#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lz1 s VAL 2 N 0.00 4.61 0.55 3.15 1.01 -1.26 -1.27 120.40 127.19 1lz1 s VAL 2 Ca 0.00 -0.63 -0.19 0.00 0.00 0.00 0.00 61.98 61.16 1lz1 s VAL 2 Cb 0.00 -3.46 -0.05 0.00 0.00 0.00 0.00 36.38 32.86 1lz1 s VAL 2 CO 0.00 -0.09 1.12 -0.36 0.00 0.00 0.00 175.10 175.77 1lz1 s PHE 3 N 1.59 2.69 0.50 5.22 0.08 -0.60 -5.02 117.98 122.44 1lz1 s PHE 3 Ca 0.03 1.55 -0.13 0.00 0.12 0.00 0.00 56.93 58.50 1lz1 s PHE 3 Cb -0.18 -3.26 -0.07 0.00 -0.57 0.00 0.00 43.02 38.94 1lz1 s PHE 3 CO 0.07 -1.53 0.91 -1.21 -0.10 0.00 0.00 175.22 173.36 1lz1 s GLU 4 N -3.36 3.82 0.12 0.44 0.41 -1.26 -4.88 118.70 113.99 1lz1 s GLU 4 Ca 0.72 0.73 -0.21 0.00 -0.41 0.00 0.00 54.97 55.79 1lz1 s GLU 4 Cb -0.23 -2.22 -0.05 0.00 -1.78 0.00 0.00 34.13 29.85 1lz1 s GLU 4 CO 0.28 -0.24 1.70 -0.09 -0.49 0.00 0.00 175.26 176.41 1lz1 h ARG 5 N 0.78 -0.08 0.00 1.61 2.43 -1.96 -0.43 114.38 116.73 1lz1 h ARG 5 Ca -0.46 0.01 -0.09 0.00 -0.81 0.00 0.00 59.98 58.62 1lz1 h ARG 5 Cb 1.19 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.74 1lz1 h ARG 5 CO 0.62 -0.05 -0.42 0.00 -1.51 0.00 0.00 179.97 178.61 1lz1 h GLU 7 N 0.00 0.62 -0.67 0.00 4.81 -1.84 -0.98 114.58 116.51 1lz1 h GLU 7 Ca -0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.16 1lz1 h GLU 7 Cb 1.24 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.46 1lz1 h GLU 7 CO 0.05 0.41 0.32 1.25 -0.73 0.00 0.00 179.01 180.32 1lz1 h LEU 8 N 0.63 0.89 -0.53 1.64 5.85 -0.64 -1.15 115.31 121.99 1lz1 h LEU 8 Ca 0.17 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.75 1lz1 h LEU 8 Cb -0.07 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.71 1lz1 h LEU 8 CO -0.04 0.77 0.31 0.00 -0.34 0.00 0.00 178.44 179.15 1lz1 h ALA 9 N 1.15 0.68 -0.25 1.25 0.00 -0.87 0.21 119.26 121.43 1lz1 h ALA 9 Ca 0.23 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.97 1lz1 h ALA 9 Cb 0.13 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1lz1 h ALA 9 CO -0.03 0.18 -0.26 0.00 0.00 0.00 0.00 179.25 179.14 1lz1 h ARG 10 N 0.72 0.48 -0.14 0.00 3.08 -1.11 -0.64 114.38 116.77 1lz1 h ARG 10 Ca 0.19 -0.19 -0.03 0.00 0.07 0.00 0.00 59.98 60.03 1lz1 h ARG 10 Cb 0.00 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.02 1lz1 h ARG 10 CO -0.03 0.71 -0.01 1.15 -1.07 0.00 0.00 179.97 180.71 1lz1 h THR 11 N 0.43 1.27 -0.69 2.04 2.02 -0.49 -1.10 112.91 116.38 1lz1 h THR 11 Ca 0.06 -0.90 -0.02 0.00 0.77 0.00 0.00 66.41 66.33 1lz1 h THR 11 Cb 0.68 1.58 -0.03 0.00 -1.74 0.00 0.00 68.15 68.64 1lz1 h THR 11 CO 0.05 0.26 0.37 -0.07 0.37 0.00 0.00 175.52 176.50 1lz1 h LEU 12 N -0.02 0.86 -0.54 2.58 3.38 -0.49 -2.09 115.31 118.99 1lz1 h LEU 12 Ca 0.04 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 1lz1 h LEU 12 Cb 0.41 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 1lz1 h LEU 12 CO 0.01 0.71 0.32 0.50 0.09 0.00 0.00 178.44 180.06 1lz1 h LYS 13 N 0.97 0.73 0.00 1.13 3.64 -0.85 -1.57 116.57 120.63 1lz1 h LYS 13 Ca 0.24 -0.07 -0.03 0.00 -1.27 0.00 0.00 60.65 59.53 1lz1 h LYS 13 Cb 0.04 -0.15 -0.00 0.00 -0.41 0.00 0.00 32.23 31.71 1lz1 h LYS 13 CO -0.04 0.54 -0.13 0.07 -2.27 0.00 0.00 179.45 177.62 1lz1 h ARG 14 N 0.72 0.00 -0.27 1.90 0.11 -0.91 -1.30 114.38 114.64 1lz1 h ARG 14 Ca 0.19 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.27 1lz1 h ARG 14 Cb -0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1lz1 h ARG 14 CO -0.04 0.13 0.00 1.28 0.10 0.00 0.00 179.97 181.45 1lz1 n LEU 15 N -3.42 2.00 0.00 0.08 4.77 -0.81 -4.92 117.00 114.69 1lz1 n LEU 15 Ca -0.01 -0.90 0.00 0.00 -0.03 0.00 0.00 56.01 55.07 1lz1 n LEU 15 Cb 0.31 -0.17 0.00 0.00 -2.33 0.00 0.00 