1lui s HIS 63 Cb -0.12 -2.85 -0.04 0.00 1.11 0.00 0.00 32.58 30.68 1lui s HIS 63 CO 0.01 -0.69 0.34 0.71 -0.85 0.00 0.00 174.74 174.26 1lui s TYR 64 N 1.65 3.24 -0.25 1.40 1.51 1.65 -4.72 117.35 121.83 1lui s TYR 64 Ca 0.04 0.35 -0.16 0.00 -1.01 0.00 0.00 57.07 56.29 1lui s TYR 64 Cb -0.21 -2.54 -0.03 0.00 -0.11 0.00 0.00 41.96 39.06 1lui s TYR 64 CO 0.08 -0.22 0.42 -1.58 -1.11 0.00 0.00 175.55 173.14 1lui s HIS 65 N 2.02 3.28 -0.35 2.71 2.46 -1.26 0.59 115.29 124.73 1lui s HIS 65 Ca 0.14 0.52 -0.27 0.00 0.47 0.00 0.00 55.06 55.91 1lui s HIS 65 Cb -0.16 -2.61 -0.05 0.00 -0.13 0.00 0.00 32.58 29.63 1lui s HIS 65 CO 0.10 -0.21 2.24 0.42 -2.47 0.00 0.00 174.74 174.83 1lui s ILE 66 N 2.01 3.06 0.48 0.89 -1.09 0.79 -4.36 121.20 122.99 1lui s ILE 66 Ca 0.18 0.05 -0.23 0.00 -2.23 0.00 0.00 60.65 58.42 1lui s ILE 66 Cb -0.16 -3.11 -0.07 0.00 -1.58 0.00 0.00 42.46 37.55 1lui s ILE 66 CO 0.09 -0.09 1.24 -0.75 -1.23 0.00 0.00 174.94 174.21 1lui s LYS 67 N 7.09 3.59 -0.07 2.79 2.47 2.40 -3.63 119.74 134.37 1lui s LYS 67 Ca 0.96 1.96 0.03 0.00 -1.56 0.00 0.00 55.97 57.36 1lui s LYS 67 Cb -0.25 -2.40 -0.02 0.00 -1.46 0.00 0.00 37.83 33.70 1lui s LYS 67 CO 0.31 -0.74 -0.16 -1.21 0.16 0.00 0.00 175.35 173.70 1lui s GLU 68 N -2.71 2.71 -0.39 4.03 0.41 -1.08 0.39 118.70 122.04 1lui s GLU 68 Ca 0.65 -0.73 0.06 0.00 -0.41 0.00 0.00 54.97 54.54 1lui s GLU 68 Cb -0.33 -2.39 0.18 0.00 -1.78 0.00 0.00 34.13 29.81 1lui s GLU 68 CO 0.40 0.49 0.67 -0.08 -0.49 0.00 0.00 175.26 176.25 1lui s THR 69 N -0.39 -0.92 -0.10 3.63 -1.32 0.81 -4.86 115.64 112.49 1lui s THR 69 Ca 0.04 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.51 1lui s THR 69 Cb -0.12 -0.06 -0.03 0.00 -1.51 0.00 0.00 72.50 70.77 1lui s THR 69 CO 0.02 0.00 0.46 0.59 -2.21 0.00 0.00 174.62 173.48 1lui n ASN 70 N 4.42 -0.64 -0.74 8.08 5.03 -1.26 -3.26 115.26 126.89 1lui n ASN 70 Ca 0.10 -0.40 0.00 0.00 0.87 0.00 0.00 54.58 55.15 1lui n ASN 70 Cb 0.57 -0.20 0.00 0.00 -1.02 0.00 0.00 39.78 39.14 1lui n ASN 70 CO 0.00 0.00 0.00 0.47 -1.83 0.00 0.00 177.26 175.90 1lui n ASP 71 N 1.64 0.15 0.00 6.41 8.00 -1.23 -4.87 116.55 126.65 1lui n ASP 71 Ca 0.07 -0.68 0.00 0.00 0.71 0.00 0.00 54.79 54.88 1lui n ASP 71 Cb 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.24 1lui n ASP 71 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1lui n SER 72 N -1.95 0.00 -0.40 -2.24 7.64 -1.26 -3.11 113.62 112.30 1lui n SER 72 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 1lui n SER 72 Cb 0.00 0.00 -0.01 0.00 -1.01 0.00 0.00 64.21 