#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 0.00 -0.52 6.41 2.85 -1.26 -4.57 115.26 118.17 1lui n ASN 5 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 1lui n ASN 5 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 1lui n ASN 5 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1lui n LEU 6 N 0.00 0.00 -1.35 1.20 -0.00 -1.26 -4.61 117.00 110.98 1lui n LEU 6 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1lui n LEU 6 Cb 0.00 -0.46 0.00 0.00 -0.00 0.00 0.00 43.42 42.96 1lui n LEU 6 CO 0.00 0.00 0.34 -1.84 -0.00 0.00 0.00 177.39 175.89 1lui n GLU 7 N -0.52 0.46 0.00 1.47 -0.00 -1.26 -1.55 120.64 119.25 1lui n GLU 7 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.16 1lui n GLU 7 Cb 0.00 -1.27 0.00 0.00 -0.00 0.00 0.00 31.44 30.17 1lui n GLU 7 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1lui n THR 8 N 1.23 0.00 -3.03 3.84 5.66 -1.26 -5.08 114.28 115.64 1lui n THR 8 Ca 0.00 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.60 1lui n THR 8 Cb 0.23 1.70 -0.05 0.00 -1.55 0.00 0.00 70.33 70.66 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 3.45 0.65 1.09 2.02 -0.59 -4.89 117.35 119.08 1lui s TYR 9 Ca 0.00 1.12 0.07 0.00 -0.37 0.00 0.00 57.07 57.89 1lui s TYR 9 Cb 0.00 -2.87 0.32 0.00 -0.40 0.00 0.00 41.96 39.02 1lui s TYR 9 CO 0.00 -0.12 1.16 1.49 -1.57 0.00 0.00 175.55 176.51 1lui h GLU 10 N 7.22 0.00 0.01 -0.62 4.81 -1.89 0.39 114.58 124.51 1lui h GLU 10 Ca -0.33 0.00 -0.39 0.00 -0.13 0.00 0.00 59.36 58.51 1lui h GLU 10 Cb 1.15 0.00 -0.06 0.00 0.63 0.00 0.00 28.75 30.47 1lui h GLU 10 CO 0.79 0.00 -2.42 -2.67 -0.73 0.00 0.00 179.01 173.98 1lui n TRP 11 N -2.64 0.14 -1.94 0.92 4.27 -1.20 -0.84 117.44 116.15 1lui n TRP 11 Ca 0.02 0.03 -0.41 0.00 -3.89 0.00 0.00 57.50 53.25 1lui n TRP 11 Cb 0.97 -1.02 -0.01 0.00 -1.36 0.00 0.00 31.31 29.89 1lui n TRP 11 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 1lui s TYR 12 N -2.52 2.83 -0.32 -2.67 5.04 0.14 0.30 117.35 120.15 1lui s TYR 12 Ca -0.32 1.18 0.01 0.00 -2.44 0.00 0.00 57.07 55.49 1lui s TYR 12 Cb 0.09 -3.88 0.14 0.00 0.35 0.00 0.00 41.96 38.66 1lui s TYR 12 CO 0.63 -2.64 0.31 -0.80 -1.34 0.00 0.00 175.55 171.72 1lui s ASN 13 N -0.09 1.61 0.00 4.32 0.01 2.44 -4.68 114.94 118.55 1lui s ASN 13 Ca 0.54 -1.08 0.00 0.00 -0.71 0.00 0.00 52.86 51.61 1lui s ASN 13 Cb -0.44 0.47 0.00 0.00 0.41 0.00 0.00 41.25 41.69 1lui s ASN 13 CO 0.55 -0.35 0.61 1.17 -1.51 0.00 0.00 177.10 177.57 1lui n LYS 14 N 4.92 0.00 0.00 -0.60 4.81 -1.26 -3.14 118.16 122.89 1lui n LYS 14 Ca 0.03 0.41 0.00 0.00 -0.87 0.00 0.00 58.31 57.87 1lui n LYS 14 Cb 0.45 -1.24 0.00 0.00 0.02 0.00 0.00 35.03 34.26 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 -1.73 0.00 -4.68 3.14 2.88 -1.26 -4.10 113.62 107.87 1lui n SER 15 Ca 0.00 0.29 -0.31 0.00 -1.33 0.00 0.00 58.87 57.53 1lui n SER 15 Cb 0.00 -0.29 0.16 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 -2.54 2.22 0.00 2.46 1.01 -1.19 -5.05 121.20 118.11 1lui s ILE 16 Ca 0.00 0.07 0.06 0.00 0.00 0.00 0.00 60.65 60.78 1lui s ILE 16 Cb 0.00 -2.