43.42 41.22 1lz1 n LEU 15 CO 0.30 0.45 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 1lz1 n GLY 16 N 1.17 0.73 0.13 -0.72 0.00 -0.49 -4.96 105.19 101.04 1lz1 n GLY 16 Ca 0.16 -0.67 0.12 0.00 0.00 0.00 0.00 46.02 45.62 1lz1 n GLY 16 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1lz1 h MET 17 N 0.00 0.00 -6.21 1.61 2.86 -1.46 -3.40 114.93 108.33 1lz1 h MET 17 Ca 0.00 0.00 -0.56 0.00 -2.06 0.00 0.00 59.70 57.08 1lz1 h MET 17 Cb 0.28 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 31.91 1lz1 h MET 17 CO 0.00 0.00 1.29 0.34 1.06 0.00 0.00 176.91 179.60 1lz1 s ASP 18 N -5.36 5.75 0.00 1.22 2.15 -1.26 -2.32 116.67 116.86 1lz1 s ASP 18 Ca 0.02 1.10 0.00 0.00 0.43 0.00 0.00 52.55 54.10 1lz1 s ASP 18 Cb 0.09 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 1lz1 s ASP 18 CO 0.76 -1.85 0.00 0.61 -0.17 0.00 0.00 175.17 174.51 1lz1 n GLY 19 N 5.47 0.74 3.70 2.66 0.00 0.14 -4.88 105.19 113.03 1lz1 n GLY 19 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.82 1lz1 n GLY 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1lz1 s TYR 20 N -2.41 2.58 -1.62 1.61 5.04 -0.98 -1.60 117.35 119.97 1lz1 s TYR 20 Ca 0.00 0.35 -0.18 0.00 -2.44 0.00 0.00 57.07 54.81 1lz1 s TYR 20 Cb 0.00 -4.00 0.15 0.00 0.35 0.00 0.00 41.96 38.47 1lz1 s TYR 20 CO 0.00 -3.92 0.70 0.54 -1.34 0.00 0.00 175.55 171.54 1lz1 n ARG 21 N 5.08 -2.89 -0.84 4.97 5.12 -1.26 -1.66 116.66 125.17 1lz1 n ARG 21 Ca 0.16 0.35 0.00 0.00 -1.93 0.00 0.00 57.85 56.42 1lz1 n ARG 21 Cb 0.39 -5.05 0.00 0.00 -1.16 0.00 0.00 32.46 26.64 1lz1 n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1lz1 n GLY 22 N -1.28 0.69 3.54 -0.13 0.00 -0.63 -5.02 105.19 102.36 1lz1 n GLY 22 Ca 0.07 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.72 1lz1 n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lz1 s ILE 23 N -2.57 4.81 0.66 -0.61 1.01 -0.66 -4.87 121.20 118.97 1lz1 s ILE 23 Ca 0.00 -0.00 -0.15 0.00 0.00 0.00 0.00 60.65 60.50 1lz1 s ILE 23 Cb 0.00 -3.26 0.00 0.00 0.01 0.00 0.00 42.46 39.22 1lz1 s ILE 23 CO 0.00 0.32 1.11 -0.94 0.00 0.00 0.00 174.94 175.43 1lz1 s SER 24 N 1.48 5.08 0.35 3.58 1.04 -1.26 0.26 113.70 124.22 1lz1 s SER 24 Ca 0.06 2.00 0.10 0.00 0.48 0.00 0.00 55.95 58.59 1lz1 s SER 24 Cb -0.15 -2.55 0.85 0.00 0.10 0.00 0.00 66.02 64.27 1lz1 s SER 24 CO 0.06 -1.65 1.82 0.25 0.98 0.00 0.00 173.24 174.70 1lz1 h LEU 25 N -0.02 0.65 -1.29 2.42 5.85 -1.90 -1.30 115.31 119.72 1lz1 h LEU 25 Ca -0.47 0.07 -0.07 0.00 0.84 0.00 0.00 57.88 58.25 1lz1 h LEU 25 Cb 1.25 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1lz1 h LEU 25 CO 0.54 0.26 -0.28 0.00 -0.34 0.00 0.00 178.44 178.62 1lz1 h ALA 26 N 1.62 1.41 -0.27 1.25 0.00 -1.91 0.16 119.26 121.52 1lz1 h ALA 26 Ca 0.52 -0.29 -0.13 0.00 0.00 0.00 0.00 54.91 55.02 1lz1 h ALA 26 Cb 0.95 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 1lz1 h ALA 26 CO -0.28 0.42 -0.32 -0.91 0.00 0.00 0.00 179.25 178.16 1lz1 h ASN 27 N 0.10 0.74 -0.71 0.00 2.35 -1.56 -0.39 115.58 116.12 1lz1 h ASN 27 Ca 0.02 -0.49 -0.01 0.00 -0.55 0.00 0.00 56.30 55.26 1lz1 h ASN 27 Cb 0.56 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.68 1lz1 h ASN 27 CO 0.04 1.09 0.40 -0.50 -1.65 0.00 0.00 177.43 176.81 1lz1 h TRP 28 N 0.42 0.96 -0.58 1.19 4.06 -1.04 -1.60 115.95 119.35 1lz1 h TRP 28 Ca 0.03 -0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.94 1lz1 h TRP 28 Cb 0.90 -0.31 -0.03 0.00 -1.00 0.00 0.00 29.16 28.73 1lz1 h TRP 28 CO 0.08 0.67 0.25 0.52 -3.56 0.00 0.00 178.44 176.40 1lz1 h MET 29 N 0.97 0.86 -0.69 0.49 2.86 -0.84 -0.77 114.93 117.81 1lz1 h MET 29 Ca 0.25 -0.14 -0.04 0.00 -2.06 0.00 0.00 59.70 57.71 