63.19 1lui n SER 72 CO 0.00 0.00 0.00 -2.65 -3.01 0.00 0.00 175.04 169.38 1lui n PRO 73 N 0.00 0.00 0.00 1.43 -0.02 -1.26 -5.13 135.00 130.02 1lui n PRO 73 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1lui n PRO 73 Cb 0.00 -0.13 0.00 0.00 -0.02 0.00 0.00 33.50 33.35 1lui n PRO 73 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1lui n LYS 74 N 0.53 0.95 0.02 -0.52 4.01 -1.15 -4.81 118.16 117.20 1lui n LYS 74 Ca 0.04 0.00 -0.18 0.00 -0.51 0.00 0.00 58.31 57.65 1lui n LYS 74 Cb -0.00 0.00 -0.14 0.00 -0.51 0.00 0.00 35.03 34.38 1lui n LYS 74 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1lui h ARG 75 N 0.00 0.28 -6.87 1.97 3.08 -1.46 -3.26 114.38 108.12 1lui h ARG 75 Ca 0.00 -0.42 -0.48 0.00 0.07 0.00 0.00 59.98 59.16 1lui h ARG 75 Cb 0.00 0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 1lui h ARG 75 CO 0.00 1.17 0.36 0.71 -1.07 0.00 0.00 179.97 181.14 1lui s TYR 76 N -2.61 3.68 0.00 3.04 1.51 0.74 0.28 117.35 123.99 1lui s TYR 76 Ca -0.14 1.78 0.00 0.00 -1.01 0.00 0.00 57.07 57.70 1lui s TYR 76 Cb 0.01 -2.98 0.00 0.00 -0.11 0.00 0.00 41.96 38.88 1lui s TYR 76 CO 0.81 0.10 0.00 2.48 -1.11 0.00 0.00 175.55 177.83 1lui n TYR 77 N 0.67 0.00 -3.79 2.71 4.11 1.25 0.49 117.16 122.60 1lui n TYR 77 Ca 0.01 0.00 -0.28 0.00 -0.00 0.00 0.00 57.90 57.64 1lui n TYR 77 Cb 0.49 0.00 -0.11 0.00 -0.00 0.00 0.00 39.34 39.72 1lui n TYR 77 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 176.86 178.19 1lui n VAL 78 N -0.04 1.37 0.00 -3.48 0.24 -1.26 0.58 118.33 115.74 1lui n VAL 78 Ca 0.00 -4.74 0.00 0.00 -2.04 0.00 0.00 64.34 57.56 1lui n VAL 78 Cb 0.00 -2.12 0.00 0.00 -1.47 0.00 0.00 33.84 30.25 1lui n VAL 78 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lui n ALA 79 N 1.93 0.00 -1.34 2.33 0.00 -1.26 -4.73 120.51 117.45 1lui n ALA 79 Ca 0.22 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.62 1lui n ALA 79 Cb 0.37 0.00 -0.02 0.00 0.00 0.00 0.00 19.45 19.81 1lui n ALA 79 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1lui n GLU 80 N 0.00 -1.35 0.00 0.00 1.02 -1.26 -4.73 120.64 114.32 1lui n GLU 80 Ca 0.00 0.25 0.00 0.00 -0.02 0.00 0.00 57.16 57.39 1lui n GLU 80 Cb 0.00 -4.40 0.00 0.00 -0.02 0.00 0.00 31.44 27.02 1lui n GLU 80 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1lui n LYS 81 N -1.49 0.00 -4.81 3.49 5.02 -1.26 -4.99 118.16 114.12 1lui n LYS 81 Ca -0.05 0.06 -0.27 0.00 -2.02 0.00 0.00 58.31 56.04 1lui n LYS 81 Cb 0.21 -0.42 -0.17 0.00 -0.02 0.00 0.00 35.03 34.63 1lui n LYS 81 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1lui