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.30 1lui s ILE 16 CO 0.00 -0.09 -0.19 -0.55 0.00 0.00 0.00 174.94 174.11 1lui s SER 17 N -2.76 2.24 0.60 3.58 0.15 -1.26 -4.87 113.70 111.37 1lui s SER 17 Ca 0.66 -0.39 0.29 0.00 0.70 0.00 0.00 55.95 57.20 1lui s SER 17 Cb -0.22 -0.23 1.36 0.00 -1.71 0.00 0.00 66.02 65.22 1lui s SER 17 CO 0.58 0.20 1.76 0.08 1.20 0.00 0.00 173.24 177.06 1lui h ARG 18 N 5.42 0.00 -0.05 5.44 0.11 -1.98 0.11 114.38 123.43 1lui h ARG 18 Ca -0.39 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.60 1lui h ARG 18 Cb 1.15 0.00 0.01 0.00 1.11 0.00 0.00 29.97 32.24 1lui h ARG 18 CO 0.47 0.00 -0.33 -0.44 0.10 0.00 0.00 179.97 179.77 1lui h ASP 19 N 0.00 0.37 0.46 0.08 3.32 -2.03 -3.35 116.42 115.27 1lui h ASP 19 Ca 0.28 -0.68 -0.25 0.00 0.02 0.00 0.00 57.03 56.40 1lui h ASP 19 Cb 1.61 -0.11 0.01 0.00 0.22 0.00 0.00 39.33 41.05 1lui h ASP 19 CO -0.00 1.00 -1.10 0.11 -1.72 0.00 0.00 179.24 177.52 1lui h LYS 20 N -0.22 0.36 -0.79 3.56 6.56 -1.27 -3.34 116.57 121.43 1lui h LYS 20 Ca -0.03 -0.48 0.18 0.00 -1.06 0.00 0.00 60.65 59.26 1lui h LYS 20 Cb 1.01 0.16 -0.11 0.00 -0.57 0.00 0.00 32.23 32.71 1lui h LYS 20 CO 0.07 1.17 0.23 0.00 -2.06 0.00 0.00 179.45 178.87 1lui h ALA 21 N 0.64 1.09 -0.07 3.86 0.00 -1.22 0.80 119.26 124.36 1lui h ALA 21 Ca -0.11 0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1lui h ALA 21 Cb 1.78 0.21 -0.00 0.00 0.00 0.00 0.00 17.79 19.78 1lui h ALA 21 CO 0.19 -0.34 0.02 0.93 0.00 0.00 0.00 179.25 180.05 1lui h GLU 22 N 0.31 0.11 -0.18 0.00 5.08 -1.70 1.31 114.58 119.51 1lui h GLU 22 Ca 0.46 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.83 1lui h GLU 22 Cb 0.81 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 30.01 1lui h GLU 22 CO -0.52 0.27 -0.04 0.87 -1.00 0.00 0.00 179.01 178.59 1lui h LYS 23 N -0.07 0.01 0.11 2.33 1.79 -1.20 0.99 116.57 120.53 1lui h LYS 23 Ca 0.02 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.49 1lui h LYS 23 Cb 0.20 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 30.84 1lui h LYS 23 CO -0.00 0.00 -0.09 1.37 -1.08 0.00 0.00 179.45 179.65 1lui h LEU 24 N 0.01 -0.23 -0.19 2.94 8.10 0.74 0.95 115.31 127.62 1lui h LEU 24 Ca 0.08 0.02 0.05 0.00 0.11 0.00 0.00 57.88 58.15 1lui h LEU 24 Cb 0.13 0.08 -0.07 0.00 -0.44 0.00 0.00 40.66 40.36 1lui h LEU 24 CO -0.18 -0.14 -0.26 -0.07 -4.11 0.00 0.00 178.44 173.68 1lui h LEU 25 N -0.21 -0.83 -2.77 0.17 3.38 0.25 0.34 115.31 115.63 1lui h LEU 25 Ca -0.00 0.14 0.00 0.00 0.09 0.00 0.00 57.88 58.10 1lui h LEU 25 Cb 0.19 0.38 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1lui h LEU 25 CO -0.01 -0.30 0.00 0.25 0.09 0.00 0.00 178.44 178.47 1lui h LEU 26 N -0.30 0.00 -1.38 1.67 6.46 0.13 -0.48 115.31 121.41 1lui h LEU 26 Ca 0.12 0.00 -0.04 0.00 -0.12 0.00 0.00 57.88 57.84 1lui h LEU 26 Cb 0.48 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.41 1lui h LEU 26 CO -0.36 0.00 -0.18 -0.78 -0.62 0.00 0.00 178.44 176.49 1lui h ASP 27 N 0.00 0.00 0.20 1.25 1.82 0.23 -3.09 116.42 116.83 1lui h ASP 27 Ca 0.00 0.00 -0.35 0.00 -0.39 0.00 0.00 57.03 56.29 1lui h ASP 27 Cb 0.07 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.08 1lui h ASP 27 CO 0.00 0.18 -1.84 0.00 -1.61 0.00 0.00 179.24 175.97 1lui h THR 28 N 0.00 0.81 -4.10 2.25 1.03 -0.87 -3.50 112.91 108.52 1lui h THR 28 Ca -0.00 -2.47 0.00 0.00 -0.01 0.00 0.00 66.41 63.93 1lui h THR 28 Cb 0.61 2.63 0.00 0.00 -1.07 0.00 0.00 68.15 70.32 1lui h THR 28 CO 0.02 0.86 -0.04 0.61 -0.01 0.00 0.00 175.52 176.96 1lui n GLY 29 N 1.89 -0.78 3.07 2.99 0.00 -1.15 -5.08 105.19 106.14 1lui n GLY 29 Ca -0.27 0.18 -0.14 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.80 0.56 -0.52 1.61 3.01 -1.26 -5.02 119.74 115.32 1lui s LYS 30 Ca 0.02 -0.77 -0.27 0.00 -1.01 0.00 0.00 55.97 53.95 1lui s LYS 30 Cb -0.01 -0.35 0.03 0.00 -1.01 0.00 0.00 37.83 36.49 1lui s LYS 30 CO 0.35 0.07 1.04 -2.00 0.51 0.00 0.00 175.35 175.32 1lui s GLU 31 N -1.57 3.51 0.00 1.68 2.56 -1.26 -2.97 118.70 120.65 1lui s GLU 31 Ca -0.09 0.15 0.00 0.00 0.00 0.00 0.00 54.97 55.03 1lui s GLU 31 Cb -0.10 -3.98 0.00 0.00 2.00 0.00 0.00 34.13 32.05 1lui s GLU 31 CO 0.01 -1.45 0.00 0.41 -0.56 0.00 0.00 175.26 173.67 1lui n GLY 32 N 5.00 0.76 2.67 -1.50 0.00 0.15 -4.46 105.19 107.82 1lui n GLY 32 Ca 0.07 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 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 -0.64 -2.74 -2.39 4.61 0.00 2.10 -2.54 120.51 118.91 1lui n ALA 33 Ca 0.00 0.41 -0.29 0.00 0.00 0.00 0.00 53.44 53.56 1lui n ALA 33 Cb 0.00 -1.31 -0.13 0.00 0.00 0.00 0.00 19.45 18.01 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 -0.30 2.32 0.22 0.00 5.36 0.56 0.19 117.98 126.34 1lui s PHE 34 Ca 0.62 -0.38 -0.22 0.00 -0.96 0.00 0.00 56.93 55.99 1lui s PHE 34 Cb -0.88 -1.28 0.04 0.00 -0.34 0.00 0.00 43.02 40.57 1lui s PHE 34 CO 0.44 0.31 0.67 1.41 -1.46 0.00 0.00 175.22 176.59 1lui s MET 35 N -1.92 1.54 0.02 10.12 -2.45 1.97 0.74 119.30 129.32 1lui s MET 35 Ca 0.14 -0.75 -0.02 0.00 -1.25 0.00 0.00 55.69 53.81 1lui s MET 35 Cb -0.10 0.59 -0.01 0.00 1.25 0.00 0.00 34.83 36.56 1lui s MET 35 CO 0.06 -0.70 0.02 0.08 1.05 0.00 0.00 175.02 175.53 1lui s VAL 36 N -3.82 0.11 -0.11 10.11 1.01 0.88 0.54 120.40 129.12 1lui s VAL 36 Ca 0.07 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.11 1lui s VAL 36 Cb -0.04 -0.36 0.05 0.00 0.00 0.00 0.00 36.38 36.03 1lui s VAL 36 CO -0.02 -0.49 0.25 0.00 0.00 0.00 0.00 175.10 174.84 1lui s ARG 37 N -1.56 0.19 0.59 2.72 1.70 1.00 0.59 118.95 124.18 1lui s ARG 37 Ca -0.15 0.58 -0.20 0.00 -0.47 0.00 0.00 55.73 55.50 1lui s ARG 37 Cb -0.09 -0.11 -0.03 0.00 -0.57 0.00 0.00 34.95 34.16 1lui s ARG 37 CO -0.01 -0.20 1.30 -3.47 -1.08 0.00 0.00 175.30 171.84 1lui n ASP 38 N 4.52 2.26 -3.91 -2.89 -0.08 -1.25 0.43 116.55 115.64 1lui n ASP 38 Ca -0.20 0.90 -0.11 0.00 -1.51 0.00 0.00 54.79 53.87 1lui n ASP 38 Cb 0.52 -1.55 -0.12 0.00 2.34 0.00 0.00 41.12 42.31 1lui n ASP 38 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 1lui s SER 39 N -1.13 0.08 0.00 1.67 0.15 -1.23 -4.70 113.70 108.53 1lui s SER 39 Ca 0.77 -0.19 0.00 0.00 0.70 0.00 0.00 55.95 57.23 1lui s SER 39 Cb -0.40 0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 1lui s SER 39 CO 0.45 -0.19 0.87 0.54 1.20 0.00 0.00 173.24 176.12 1lui n ARG 40 N 2.21 0.00 -0.64 5.44 3.00 -1.26 -4.39 116.66 121.02 1lui n ARG 40 Ca -0.19 0.38 -0.01 0.00 -0.01 0.00 0.00 57.85 58.02 1lui n ARG 40 Cb 0.57 -1.54 0.01 0.00 0.00 0.00 0.00 32.46 31.50 1lui n ARG 40 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.63 175.26 1lui n THR 41 N -1.37 0.00 0.00 0.55 5.66 -1.26 -4.31 114.28 113.54 1lui n THR 41 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1lui n THR 41 Cb 0.04 -0.03 0.00 0.00 -1.55 0.00 0.00 70.33 68.79 1lui n THR 41 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1lui n PRO 42 N 2.36 0.00 0.00 1.09 -0.04 -1.26 -4.28 135.00 132.87 1lui n PRO 42 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1lui n PRO 42 Cb 0.02 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.29 1lui n PRO 42 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1lui n GLY 43 N -0.37 1.52 0.00 0.55 0.00 -1.26 -4.97 105.19 100.66 1lui n GLY 43 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -4.15 2.61 