1lz1 h MET 29 Cb 0.01 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 31.50 1lz1 h MET 29 CO -0.04 0.72 0.26 0.00 1.06 0.00 0.00 176.91 178.91 1lz1 h LEU 31 N 1.01 -0.14 -0.98 0.00 5.85 -0.87 -2.10 115.31 118.08 1lz1 h LEU 31 Ca 0.23 -0.15 -0.00 0.00 0.84 0.00 0.00 57.88 58.80 1lz1 h LEU 31 Cb 0.22 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 1lz1 h LEU 31 CO -0.02 0.07 0.60 0.00 -0.34 0.00 0.00 178.44 178.76 1lz1 h ALA 32 N 0.49 1.24 0.12 1.25 0.00 -0.92 0.36 119.26 121.81 1lz1 h ALA 32 Ca -0.02 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.81 1lz1 h ALA 32 Cb 0.29 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1lz1 h ALA 32 CO 0.03 0.67 -0.15 -0.22 0.00 0.00 0.00 179.25 179.58 1lz1 h LYS 33 N 1.32 -0.30 0.00 0.00 1.63 -0.72 -1.97 116.57 116.54 1lz1 h LYS 33 Ca 0.35 0.02 -0.06 0.00 -0.85 0.00 0.00 60.65 60.11 1lz1 h LYS 33 Cb -0.09 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.60 1lz1 h LYS 33 CO -0.07 -0.20 -0.35 -1.49 -3.45 0.00 0.00 179.45 173.90 1lz1 h TRP 34 N -0.31 0.00 -0.03 1.91 4.06 -1.10 0.13 115.95 120.61 1lz1 h TRP 34 Ca 0.01 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.84 1lz1 h TRP 34 Cb 0.31 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.48 1lz1 h TRP 34 CO -0.14 0.30 -0.46 0.93 -3.56 0.00 0.00 178.44 175.50 1lz1 h GLU 35 N 0.00 0.36 0.00 0.49 4.39 -0.82 -3.42 114.58 115.58 1lz1 h GLU 35 Ca -0.01 -0.35 0.00 0.00 0.34 0.00 0.00 59.36 59.34 1lz1 h GLU 35 Cb 1.23 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.98 1lz1 h GLU 35 CO 0.04 1.02 0.00 -1.13 -1.16 0.00 0.00 179.01 177.78 1lz1 n SER 36 N -4.32 0.13 -1.30 1.42 3.41 -0.76 -4.84 113.62 107.36 1lz1 n SER 36 Ca -0.10 -0.48 -0.13 0.00 -0.26 0.00 0.00 58.87 57.91 1lz1 n SER 36 Cb 0.60 0.24 -0.02 0.00 -0.26 0.00 0.00 64.21 64.76 1lz1 n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lz1 n GLY 37 N 0.24 0.41 2.33 5.00 0.00 0.03 -2.52 105.19 110.68 1lz1 n GLY 37 Ca 0.00 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.52 1lz1 n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1lz1 n TYR 38 N -3.49 -0.79 -3.93 1.61 0.53 -1.19 -4.81 117.16 105.09 1lz1 n TYR 38 Ca -0.15 0.11 -0.35 0.00 -1.02 0.00 0.00 57.90 56.49 1lz1 n TYR 38 Cb 0.55 -2.89 -0.13 0.00 -1.03 0.00 0.00 39.34 35.83 1lz1 n TYR 38 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 1lz1 s ASN 39 N -2.57 4.67 0.51 7.72 2.47 -1.05 -1.55 114.94 125.14 1lz1 s ASN 39 Ca 0.06 -0.29 0.30 0.00 0.42 0.00 0.00 52.86 53.35 1lz1 s ASN 39 Cb -0.03 -1.81 1.13 0.00 -1.45 0.00 0.00 41.25 39.10 1lz1 s ASN 39 CO 0.08 0.00 1.90 0.71 -3.72 0.00 0.00 177.10 176.07 1lz1 h THR 40 N 5.56 0.16 -0.12 -5.21 1.35 -1.50 -3.01 112.91 110.14 1lz1 h THR 40 Ca -0.39 -0.74 0.00 0.00 -0.55 0.00 0.00 66.41 64.74 1lz1 h THR 40 Cb 1.17 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 69.23 1lz1 h THR 40 CO 0.60 0.06 0.00 0.54 -0.25 0.00 0.00 175.52 176.47 1lz1 n ARG 41 N -3.18 1.94 -1.75 4.72 1.74 -1.26 -4.10 116.66 114.77 1lz1 n ARG 41 Ca 0.01 -1.39 -0.42 0.00 -0.77 0.00 0.00 57.85 55.28 1lz1 n ARG 41 Cb 0.36 -1.46 -0.01 0.00 -1.02 0.00 0.00 32.46 30.34 1lz1 n ARG 41 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lz1 n ALA 42 N 0.64 2.28 -2.98 7.54 0.00 -1.14 -4.79 120.51 122.06 1lz1 n ALA 42 Ca 0.17 0.36 -0.10 0.00 0.00 0.00 0.00 53.44 53.88 1lz1 n ALA 42 Cb 0.43 -2.42 -0.11 0.00 0.00 0.00 0.00 19.45 17.35 1lz1 n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1lz1 s THR 43 N -0.49 0.08 -0.03 0.00 -4.23 -1.26 0.04 115.64 109.75 1lz1 s THR 43 Ca 0.60 -0.70 -0.01 0.00 -1.18 0.00 0.00 61.69 60.39 1lz1 s THR 43 Cb -0.51 -0.25 0.03 0.00 1.34 