s TYR 82 N -0.20 1.81 0.06 2.13 1.51 -1.26 -5.09 117.35 116.31 1lui s TYR 82 Ca 0.00 -0.67 0.03 0.00 -1.01 0.00 0.00 57.07 55.42 1lui s TYR 82 Cb 0.00 -1.26 -0.04 0.00 -0.11 0.00 0.00 41.96 40.55 1lui s TYR 82 CO 0.00 -0.30 0.03 0.14 -1.11 0.00 0.00 175.55 174.32 1lui s VAL 83 N 0.46 4.28 0.15 0.71 -7.23 -1.21 -4.08 120.40 113.49 1lui s VAL 83 Ca -0.14 -0.79 -0.03 0.00 -1.81 0.00 0.00 61.98 59.22 1lui s VAL 83 Cb -0.16 -3.02 -0.03 0.00 0.56 0.00 0.00 36.38 33.73 1lui s VAL 83 CO 0.05 0.19 0.13 -0.36 -0.31 0.00 0.00 175.10 174.80 1lui s PHE 84 N -1.28 0.81 -0.68 2.82 0.40 1.82 -2.93 117.98 118.93 1lui s PHE 84 Ca 0.25 -1.15 0.10 0.00 -0.60 0.00 0.00 56.93 55.54 1lui s PHE 84 Cb -0.12 -0.39 0.55 0.00 0.51 0.00 0.00 43.02 43.57 1lui s PHE 84 CO 0.18 -0.60 1.36 -3.47 0.70 0.00 0.00 175.22 173.39 1lui n ASP 85 N -0.16 4.05 -3.64 1.36 2.03 -1.26 0.26 116.55 119.19 1lui n ASP 85 Ca -0.04 -2.56 -0.03 0.00 0.52 0.00 0.00 54.79 52.68 1lui n ASP 85 Cb 0.64 -0.59 -0.06 0.00 -0.72 0.00 0.00 41.12 40.39 1lui n ASP 85 CO 0.00 0.00 0.00 -0.55 -1.92 0.00 0.00 177.20 174.73 1lui s SER 86 N -0.59 -0.09 0.14 1.67 0.15 -1.26 -4.95 113.70 108.77 1lui s SER 86 Ca 0.37 0.15 -0.19 0.00 0.70 0.00 0.00 55.95 56.97 1lui s SER 86 Cb 0.27 0.14 0.01 0.00 -1.71 0.00 0.00 66.02 64.74 1lui s SER 86 CO 0.12 -0.04 1.69 0.40 1.20 0.00 0.00 173.24 176.61 1lui h ILE 87 N 2.80 0.70 -0.49 6.45 5.03 -1.96 0.69 117.51 130.73 1lui h ILE 87 Ca -0.22 0.00 0.09 0.00 -0.12 0.00 0.00 64.86 64.62 1lui h ILE 87 Cb 1.19 0.70 -0.08 0.00 -3.03 0.00 0.00 36.82 35.60 1lui h ILE 87 CO 0.19 0.00 0.01 1.55 -0.68 0.00 0.00 178.15 179.22 1lui h PRO 88 N -0.03 0.12 0.28 2.37 0.13 -1.95 9.47 132.00 142.40 1lui h PRO 88 Ca 0.13 -0.01 -0.01 0.00 -0.87 0.00 0.00 66.00 65.24 1lui h PRO 88 Cb 0.22 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.33 1lui h PRO 88 CO -0.28 0.08 -0.14 1.37 -0.23 0.00 0.00 178.00 178.80 1lui h LEU 89 N 0.13 -0.32 -1.71 1.56 -0.00 -1.85 6.75 115.31 119.86 1lui h LEU 89 Ca 0.25 -0.12 0.07 0.00 -0.00 0.00 0.00 57.88 58.08 1lui h LEU 89 Cb 0.36 0.08 -0.03 0.00 -0.00 0.00 0.00 40.66 41.08 1lui h LEU 89 CO -0.40 -0.06 0.33 0.25 -0.00 0.00 0.00 178.44 178.56 1lui h LEU 90 N -0.59 0.31 0.01 0.17 6.46 0.16 1.12 115.31 122.95 1lui h LEU 90 Ca -0.04 0.00 -0.24 0.00 -0.12 0.00 0.00 57.88 57.48 1lui h LEU 90 Cb 0.43 -0.06 -0.01 0.00 -0.73 0.00 0.00 40.66 40.29 1lui h LEU 90 CO 0.06 0.20 -1.10 0.40 -0.62 0.00 0.00 178.44 177.38 1lui h ILE 91 N 0.35 1.55 -0.61 4.05 1.08 2.14 -2.26 117.51 123.80 