5.66 -1.26 -5.03 114.28 111.35 1lui n THR 44 Ca 0.00 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.90 1lui n THR 44 Cb 0.00 -0.85 -0.10 0.00 -1.55 0.00 0.00 70.33 67.83 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 1.91 0.80 0.12 1.09 1.51 -1.25 -3.58 117.35 117.94 1lui s TYR 45 Ca 0.00 -0.95 -0.01 0.00 -1.01 0.00 0.00 57.07 55.10 1lui s TYR 45 Cb 0.00 -0.48 -0.04 0.00 -0.11 0.00 0.00 41.96 41.32 1lui s TYR 45 CO 0.00 -0.21 0.29 0.99 -1.11 0.00 0.00 175.55 175.51 1lui s THR 46 N -3.70 5.30 -0.21 -0.71 2.01 1.47 0.17 115.64 119.97 1lui s THR 46 Ca 0.11 -0.35 0.00 0.00 0.31 0.00 0.00 61.69 61.76 1lui s THR 46 Cb 0.06 -3.67 0.05 0.00 0.01 0.00 0.00 72.50 68.95 1lui s THR 46 CO -0.06 0.02 -0.06 -0.69 -0.69 0.00 0.00 174.62 173.14 1lui s VAL 47 N -1.65 1.39 -0.12 3.82 1.01 2.39 0.33 120.40 127.57 1lui s VAL 47 Ca 0.37 -0.98 -0.25 0.00 0.00 0.00 0.00 61.98 61.12 1lui s VAL 47 Cb -0.12 -1.60 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 1lui s VAL 47 CO 0.28 0.02 0.82 -0.55 0.00 0.00 0.00 175.10 175.66 1lui s SER 48 N 1.48 7.02 -0.07 3.32 0.15 2.16 0.48 113.70 128.24 1lui s SER 48 Ca -0.03 1.25 -0.01 0.00 0.70 0.00 0.00 55.95 57.86 1lui s SER 48 Cb -0.17 -2.46 0.03 0.00 -1.71 0.00 0.00 66.02 61.71 1lui s SER 48 CO -0.07 -0.30 -0.02 0.68 1.20 0.00 0.00 173.24 174.73 1lui s VAL 49 N 1.61 0.50 -0.01 4.45 -7.23 0.68 0.52 120.40 120.92 1lui s VAL 49 Ca 0.40 0.00 -0.03 0.00 -1.81 0.00 0.00 61.98 60.54 1lui s VAL 49 Cb -0.17 -0.60 0.00 0.00 0.56 0.00 0.00 36.38 36.16 1lui s VAL 49 CO 0.16 0.26 0.07 0.72 -0.31 0.00 0.00 175.10 176.00 1lui s PHE 50 N 1.64 0.02 -0.29 2.82 -0.71 0.52 0.26 117.98 122.24 1lui s PHE 50 Ca 0.00 -0.03 -0.02 0.00 -1.04 0.00 0.00 56.93 55.85 1lui s PHE 50 Cb -0.13 -0.04 0.12 0.00 -1.21 0.00 0.00 43.02 41.77 1lui s PHE 50 CO -0.04 -0.13 0.24 -0.08 -1.34 0.00 0.00 175.22 173.86 1lui s THR 51 N -0.61 -0.29 -0.67 -4.49 -1.32 -0.97 0.54 115.64 107.84 1lui s THR 51 Ca -0.07 -0.56 -0.29 0.00 -1.21 0.00 0.00 61.69 59.56 1lui s THR 51 Cb -0.04 -0.97 -0.17 0.00 -1.51 0.00 0.00 72.50 69.81 1lui s THR 51 CO 0.00 -0.54 2.02 1.17 -2.21 0.00 0.00 174.62 175.06 1lui n LYS 52 N 5.29 0.00 -2.76 7.08 3.00 -1.24 -4.53 118.16 125.00 1lui n LYS 52 Ca -0.04 0.00 0.01 0.00 -0.00 0.00 0.00 58.31 58.29 1lui n LYS 52 Cb 0.45 -1.21 0.01 0.00 0.00 0.00 0.00 35.03 34.28 1lui n LYS 52 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1lui s ALA 53 N 6.43 -4.46 -0.38 3.14 0.00 -1.26 -4.92 121.76 120.31 1lui s ALA 53 Ca 1.05 1.24 0.06 0.00 0.00 0.00 0.00 51.96 54.31 1lui s ALA 53 Cb -1.08 -3.01 0.18 0.00 0.00 0.00 0.00 23.12 19.21 1lui s ALA 53 CO 0.44 -2.50 0.66 0.42 0.00 0.00 0.00 175.76 174.78 1lui s ILE 54 N 1.90 -0.94 -1.52 0.00 1.09 -1.26 -4.78 121.20 115.68 1lui s ILE 54 Ca 0.15 0.00 0.03 0.00 -1.10 0.00 0.00 60.65 59.73 1lui s ILE 54 Cb 0.04 -0.16 0.06 0.00 -1.06 0.00 0.00 42.46 41.33 1lui s ILE 54 CO -0.15 0.00 0.87 -0.38 -0.10 0.00 0.00 174.94 175.18 1lui n ILE 55 N 4.54 0.86 -0.09 2.92 5.41 -1.26 -1.73 119.36 130.01 1lui n ILE 55 Ca 0.10 0.22 -0.09 0.00 1.00 0.00 0.00 62.75 63.97 1lui n ILE 55 Cb 0.57 -1.17 -0.03 0.00 -0.71 0.00 0.00 39.64 38.30 1lui n ILE 55 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1lui n SER 56 N -1.24 1.90 -2.76 4.38 3.41 -1.26 -4.92 113.62 113.13 1lui n SER 56 Ca 0.02 0.43 -0.09 0.00 -0.26 0.00 0.00 58.87 58.97 1lui n SER 56 Cb 0.02 -0.79 0.07 0.00 -0.26 0.00 0.00 64.21 63.25 