0.00 0.00 72.50 73.12 1lz1 s THR 43 CO 0.55 -0.39 0.04 0.20 -0.54 0.00 0.00 174.62 174.49 1lz1 s ASN 44 N -1.17 0.72 -0.08 3.99 -0.87 -0.04 -4.97 114.94 112.53 1lz1 s ASN 44 Ca -0.13 0.05 -0.16 0.00 -1.57 0.00 0.00 52.86 51.05 1lz1 s ASN 44 Cb -0.08 -0.13 -0.05 0.00 -0.02 0.00 0.00 41.25 40.98 1lz1 s ASN 44 CO -0.00 -0.20 0.43 -0.47 -2.57 0.00 0.00 177.10 174.28 1lz1 s TYR 45 N 1.70 3.58 -0.63 2.20 6.14 -1.26 -0.05 117.35 129.03 1lz1 s TYR 45 Ca -0.01 0.88 -0.11 0.00 0.64 0.00 0.00 57.07 58.47 1lz1 s TYR 45 Cb -0.12 -2.43 0.16 0.00 0.42 0.00 0.00 41.96 39.99 1lz1 s TYR 45 CO -0.03 0.34 0.53 -0.80 0.64 0.00 0.00 175.55 176.23 1lz1 s ASN 46 N 0.02 6.07 0.34 4.32 0.01 0.38 -4.92 114.94 121.16 1lz1 s ASN 46 Ca 0.24 -2.31 0.02 0.00 -0.71 0.00 0.00 52.86 50.10 1lz1 s ASN 46 Cb -0.15 -2.09 0.60 0.00 0.41 0.00 0.00 41.25 40.02 1lz1 s ASN 46 CO 0.10 -0.63 1.99 0.00 -1.51 0.00 0.00 177.10 177.05 1lz1 h ALA 47 N 8.07 1.51 -0.46 0.60 0.00 -1.96 0.28 119.26 127.30 1lz1 h ALA 47 Ca -0.09 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.82 1lz1 h ALA 47 Cb 1.05 -0.26 -0.09 0.00 0.00 0.00 0.00 17.79 18.49 1lz1 h ALA 47 CO 0.84 0.44 -0.53 0.78 0.00 0.00 0.00 179.25 180.77 1lz1 h GLY 48 N 0.89 -0.90 -0.03 0.00 0.00 -1.95 -3.27 103.07 97.81 1lz1 h GLY 48 Ca 0.23 0.69 0.00 0.00 0.00 0.00 0.00 47.33 48.25 1lz1 h GLY 48 CO -0.05 -0.12 0.00 2.09 0.00 0.00 0.00 176.54 178.46 1lz1 n ASP 49 N -5.38 2.18 -1.57 0.19 5.75 -1.07 -4.99 116.55 111.66 1lz1 n ASP 49 Ca -0.02 -2.47 -0.16 0.00 -0.01 0.00 0.00 54.79 52.13 1lz1 n ASP 49 Cb 0.34 -0.19 -0.03 0.00 -1.03 0.00 0.00 41.12 40.21 1lz1 n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1lz1 n ARG 50 N -0.88 -1.20 -3.90 0.11 1.74 0.96 -4.77 116.66 108.72 1lz1 n ARG 50 Ca 0.07 0.88 -0.22 0.00 -0.77 0.00 0.00 57.85 57.81 1lz1 n ARG 50 Cb 0.42 -5.18 -0.05 0.00 -1.02 0.00 0.00 32.46 26.63 1lz1 n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1lz1 s SER 51 N -2.50 4.99 0.03 0.55 1.04 -1.15 -4.49 113.70 112.17 1lz1 s SER 51 Ca 0.00 -0.66 0.05 0.00 0.48 0.00 0.00 55.95 55.82 1lz1 s SER 51 Cb 0.00 -0.81 -0.02 0.00 0.10 0.00 0.00 66.02 65.29 1lz1 s SER 51 CO 0.00 -0.38 -0.15 -0.89 0.98 0.00 0.00 173.24 172.80 1lz1 s THR 52 N -2.39 1.21 -0.19 2.02 2.01 -1.26 -0.47 115.64 116.57 1lz1 s THR 52 Ca 0.41 -0.93 -0.11 0.00 0.31 0.00 0.00 61.69 61.37 1lz1 s THR 52 Cb -0.04 -1.06 -0.05 0.00 0.01 0.00 0.00 72.50 71.36 1lz1 s THR 52 CO 0.25 0.12 0.17 -1.81 -0.69 0.00 0.00 174.62 172.66 1lz1 s ASP 53 N -0.93 6.27 -0.05 3.53 1.01 0.92 -1.02 116.67 126.40 1lz1 s ASP 53 Ca 0.04 0.30 0.06 0.00 0.71 0.00 0.00 52.55 53.66 1lz1 s ASP 53 Cb -0.07 -2.11 -0.01 0.00 1.01 0.00 0.00 42.92 41.73 1lz1 s ASP 53 CO 0.01 0.17 -0.25 -0.31 0.21 0.00 0.00 175.17 175.00 1lz1 s TYR 54 N 0.33 2.41 0.00 4.23 2.02 -0.07 -0.86 117.35 125.41 1lz1 s TYR 54 Ca 0.10 -0.67 0.00 0.00 -0.37 0.00 0.00 57.07 56.13 1lz1 s TYR 54 Cb -0.11 -1.58 0.00 0.00 -0.40 0.00 0.00 41.96 39.87 1lz1 s TYR 54 CO -0.00 -0.18 0.00 0.41 -1.57 0.00 0.00 175.55 174.20 1lz1 n GLY 55 N 2.85 -1.99 0.25 0.71 0.00 0.11 -1.74 105.19 105.38 1lz1 n GLY 55 Ca -0.17 -1.46 0.11 0.00 0.00 0.00 0.00 46.02 44.49 1lz1 n GLY 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1lz1 h ILE 56 N 0.00 0.71 -0.24 -0.61 2.10 -1.71 -0.93 117.51 116.82 1lz1 h ILE 56 Ca 0.00 -0.59 0.00 0.00 1.08 0.00 0.00 64.86 65.35 1lz1 h ILE 56 Cb 0.00 1.36 0.00 0.00 -1.09 0.00 0.00 36.82 37.09 1lz1 h ILE 56 CO 0.00 0.14 0.00 0.49 -1.08 0.00 0.00 178.15 177.70 1lz1 n PHE 57 N -3.79 0.30 -3.64 2.19 0.99 -1.26 -4.05 117.46 108.21 1lz1 n PHE 57 Ca -0.02 -0.20 -0.25 0.00 -0.00 0.00 0.00 57.45 