1lui h ILE 91 Ca 0.22 -3.05 -0.06 0.00 -0.39 0.00 0.00 64.86 61.58 1lui h ILE 91 Cb 0.41 2.81 -0.03 0.00 -3.07 0.00 0.00 36.82 36.95 1lui h ILE 91 CO -0.05 0.89 0.15 1.56 -0.69 0.00 0.00 178.15 180.01 1lui h GLN 92 N 0.07 0.96 -0.04 2.37 1.08 1.84 1.42 115.11 122.79 1lui h GLN 92 Ca -0.08 -0.21 -0.14 0.00 -1.45 0.00 0.00 58.65 56.76 1lui h GLN 92 Cb 1.82 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 29.10 1lui h GLN 92 CO 0.17 0.85 -0.63 -0.92 -0.95 0.00 0.00 178.83 177.36 1lui h TYR 93 N 0.92 0.21 0.00 2.96 3.20 0.11 -0.03 116.97 124.34 1lui h TYR 93 Ca 0.20 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1lui h TYR 93 Cb 0.32 -0.04 -0.00 0.00 1.54 0.00 0.00 36.73 38.56 1lui h TYR 93 CO 0.02 0.74 -0.26 0.45 -1.64 0.00 0.00 178.16 177.47 1lui h HIS 94 N 0.12 0.00 0.02 -3.82 3.86 -0.71 -2.49 115.15 112.14 1lui h HIS 94 Ca -0.01 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.12 1lui h HIS 94 Cb 1.13 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.59 1lui h HIS 94 CO 0.02 0.08 -0.40 1.96 0.86 0.00 0.00 177.93 180.45 1lui h GLN 95 N 0.00 0.05 0.00 2.45 4.20 0.22 1.24 115.11 123.26 1lui h GLN 95 Ca -0.01 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.62 1lui h GLN 95 Cb 1.07 0.03 0.00 0.00 0.30 0.00 0.00 27.48 28.88 1lui h GLN 95 CO 0.01 1.04 0.00 0.66 -0.67 0.00 0.00 178.83 179.87 1lui n TYR 96 N -4.48 0.00 0.00 2.96 4.02 -0.05 -4.64 117.16 114.97 1lui n TYR 96 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.74 1lui n TYR 96 Cb 0.58 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.90 1lui n TYR 96 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 1lui n ASN 97 N -0.92 0.00 0.00 7.72 3.02 -1.05 -4.76 115.26 119.27 1lui n ASN 97 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.55 1lui n ASN 97 Cb 0.00 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.17 1lui n ASN 97 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1lui n GLY 98 N -0.60 1.05 0.00 7.41 0.00 -0.96 -5.03 105.19 107.06 1lui n GLY 98 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1lui n GLY 98 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lui n GLY 99 N 0.00 0.00 0.00 -0.02 0.00 -1.25 -4.69 105.19 99.23 1lui n GLY 99 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1lui n GLY 99 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lui n GLY 100 N -0.88 -0.99 0.00 -0.02 0.00 -1.26 -5.04 105.19 96.99 1lui n GLY 100 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1lui n GLY 100 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1lui