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 -4.49 0.93 -0.96 4.33 4.07 -1.11 -5.15 120.64 118.25 1lui n GLU 57 Ca -0.15 -1.92 -0.30 0.00 -0.06 0.00 0.00 57.16 54.73 1lui n GLU 57 Cb 0.47 -1.21 0.16 0.00 -0.06 0.00 0.00 31.44 30.80 1lui n GLU 57 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1lui s ASN 58 N -1.45 3.06 0.12 4.31 4.22 -0.71 -4.76 114.94 119.73 1lui s ASN 58 Ca 0.26 1.74 0.00 0.00 -2.14 0.00 0.00 52.86 52.72 1lui s ASN 58 Cb 0.27 -2.36 0.00 0.00 1.28 0.00 0.00 41.25 40.44 1lui s ASN 58 CO -0.12 -2.94 0.00 -0.81 -2.04 0.00 0.00 177.10 171.19 1lui n PRO 59 N -4.10 0.87 -3.66 3.55 -0.04 -1.26 -5.00 135.00 125.35 1lui n PRO 59 Ca 0.08 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.43 1lui n PRO 59 Cb 0.54 0.00 -0.12 0.00 -0.04 0.00 0.00 33.50 33.88 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 2.48 2.21 0.15 0.00 -1.09 -1.26 -2.28 121.20 121.40 1lui s ILE 61 Ca -0.00 -1.46 -0.01 0.00 -2.23 0.00 0.00 60.65 56.95 1lui s ILE 61 Cb -0.12 -2.22 -0.04 0.00 -1.58 0.00 0.00 42.46 38.50 1lui s ILE 61 CO -0.10 0.09 0.33 -0.75 -1.23 0.00 0.00 174.94 173.27 1lui s LYS 62 N 1.15 3.50 -0.32 2.79 2.20 0.72 -4.85 119.74 124.94 1lui s LYS 62 Ca -0.06 -0.37 -0.03 0.00 -0.36 0.00 0.00 55.97 55.16 1lui s LYS 62 Cb -0.18 -2.91 0.06 0.00 -1.51 0.00 0.00 37.83 33.28 1lui s LYS 62 CO -0.06 0.48 0.04 -1.01 -0.36 0.00 0.00 175.35 174.44 1lui s HIS 63 N -1.72 3.31 -0.29 4.03 3.76 -1.25 0.25 115.29 123.37 1lui s HIS 63 Ca 0.37 -1.87 -0.12 0.00 -0.15 0.00 0.00 55.06 53.30 1lui s HIS 63 Cb -0.12 -2.29 -0.04 0.00 1.11 0.00 0.00 32.58 31.24 1lui s HIS 63 CO 0.28 -0.81 0.22 0.71 -0.85 0.00 0.00 174.74 174.28 1lui s TYR 64 N 1.26 3.22 0.16 1.40 1.51 1.75 -4.77 117.35 121.88 1lui s TYR 64 Ca -0.03 0.10 -0.16 0.00 -1.01 0.00 0.00 57.07 55.98 1lui s TYR 64 Cb -0.20 -2.42 -0.07 0.00 -0.11 0.00 0.00 41.96 39.16 1lui s TYR 64 CO -0.01 -0.20 0.59 -1.58 -1.11 0.00 0.00 175.55 173.24 1lui s HIS 65 N 1.79 3.63 -0.54 2.71 2.46 -1.26 0.58 115.29 124.66 1lui s HIS 65 Ca 0.08 1.15 -0.23 0.00 0.47 0.00 0.00 55.06 56.53 1lui s HIS 65 Cb -0.16 -2.43 0.04 0.00 -0.13 0.00 0.00 32.58 29.90 1lui s HIS 65 CO 0.11 0.42 0.88 0.42 -2.47 0.00 0.00 174.74 174.10 1lui s ILE 66 N -1.45 4.48 0.39 0.89 -1.09 0.46 -4.22 121.20 120.66 1lui s ILE 66 Ca 0.38 0.13 -0.26 0.00 -2.23 0.00 0.00 60.65 58.67 1lui s ILE 66 Cb -0.16 -4.49 -0.09 0.00 -1.58 0.00 0.00 42.46 36.14 1lui s ILE 66 CO 0.19 -1.06 1.26 -0.75 -1.23 0.00 0.00 174.94 173.36 1lui s LYS 67 N 3.70 4.06 -0.07 2.79 2.47 2.49 -3.95 119.74 131.23 1lui s LYS 67 Ca 0.27 2.08 0.03 0.00 -1.56 0.00 0.00 55.97 56.79 1lui s LYS 67 Cb -0.14 -2.79 -0.02 0.00 -1.46 0.00 0.00 37.83 33.42 1lui s LYS 67 CO 0.18 -0.39 -0.16 -1.21 0.16 0.00 0.00 175.35 173.93 1lui s GLU 68 N -2.17 2.73 -0.00 4.03 2.02 -1.13 0.43 118.70 124.61 1lui s GLU 68 Ca 0.56 -0.72 0.02 0.00 0.02 0.00 0.00 54.97 54.84 1lui s GLU 68 Cb -0.36 -2.41 -0.01 0.00 0.10 0.00 0.00 34.13 31.45 1lui s GLU 68 CO 0.47 0.49 -0.06 -0.08 0.02 0.00 0.00 175.26 176.10 1lui s THR 69 N -0.38 0.44 -0.05 3.63 -1.32 2.11 -4.85 115.64 115.21 1lui s THR 69 Ca 0.04 -0.28 -0.01 0.00 -1.21 0.00 0.00 61.69 60.23 1lui s THR 69 Cb -0.12 -0.38 -0.03 0.00 -1.51 0.00 0.00 72.50 70.46 1lui s THR 69 CO 0.02 0.10 1.03 -0.46 -2.21 0.00 0.00 174.62 173.10 1lui n ASN 70 N 2.87 0.88 -4.91 8.08 2.04 -1.26 -3.52 115.26 119.44 1lui n ASN 70 Ca -0.13 -1.74 -0.23 0.00 -0.44 0.00 0.00 54.58 52.04 