56.98 1lz1 n PHE 57 Cb 0.25 -0.01 0.04 0.00 -1.00 0.00 0.00 39.48 38.76 1lz1 n PHE 57 CO 0.00 0.00 0.00 1.04 -0.00 0.00 0.00 176.76 177.80 1lz1 n GLN 58 N 1.06 -2.69 -2.92 -1.08 1.13 -0.35 -4.92 117.38 107.60 1lz1 n GLN 58 Ca 0.14 0.57 -0.40 0.00 -1.94 0.00 0.00 57.00 55.37 1lz1 n GLN 58 Cb 0.48 -4.77 -0.05 0.00 0.11 0.00 0.00 30.24 26.01 1lz1 n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1lz1 s ILE 59 N -3.56 4.47 0.12 5.09 1.01 -0.71 -4.47 121.20 123.16 1lz1 s ILE 59 Ca 0.29 1.78 -0.13 0.00 0.00 0.00 0.00 60.65 62.58 1lz1 s ILE 59 Cb -0.09 -4.18 -0.07 0.00 0.01 0.00 0.00 42.46 38.14 1lz1 s ILE 59 CO 0.83 0.44 0.50 0.21 0.00 0.00 0.00 174.94 176.92 1lz1 s ASN 60 N -0.64 6.78 0.00 3.58 3.84 -1.26 -0.90 114.94 126.35 1lz1 s ASN 60 Ca 0.39 1.00 0.29 0.00 0.21 0.00 0.00 52.86 54.75 1lz1 s ASN 60 Cb -0.23 -2.26 1.24 0.00 -0.55 0.00 0.00 41.25 39.46 1lz1 s ASN 60 CO 0.26 0.13 1.88 -1.54 -2.79 0.00 0.00 177.10 175.05 1lz1 n SER 61 N 0.89 0.25 0.07 -4.21 3.41 -0.19 -1.84 113.62 111.99 1lz1 n SER 61 Ca -0.06 -0.20 -0.20 0.00 -0.26 0.00 0.00 58.87 58.14 1lz1 n SER 61 Cb 0.52 -0.19 -0.11 0.00 -0.26 0.00 0.00 64.21 64.18 1lz1 n SER 61 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1lz1 h ARG 62 N 0.23 0.61 0.00 4.33 2.43 -1.84 -3.41 114.38 116.73 1lz1 h ARG 62 Ca 0.00 -0.73 -0.26 0.00 -0.81 0.00 0.00 59.98 58.19 1lz1 h ARG 62 Cb 0.38 0.22 -0.05 0.00 -0.42 0.00 0.00 29.97 30.10 1lz1 h ARG 62 CO 0.00 1.31 -1.97 0.66 -1.51 0.00 0.00 179.97 178.46 1lz1 n TYR 63 N -3.80 0.00 -0.05 2.20 4.02 -1.20 -0.03 117.16 118.30 1lz1 n TYR 63 Ca -0.11 0.00 -0.06 0.00 -0.01 0.00 0.00 57.90 57.71 1lz1 n TYR 63 Cb 0.92 -0.68 -0.05 0.00 -0.02 0.00 0.00 39.34 39.51 1lz1 n TYR 63 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 1lz1 n TRP 64 N -2.67 0.00 -4.26 -0.72 7.02 -0.76 -1.27 117.44 114.78 1lz1 n TRP 64 Ca -0.25 0.00 -0.17 0.00 -1.02 0.00 0.00 57.50 56.05 1lz1 n TRP 64 Cb 0.91 -0.40 -0.11 0.00 -2.42 0.00 0.00 31.31 29.30 1lz1 n TRP 64 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1lz1 s ASN 66 N -2.70 6.35 0.00 0.00 2.47 0.01 -4.39 114.94 116.68 1lz1 s ASN 66 Ca 0.12 0.41 0.02 0.00 0.42 0.00 0.00 52.86 53.83 1lz1 s ASN 66 Cb -0.03 -2.16 0.01 0.00 -1.45 0.00 0.00 41.25 37.62 1lz1 s ASN 66 CO 0.03 0.09 0.55 -0.90 -3.72 0.00 0.00 177.10 173.15 1lz1 n ASP 67 N 3.78 1.14 0.00 -4.21 5.68 -1.26 -1.13 116.55 120.54 1lz1 n ASP 67 Ca -0.12 -1.07 0.00 0.00 -0.50 0.00 0.00 54.79 53.10 1lz1 n ASP 67 Cb 0.52 0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1lz1 n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lz1 n GLY 68 N 0.11 2.90 0.11 6.12 0.00 -1.26 -4.76 105.19 108.40 1lz1 n GLY 68 Ca 0.01 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.12 1lz1 n GLY 68 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1lz1 n LYS 69 N -1.41 1.18 -3.55 1.61 4.01 -1.26 -4.96 118.16 113.77 1lz1 n LYS 69 Ca 0.00 -2.44 -0.39 0.00 -0.51 0.00 0.00 58.31 54.97 1lz1 n LYS 69 Cb 0.00 -1.41 -0.11 0.00 -0.51 0.00 0.00 35.03 33.00 1lz1 n LYS 69 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 1lz1 s THR 70 N -2.63 5.29 0.50 -0.18 2.01 -1.26 -4.96 115.64 114.41 1lz1 s THR 70 Ca 0.29 0.01 -0.21 0.00 0.31 0.00 0.00 61.69 62.09 1lz1 s THR 70 Cb 0.26 -3.62 -0.06 0.00 0.01 0.00 0.00 72.50 69.08 1lz1 s THR 70 CO 0.03 0.13 1.16 -2.16 -0.69 0.00 0.00 174.62 173.09 1lz1 s PRO 71 N 1.76 3.52 0.00 4.92 0.04 -1.26 -2.33 135.00 141.65 1lz1 s PRO 71 Ca 0.07 1.74 0.00 0.00 0.04 0.00 0.00 61.00 62.85 1lz1 s PRO 71 Cb -0.17 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.16 1lz1 s PRO 71 CO 0.11 -0.74 0.00 0.41 0.04 0.00 0.00 177.00 