n LEU 101 N 0.00 0.00 -0.56 0.99 4.32 -1.26 -4.66 117.00 115.83 1lui n LEU 101 Ca 0.00 0.00 0.46 0.00 -0.02 0.00 0.00 56.01 56.45 1lui n LEU 101 Cb 0.00 0.00 0.70 0.00 -1.62 0.00 0.00 43.42 42.50 1lui n LEU 101 CO 0.00 -0.60 1.40 1.33 -1.22 0.00 0.00 177.39 178.30 1lui n VAL 102 N -1.26 0.00 0.00 4.08 0.24 -1.26 -3.77 118.33 116.36 1lui n VAL 102 Ca 0.00 1.40 0.00 0.00 -2.04 0.00 0.00 64.34 63.70 1lui n VAL 102 Cb 0.00 -2.38 0.00 0.00 -1.47 0.00 0.00 33.84 29.99 1lui n VAL 102 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1lui n THR 103 N -3.70 0.00 -1.33 3.34 5.66 -1.26 -4.87 114.28 112.12 1lui n THR 103 Ca 0.38 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.38 1lui n THR 103 Cb 1.86 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 70.64 1lui n THR 103 CO 0.00 0.00 0.00 -2.11 -3.05 0.00 0.00 175.07 169.91 1lui n ARG 104 N 0.00 0.00 -0.38 1.09 -4.01 -1.25 -2.45 116.66 109.66 1lui n ARG 104 Ca 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 56.81 1lui n ARG 104 Cb 0.00 -0.38 0.00 0.00 -3.04 0.00 0.00 32.46 29.04 1lui n ARG 104 CO 0.00 0.00 0.00 1.28 -3.04 0.00 0.00 177.63 175.87 1lui n LEU 105 N 1.59 0.00 -0.10 2.89 4.32 0.42 -4.50 117.00 121.63 1lui n LEU 105 Ca 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 56.01 55.98 1lui n LEU 105 Cb 0.00 0.00 0.26 0.00 -1.62 0.00 0.00 43.42 42.06 1lui n LEU 105 CO 0.00 0.00 1.05 -0.09 -1.22 0.00 0.00 177.39 177.13 1lui h ARG 106 N 0.27 0.75 -0.29 3.23 2.43 -1.24 -3.35 114.38 116.17 1lui h ARG 106 Ca 0.00 -0.11 0.21 0.00 -0.81 0.00 0.00 59.98 59.27 1lui h ARG 106 Cb 0.00 -0.13 -0.19 0.00 -0.42 0.00 0.00 29.97 29.22 1lui h ARG 106 CO 0.00 0.63 0.00 -0.47 -1.51 0.00 0.00 179.97 178.62 1lui s TYR 107 N -5.32 -0.53 0.62 2.20 5.04 -1.11 -4.93 117.35 113.31 1lui s TYR 107 Ca -0.09 0.35 -0.18 0.00 -2.44 0.00 0.00 57.07 54.71 1lui s TYR 107 Cb 0.16 0.11 -0.03 0.00 0.35 0.00 0.00 41.96 42.55 1lui s TYR 107 CO 0.78 -0.31 1.13 -0.35 -1.34 0.00 0.00 175.55 175.46 1lui n PRO 108 N 5.19 1.02 -4.40 4.97 -0.04 -1.22 0.24 135.00 140.75 1lui n PRO 108 Ca 0.06 0.40 -0.24 0.00 -0.04 0.00 0.00 63.50 63.68 1lui n PRO 108 Cb 0.57 -2.35 -0.11 0.00 -0.04 0.00 0.00 33.50 31.57 1lui n PRO 108 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1lui s VAL 109 N -1.45 2.17 -0.37 0.52 -7.23 3.78 -4.44 120.40 113.38 1lui s VAL 109 Ca 0.79 -2.13 0.01 0.00 -1.81 0.00 0.00 61.98 58.85 1lui s VAL 109 Cb -0.40 -2.08 0.15 0.00 0.56 0.00 0.00 36.38 34.61 1lui s VAL 109 CO 0.44 -0.31 0.27 0.00 -0.31 0.00 0.00 175.10 175.19