1lui n ASN 70 Cb 0.58 -0.30 0.04 0.00 -2.53 0.00 0.00 39.78 37.56 1lui n ASN 70 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 1lui n ASP 71 N 3.33 2.45 -3.51 0.53 9.92 0.12 -5.02 116.55 124.36 1lui n ASP 71 Ca 0.07 -2.73 0.00 0.00 -0.53 0.00 0.00 54.79 51.61 1lui n ASP 71 Cb 0.11 -0.24 -0.04 0.00 -0.64 0.00 0.00 41.12 40.31 1lui n ASP 71 CO 0.00 0.00 0.00 -0.55 0.13 0.00 0.00 177.20 176.78 1lui s SER 72 N -4.44 -0.78 -0.13 -2.24 0.15 -1.26 -3.77 113.70 101.21 1lui s SER 72 Ca 0.47 1.09 -0.01 0.00 0.70 0.00 0.00 55.95 58.20 1lui s SER 72 Cb -0.04 1.85 0.07 0.00 -1.71 0.00 0.00 66.02 66.20 1lui s SER 72 CO 0.30 -0.15 2.08 -0.81 1.20 0.00 0.00 173.24 175.86 1lui n PRO 73 N 5.04 1.38 -4.36 5.44 -0.04 -1.26 -5.07 135.00 136.13 1lui n PRO 73 Ca -0.11 -0.69 -0.31 0.00 -0.04 0.00 0.00 63.50 62.35 1lui n PRO 73 Cb 0.52 -1.30 -0.10 0.00 -0.04 0.00 0.00 33.50 32.58 1lui n PRO 73 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1lui s LYS 74 N -0.70 2.33 0.19 0.54 3.01 -1.25 -0.20 119.74 123.65 1lui s LYS 74 Ca 0.16 -0.88 0.00 0.00 -1.01 0.00 0.00 55.97 54.23 1lui s LYS 74 Cb 0.11 -2.39 0.00 0.00 -1.01 0.00 0.00 37.83 34.54 1lui s LYS 74 CO -0.01 0.55 0.00 2.89 0.51 0.00 0.00 175.35 179.29 1lui n ARG 75 N 1.12 0.00 -3.19 1.68 1.85 0.12 -0.70 116.66 117.53 1lui n ARG 75 Ca -0.14 0.00 -0.34 0.00 -1.00 0.00 0.00 57.85 56.37 1lui n ARG 75 Cb 0.52 0.00 -0.06 0.00 -1.05 0.00 0.00 32.46 31.87 1lui n ARG 75 CO 0.00 0.00 0.00 0.71 -0.01 0.00 0.00 177.63 178.33 1lui s TYR 76 N -2.00 3.48 -0.23 2.89 2.02 0.75 0.54 117.35 124.80 1lui s TYR 76 Ca 0.00 1.20 -0.32 0.00 -0.37 0.00 0.00 57.07 57.58 1lui s TYR 76 Cb 0.00 -2.50 0.16 0.00 -0.40 0.00 0.00 41.96 39.22 1lui s TYR 76 CO 0.00 0.22 1.25 1.52 -1.57 0.00 0.00 175.55 176.98 1lui s TYR 77 N -1.77 -0.12 -0.54 2.71 1.13 1.47 0.30 117.35 120.54 1lui s TYR 77 Ca 0.48 0.15 0.07 0.00 -1.41 0.00 0.00 57.07 56.36 1lui s TYR 77 Cb -0.13 0.50 0.28 0.00 -1.10 0.00 0.00 41.96 41.51 1lui s TYR 77 CO 0.19 -0.14 0.74 1.33 -2.51 0.00 0.00 175.55 175.16 1lui n VAL 78 N 0.28 1.58 0.00 -3.49 0.24 -1.26 0.59 118.33 116.27 1lui n VAL 78 Ca -0.01 -4.97 0.00 0.00 -2.04 0.00 0.00 64.34 57.32 1lui n VAL 78 Cb 0.58 -1.71 0.00 0.00 -1.47 0.00 0.00 33.84 31.24 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 0.66 0.00 -2.06 2.33 0.00 -1.26 -4.78 120.51 115.40 1lui n ALA 79 Ca 0.28 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.70 1lui n ALA 79 Cb 0.46 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.91 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 -2.37 -4.69 0.00 -0.58 -1.26 -4.74 120.64 107.00 1lui n GLU 80 Ca 0.00 0.01 -0.31 0.00 -0.42 0.00 0.00 57.16 56.44 1lui n GLU 80 Cb 0.00 -3.30 -0.09 0.00 -0.57 0.00 0.00 31.44 27.48 1lui n GLU 80 CO 0.00 0.00 0.00 -1.59 -0.48 0.00 0.00 177.13 175.06 1lui s LYS 81 N -3.76 2.10 0.00 3.49 -2.85 -1.26 -4.95 119.74 112.51 1lui s LYS 81 Ca 0.03 -2.27 0.00 0.00 -1.00 0.00 0.00 55.97 52.73 1lui s LYS 81 Cb -0.02 -1.58 0.00 0.00 -2.06 0.00 0.00 37.83 34.17 1lui s LYS 81 CO 0.04 -0.23 0.00 0.66 0.10 0.00 0.00 175.35 175.92 1lui n TYR 82 N -1.15 0.00 -2.29 1.78 4.02 -1.26 -4.50 117.16 113.76 1lui n TYR 82 Ca -0.13 0.00 -0.31 0.00 -0.01 0.00 0.00 57.90 57.44 1lui n TYR 82 Cb 0.67 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.97 1lui n TYR 82 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1lui s VAL 83 N 0.00 4.62 0.15 -0.72 1.01 -1.26 -4.62 120.40 