176.82 1lz1 n GLY 72 N 0.36 0.66 3.67 0.56 0.00 -1.26 -4.93 105.19 104.25 1lz1 n GLY 72 Ca 0.09 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.67 1lz1 n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lz1 n ALA 73 N 1.00 1.15 -0.07 4.61 0.00 -0.98 -4.81 120.51 121.41 1lz1 n ALA 73 Ca 0.00 0.41 -0.04 0.00 0.00 0.00 0.00 53.44 53.81 1lz1 n ALA 73 Cb 0.03 -2.28 -0.14 0.00 0.00 0.00 0.00 19.45 17.06 1lz1 n ALA 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.50 177.78 1lz1 n VAL 74 N 1.89 0.87 -3.89 0.00 0.31 0.95 -5.01 118.33 113.46 1lz1 n VAL 74 Ca 0.11 -0.66 -0.27 0.00 -0.01 0.00 0.00 64.34 63.52 1lz1 n VAL 74 Cb 0.32 -0.37 -0.00 0.00 -0.91 0.00 0.00 33.84 32.88 1lz1 n VAL 74 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1lz1 n ASN 75 N -2.51 -1.32 0.26 4.52 5.15 -1.16 -4.90 115.26 115.30 1lz1 n ASN 75 Ca -0.22 -1.00 0.13 0.00 -0.60 0.00 0.00 54.58 52.89 1lz1 n ASN 75 Cb 0.91 -3.16 0.70 0.00 -0.53 0.00 0.00 39.78 37.70 1lz1 n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1lz1 h ALA 76 N 0.85 1.22 -0.00 5.20 0.00 -1.07 -0.75 119.26 124.71 1lz1 h ALA 76 Ca -0.64 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.16 1lz1 h ALA 76 Cb 1.37 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.14 1lz1 h ALA 76 CO 0.59 0.16 -0.19 0.00 0.00 0.00 0.00 179.25 179.81 1lz1 n HIS 78 N -1.25 -1.85 -4.12 0.00 -0.00 -0.29 -4.98 115.22 102.74 1lz1 n HIS 78 Ca 0.10 0.71 -0.15 0.00 -0.00 0.00 0.00 57.72 58.38 1lz1 n HIS 78 Cb 0.31 -3.93 -0.13 0.00 -0.00 0.00 0.00 29.99 26.24 1lz1 n HIS 78 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1lz1 s LEU 79 N -6.66 2.09 0.37 2.41 1.43 -1.26 -5.07 118.68 112.00 1lz1 s LEU 79 Ca 0.15 -0.24 -0.27 0.00 -1.03 0.00 0.00 54.13 52.73 1lz1 s LEU 79 Cb -0.05 -0.22 -0.10 0.00 0.03 0.00 0.00 46.19 45.85 1lz1 s LEU 79 CO 0.85 -0.03 1.35 -0.55 0.23 0.00 0.00 176.35 178.20 1lz1 s SER 80 N -0.59 6.47 0.50 2.29 0.15 -1.26 -0.81 113.70 120.45 1lz1 s SER 80 Ca -0.02 2.77 0.28 0.00 0.70 0.00 0.00 55.95 59.68 1lz1 s SER 80 Cb -0.05 -2.65 1.31 0.00 -1.71 0.00 0.00 66.02 62.92 1lz1 s SER 80 CO -0.00 -0.76 1.99 0.00 1.20 0.00 0.00 173.24 175.68 1lz1 h SER 82 N 0.00 0.00 0.58 0.00 4.64 -1.90 -1.76 113.55 115.10 1lz1 h SER 82 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1lz1 h SER 82 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1lz1 h SER 82 CO 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.98 1lz1 n ALA 83 N -2.01 1.55 0.32 5.18 0.00 -0.32 -1.72 120.51 123.52 1lz1 n ALA 83 Ca -0.01 0.08 0.08 0.00 0.00 0.00 0.00 53.44 53.60 1lz1 n ALA 83 Cb 0.18 -1.35 0.23 0.00 0.00 0.00 0.00 19.45 18.52 1lz1 n ALA 83 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1lz1 n LEU 84 N -2.12 2.82 -0.19 0.00 4.77 -0.66 -3.47 117.00 118.14 1lz1 n LEU 84 Ca 0.02 -1.41 0.03 0.00 -0.03 0.00 0.00 56.01 54.62 1lz1 n LEU 84 Cb 0.19 -0.35 0.07 0.00 -2.33 0.00 0.00 43.42 41.00 1lz1 n LEU 84 CO 0.17 0.71 0.55 0.18 -1.33 0.00 0.00 177.39 177.66 1lz1 n LEU 85 N 1.04 2.36 -4.85 2.23 4.77 -0.70 -3.58 117.00 118.27 1lz1 n LEU 85 Ca 0.18 -2.27 -0.31 0.00 -0.03 0.00 0.00 56.01 53.58 1lz1 n LEU 85 Cb 0.44 -0.16 0.03 0.00 -2.33 0.00 0.00 43.42 41.41 1lz1 n LEU 85 CO 0.12 0.59 0.72 -1.10 -1.33 0.00 0.00 177.39 176.39 1lz1 s GLN 86 N -1.47 3.24 0.18 3.23 -0.21 -1.23 -4.63 119.66 118.77 1lz1 s GLN 86 Ca 0.13 0.77 0.07 0.00 0.02 0.00 0.00 55.36 56.35 1lz1 s GLN 86 Cb 0.10 -2.04 0.02 0.00 1.00 0.00 0.00 33.01 32.09 1lz1 s GLN 86 CO 0.04 -0.84 1.41 -0.44 -2.12 0.00 0.00 175.29 173.34 1lz1 h ASP 87 N -0.52 0.07 -2.98 5.90 5.19 -1.92 -3.41 116.42 118.74 1lz1 h ASP 87 Ca -0.44 -0.06 -0.57 0.00 -0.62 0.00 0.00 57.03 55.34 1lz1 h ASP 87 Cb 1.21 -0.02 -0.05 0.00 0.18 0.00 0.00 39.33 40.65 1lz1 h ASP 87 CO 0.61 0.88 0.89 0.21 -3.12 0.00 0.00 179.24 178.71 1lz1 s ASN 88 N -6.81 6.94 -0.05 6.45 3.84 -1.26 -4.86 114.94 119.19 1lz1 s ASN 88 Ca -0.01 1.55 0.17 0.00 0.21 0.00 0.00 52.86 54.79 1lz1 s ASN 88 Cb 0.11 -2.54 0.58 0.00 -0.55 0.00 0.00 41.25 38.85 1lz1 s ASN 88 CO 0.80 -0.79 1.47 2.30 -2.79 0.00 0.00 177.10 178.10 1lz1 n ILE 89 N 5.49 1.17 -0.23 -5.21 -5.35 -1.26 -4.52 119.36 109.45 1lz1 n ILE 89 Ca 0.14 -0.90 -0.01 0.00 -0.27 0.00 0.00 62.75 61.71 1lz1 n ILE 89 Cb 0.45 0.24 0.11 0.00 -1.74 0.00 0.00 39.64 38.70 1lz1 n ILE 89 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1lz1 h ALA 90 N 4.02 0.89 -0.32 -1.28 0.00 -1.94 0.32 119.26 120.95 1lz1 h ALA 90 Ca 0.00 0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.80 1lz1 h ALA 90 Cb 1.04 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 1lz1 h ALA 90 CO 0.10 -0.02 -0.38 -0.44 0.00 0.00 0.00 179.25 178.51 1lz1 h ASP 91 N 0.61 0.79 -0.55 0.00 3.45 -1.86 -1.09 116.42 117.77 1lz1 h ASP 91 Ca 0.31 -0.35 0.04 0.00 0.43 0.00 0.00 57.03 57.47 1lz1 h ASP 91 Cb 0.26 -0.22 -0.04 0.00 -0.56 0.00 0.00 39.33 38.77 1lz1 h ASP 91 CO -0.22 1.08 0.30 0.00 -1.57 0.00 0.00 179.24 178.83 1lz1 h ALA 92 N 0.96 0.71 -0.50 3.45 0.00 -1.65 -1.28 119.26 120.96 1lz1 h ALA 92 Ca 0.05 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.88 1lz1 h ALA 92 Cb 0.92 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 1lz1 h ALA 92 CO 0.08 -0.03 -0.08 0.28 0.00 0.00 0.00 179.25 179.50 1lz1 h VAL 93 N 0.57 1.26 -0.88 0.00 2.07 -0.80 0.73 116.25 119.21 1lz1 h VAL 93 Ca 0.24 -1.18 -0.00 0.00 0.82 0.00 0.00 66.70 66.57 1lz1 h VAL 93 Cb 0.12 0.96 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1lz1 h VAL 93 CO -0.15 0.41 0.53 0.00 0.02 0.00 0.00 177.57 178.39 1lz1 h ALA 94 N 1.09 1.29 0.02 1.67 0.00 -0.78 -0.56 119.26 121.98 1lz1 h ALA 94 Ca 0.14 -0.09 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 1lz1 h ALA 94 Cb 0.60 -0.35 0.02 0.00 0.00 0.00 0.00 17.79 18.05 1lz1 h ALA 94 CO 0.04 0.62 -0.82 0.00 0.00 0.00 0.00 179.25 179.09 1lz1 h ALA 96 N 0.32 1.48 -0.71 0.00 0.00 -0.52 -0.48 119.26 119.35 1lz1 h ALA 96 Ca -0.11 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1lz1 h ALA 96 Cb 1.52 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.99 1lz1 h ALA 96 CO 0.16 0.38 0.39 0.87 0.00 0.00 0.00 179.25 181.05 1lz1 h LYS 97 N 1.08 0.99 -0.51 0.00 1.57 -1.00 -2.61 116.57 116.09 1lz1 h LYS 97 Ca 0.41 -0.11 0.01 0.00 -1.87 0.00 0.00 60.65 59.09 1lz1 h LYS 97 Cb 0.21 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 32.29 1lz1 h LYS 97 CO -0.16 0.74 0.33 -0.09 -0.57 0.00 0.00 179.45 179.69 1lz1 h ARG 98 N 0.98 0.65 -0.54 3.15 9.65 -0.66 -2.52 114.38 125.08 1lz1 h ARG 98 Ca 0.25 -0.04 0.04 0.00 -1.10 0.00 0.00 59.98 59.13 1lz1 h ARG 98 Cb 0.03 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.42 1lz1 h ARG 98 CO -0.04 0.43 0.30 0.28 2.80 0.00 0.00 179.97 183.73 1lz1 h VAL 99 N 0.67 0.99 -0.01 0.20 2.07 -0.77 -2.11 116.25 117.28 1lz1 h VAL 99 Ca 0.19 -0.20 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1lz1 h VAL 99 Cb -0.05 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 30.08 1lz1 h VAL 99 CO -0.06 0.11 -0.00 1.33 0.02 0.00 0.00 177.57 178.97 1lz1 n VAL 100 N -4.83 0.00 0.72 2.57 0.24 -1.02 -2.40 118.33 113.60 1lz1 n VAL 100 Ca 0.05 -0.10 0.12 0.00 -2.04 0.00 0.00 64.34 62.38 1lz1 n VAL 100 Cb 0.12 -0.11 0.49 0.00 -1.47 0.00 0.00 33.84 32.87 1lz1 n VAL 100 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1lz1 n ARG 101 N -0.56 0.11 -1.68 7.34 