119.58 1lui s VAL 83 Ca 0.00 1.03 -0.08 0.00 0.00 0.00 0.00 61.98 62.93 1lui s VAL 83 Cb 0.00 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.60 1lui s VAL 83 CO 0.00 -0.82 0.24 -0.36 0.00 0.00 0.00 175.10 174.16 1lui s PHE 84 N -2.77 0.43 -0.47 5.22 0.08 0.89 -4.68 117.98 116.68 1lui s PHE 84 Ca 0.57 -0.81 0.09 0.00 0.12 0.00 0.00 56.93 56.90 1lui s PHE 84 Cb -0.10 -0.12 0.55 0.00 -0.57 0.00 0.00 43.02 42.78 1lui s PHE 84 CO 0.38 -0.67 1.38 -3.47 -0.10 0.00 0.00 175.22 172.74 1lui n ASP 85 N -0.18 4.17 0.00 1.36 -0.08 0.72 0.27 116.55 122.81 1lui n ASP 85 Ca -0.08 -2.68 0.00 0.00 -1.51 0.00 0.00 54.79 50.52 1lui n ASP 85 Cb 0.63 -0.64 0.00 0.00 2.34 0.00 0.00 41.12 43.45 1lui n ASP 85 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1lui n SER 86 N 0.33 0.00 -0.20 1.67 7.64 -1.26 -4.94 113.62 116.86 1lui n SER 86 Ca 0.21 0.00 -0.02 0.00 1.01 0.00 0.00 58.87 60.07 1lui n SER 86 Cb 0.93 0.00 0.08 0.00 -1.01 0.00 0.00 64.21 64.22 1lui n SER 86 CO 0.00 0.00 0.00 0.40 -3.01 0.00 0.00 175.04 172.43 1lui h ILE 87 N 0.28 0.92 -0.49 0.44 5.03 -1.95 0.85 117.51 122.58 1lui h ILE 87 Ca 0.00 -0.19 0.09 0.00 -0.12 0.00 0.00 64.86 64.64 1lui h ILE 87 Cb 0.00 0.32 -0.08 0.00 -3.03 0.00 0.00 36.82 34.03 1lui h ILE 87 CO 0.00 0.10 0.03 1.55 -0.68 0.00 0.00 178.15 179.15 1lui h PRO 88 N 0.55 0.14 0.38 2.37 0.13 -1.95 8.72 132.00 142.33 1lui h PRO 88 Ca 0.27 -0.01 -0.02 0.00 -0.87 0.00 0.00 66.00 65.37 1lui h PRO 88 Cb 0.21 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.31 1lui h PRO 88 CO -0.20 0.09 -0.18 1.37 -0.23 0.00 0.00 178.00 178.85 1lui h LEU 89 N 0.14 -0.43 -1.49 1.56 -0.00 -1.78 6.41 115.31 119.72 1lui h LEU 89 Ca 0.25 -0.12 0.18 0.00 -0.00 0.00 0.00 57.88 58.19 1lui h LEU 89 Cb 0.37 0.11 -0.06 0.00 -0.00 0.00 0.00 40.66 41.08 1lui h LEU 89 CO -0.39 -0.09 0.57 0.25 -0.00 0.00 0.00 178.44 178.77 1lui h LEU 90 N -0.79 0.44 0.08 0.17 6.46 0.18 1.11 115.31 122.96 1lui h LEU 90 Ca -0.05 0.04 -0.12 0.00 -0.12 0.00 0.00 57.88 57.63 1lui h LEU 90 Cb 0.52 -0.05 0.01 0.00 -0.73 0.00 0.00 40.66 40.42 1lui h LEU 90 CO 0.08 0.20 -0.52 0.40 -0.62 0.00 0.00 178.44 177.98 1lui h ILE 91 N 0.45 1.59 -0.92 4.05 1.08 1.93 -2.10 117.51 123.59 1lui h ILE 91 Ca 0.44 -2.40 0.20 0.00 -0.39 0.00 0.00 64.86 62.71 1lui h ILE 91 Cb 1.02 3.18 -0.07 0.00 -3.07 0.00 0.00 36.82 37.87 1lui h ILE 91 CO -0.17 0.66 0.60 1.56 -0.69 0.00 0.00 178.15 180.12 1lui h GLN 92 N -0.54 0.48 -0.00 2.37 1.08 1.56 3.29 115.11 123.33 1lui h GLN 92 Ca -0.09 -0.03 -0.24 0.00 -1.45 0.00 0.00 58.65 56.84 1lui h GLN 92 Cb 1.38 -0.11 0.01 0.00 -0.05 0.00 0.00 27.48 28.71 1lui h GLN 92 CO 0.10 0.32 -0.98 -0.92 -0.95 0.00 0.00 178.83 176.40 1lui h TYR 93 N 0.49 0.80 0.00 2.96 3.20 0.11 -0.25 116.97 124.29 1lui h TYR 93 Ca 0.49 -0.43 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1lui h TYR 93 Cb 1.09 -0.09 -0.00 0.00 1.54 0.00 0.00 36.73 39.27 1lui h TYR 93 CO -0.00 1.26 -0.06 0.45 -1.64 0.00 0.00 178.16 178.16 1lui h HIS 94 N 0.31 0.00 0.00 -3.82 3.86 0.39 -1.79 115.15 114.10 1lui h HIS 94 Ca -0.10 0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.10 1lui h HIS 94 Cb 1.62 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 30.09 1lui h HIS 94 CO 0.08 0.06 -0.65 1.96 0.86 0.00 0.00 177.93 180.24 1lui h GLN 95 N 0.00 0.00 -1.42 2.45 4.20 0.59 1.23 115.11 122.16 1lui h GLN 95 Ca -0.00 0.00 -0.43 0.00 0.06 0.00 0.00 58.65 58.28 1lui h GLN 95 Cb 0.91 0.00 -0.40 0.00 0.30 0.00 0.00 27.48 28.28 1lui h GLN 95 CO 0.01 0.04 -1.14 0.66 -0.67 0.00 0.00 178.83 177.72 1lui n TYR 96 N -2.86 1.10 0.00 2.96 4.02 -0.12 -4.79 117.16 117.47 1lui n TYR 96 Ca 0.01 -3.21 0.00 0.00 -0.01 0.00 0.00 57.90 54.69 1lui n TYR 96 Cb 0.57 -0.38 0.00 0.00 -0.02 0.00 0.00 39.34 39.51 1lui n TYR 96 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14 1lui n ASN 97 N 0.02 0.00 0.00 7.72 2.85 -0.69 -4.84 115.26 120.32 1lui n ASN 97 Ca 0.17 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.64 1lui n ASN 97 Cb 0.74 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.76 1lui n ASN 97 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1lui n GLY 98 N -0.71 -0.79 0.00 8.20 0.00 -1.25 -5.06 105.19 105.58 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 -1.26 -4.06 105.19 99.85 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 0.00 -1.76 1.58 -0.02 0.00 -1.26 -5.09 105.19 98.64 1lui n GLY 100 Ca 0.00 0.76 -0.04 0.00 0.00 0.00 0.00 46.02 46.74 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 -0.18 0.99 4.77 -1.26 -4.97 117.00 116.35 1lui n LEU 101 Ca 0.00 -1.10 0.15 0.00 -0.03 0.00 0.00 56.01 55.03 1lui n LEU 101 Cb 0.00 1.59 0.25 0.00 -2.33 0.00 0.00 43.42 42.92 1lui n LEU 101 CO 0.00 -0.36 0.44 1.33 -1.33 0.00 0.00 177.39 177.48 1lui n VAL 102 N -0.23 -0.07 0.00 4.08 0.24 -1.26 -3.62 118.33 117.47 1lui n VAL 102 Ca -0.03 0.61 0.00 0.00 -2.04 0.00 0.00 64.34 62.88 1lui n VAL 102 Cb 0.25 -1.00 0.00 0.00 -1.47 0.00 0.00 33.84 31.62 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 -3.22 0.00 0.00 3.34 5.66 -1.26 -4.87 114.28 113.93 1lui n THR 103 Ca 0.14 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.14 1lui n THR 103 Cb 0.58 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.36 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 -0.22 1.09 1.85 -1.24 -2.33 116.66 115.80 1lui n ARG 104 Ca 0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 57.85 56.71 1lui n ARG 104 Cb 0.00 0.00 -0.04 0.00 -1.05 0.00 0.00 32.46 31.37 1lui n ARG 104 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1lui n LEU 105 N 0.00 0.28 -0.29 2.89 7.99 0.42 -4.51 117.00 123.78 1lui n LEU 105 Ca 0.00 -1.11 0.06 0.00 -0.01 0.00 0.00 56.01 54.96 1lui n LEU 105 Cb 0.00 -0.45 0.28 0.00 -0.11 0.00 0.00 43.42 43.14 1lui n LEU 105 CO 0.00 -1.43 1.24 -0.09 -1.51 0.00 0.00 177.39 175.60 1lui h ARG 106 N 8.40 0.90 -0.34 3.23 1.12 -1.17 -3.36 114.38 123.15 1lui h ARG 106 Ca 0.08 -0.05 0.20 0.00 -1.11 0.00 0.00 59.98 59.09 1lui h ARG 106 Cb 0.24 -0.20 -0.19 0.00 -0.01 0.00 0.00 29.97 29.80 1lui h ARG 106 CO 1.25 0.59 -0.05 -0.47 -3.11 0.00 0.00 179.97 178.18 1lui s TYR 107 N -5.84 -0.64 0.52 2.20 5.04 -1.16 -4.89 117.35 112.58 1lui s TYR 107 Ca -0.11 0.38 -0.21 0.00 -2.44 0.00 0.00 57.07 54.69 1lui s TYR 107 Cb 0.21 0.11 -0.07 0.00 0.35 0.00 0.00 41.96 42.56 1lui s TYR 107 CO 0.80 -0.37 1.04 -0.35 -1.34 0.00 0.00 175.55 175.32 1lui n PRO 108 N 5.16 1.22 -4.32 4.97 -0.04 -1.23 0.21 135.00 140.96 1lui n PRO 108 Ca 0.08 0.45 -0.19 0.00 -0.04 0.00 0.00 63.50 63.80 1lui n PRO 108 Cb 0.57 -2.18 -0.11 0.00 -0.04 0.00 0.00 33.50 31.74 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 -1.39 1.66 -0.37 0.52 -7.23 3.72 -4.50 120.40 112.81 1lui s VAL 109 Ca 0.70 -2.01 0.01 0.00 -1.81 0.00 0.00 61.98 58.87 1lui s VAL 109 Cb -0.47 -1.87 0.15 0.00 0.56 0.00 0.00 36.38 34.75 1lui s VAL 109 CO 0.52 -0.47 0.26 0.00 -0.31 0.00 0.00 175.10 175.09