1.74 -0.79 -4.20 116.66 118.62 1lz1 n ARG 101 Ca 0.22 0.16 -0.31 0.00 -0.77 0.00 0.00 57.85 57.15 1lz1 n ARG 101 Cb 0.21 -1.65 0.04 0.00 -1.02 0.00 0.00 32.46 30.03 1lz1 n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1lz1 s ASP 102 N -3.68 5.68 0.34 0.55 -0.00 -1.01 -4.96 116.67 113.60 1lz1 s ASP 102 Ca 0.11 1.55 0.03 0.00 -0.00 0.00 0.00 52.55 54.24 1lz1 s ASP 102 Cb 0.14 -2.49 0.65 0.00 -0.00 0.00 0.00 42.92 41.22 1lz1 s ASP 102 CO 0.50 -1.24 1.96 -0.65 -0.00 0.00 0.00 175.17 175.73 1lz1 h PRO 103 N -0.56 0.84 0.00 8.23 0.11 -1.88 -1.51 132.00 137.22 1lz1 h PRO 103 Ca -0.44 -0.05 -0.01 0.00 0.11 0.00 0.00 66.00 65.61 1lz1 h PRO 103 Cb 1.20 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.12 1lz1 h PRO 103 CO 0.59 0.56 -0.07 1.96 -0.21 0.00 0.00 178.00 180.83 1lz1 h GLN 104 N 0.87 0.00 0.00 1.05 4.20 -1.91 -3.48 115.11 115.84 1lz1 h GLN 104 Ca 0.32 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.03 1lz1 h GLN 104 Cb 0.16 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.94 1lz1 h GLN 104 CO -0.10 0.07 0.00 0.41 -0.67 0.00 0.00 178.83 178.53 1lz1 n GLY 105 N -1.14 1.23 0.24 3.46 0.00 -0.57 -2.50 105.19 105.91 1lz1 n GLY 105 Ca -0.03 -0.70 0.16 0.00 0.00 0.00 0.00 46.02 45.46 1lz1 n GLY 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1lz1 h ILE 106 N 0.00 0.00 0.00 -0.61 2.10 -1.91 -2.75 117.51 114.34 1lz1 h ILE 106 Ca 0.00 -0.48 0.00 0.00 1.08 0.00 0.00 64.86 65.46 1lz1 h ILE 106 Cb 0.00 1.43 0.00 0.00 -1.09 0.00 0.00 36.82 37.16 1lz1 h ILE 106 CO 0.00 0.00 0.08 0.54 -1.08 0.00 0.00 178.15 177.69 1lz1 n ARG 107 N -2.90 0.05 0.29 2.19 1.74 -1.04 -2.04 116.66 114.95 1lz1 n ARG 107 Ca 0.01 0.50 0.16 0.00 -0.77 0.00 0.00 57.85 57.75 1lz1 n ARG 107 Cb 0.31 -1.74 0.89 0.00 -1.02 0.00 0.00 32.46 30.90 1lz1 n ARG 107 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lz1 h ALA 108 N 1.72 1.28 -2.74 7.54 0.00 -1.65 -3.38 119.26 122.02 1lz1 h ALA 108 Ca 0.00 -0.05 -0.68 0.00 0.00 0.00 0.00 54.91 54.18 1lz1 h ALA 108 Cb 0.17 -0.01 -0.20 0.00 0.00 0.00 0.00 17.79 17.75 1lz1 h ALA 108 CO 0.00 0.06 -0.49 -1.58 0.00 0.00 0.00 179.25 177.24 1lz1 s TRP 109 N -4.28 3.22 0.45 0.00 0.51 -0.87 -4.97 118.94 112.99 1lz1 s TRP 109 Ca -0.04 -0.33 0.15 0.00 -2.12 0.00 0.00 56.10 53.76 1lz1 s TRP 109 Cb 0.13 -2.45 1.01 0.00 -0.81 0.00 0.00 33.47 31.35 1lz1 s TRP 109 CO 0.53 -0.40 1.99 0.28 -0.51 0.00 0.00 176.95 178.84 1lz1 h VAL 110 N 5.55 1.11 -0.92 4.03 2.07 -1.88 0.69 116.25 126.91 1lz1 h VAL 110 Ca -0.31 -0.63 0.15 0.00 0.82 0.00 0.00 66.70 66.73 1lz1 h VAL 110 Cb 1.15 1.34 -0.08 0.00 -1.52 0.00 0.00 31.29 32.19 1lz1 h VAL 110 CO 0.64 0.18 0.59 0.00 0.02 0.00 0.00 177.57 178.99 1lz1 h ALA 111 N 1.82 1.78 -0.53 1.67 0.00 -1.93 0.14 119.26 122.20 1lz1 h ALA 111 Ca -0.00 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1lz1 h ALA 111 Cb 0.33 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.96 1lz1 h ALA 111 CO 0.02 -0.04 0.16 2.35 0.00 0.00 0.00 179.25 181.74 1lz1 h TRP 112 N 0.74 0.85 -0.52 0.00 7.01 -1.15 0.18 115.95 123.06 1lz1 h TRP 112 Ca 0.47 -0.09 -0.08 0.00 2.11 0.00 0.00 58.89 61.30 1lz1 h TRP 112 Cb 0.72 -0.25 -0.02 0.00 -2.10 0.00 0.00 29.16 27.52 1lz1 h TRP 112 CO -0.00 0.73 -0.01 0.00 -2.79 0.00 0.00 178.44 176.37 1lz1 h ARG 113 N 0.73 0.91 -0.28 2.65 3.08 -1.13 0.15 114.38 120.49 1lz1 h ARG 113 Ca 0.17 -0.29 -0.16 0.00 0.07 0.00 0.00 59.98 59.77 1lz1 h ARG 113 Cb 0.28 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1lz1 h ARG 113 CO -0.00 0.94 -0.46 -0.91 -1.07 0.00 0.00 179.97 178.47 1lz1 h ASN 114 N 0.78 0.78 -0.00 7.04 2.35 -0.72 -3.34 115.58 122.46 1lz1 h ASN 114 Ca 0.15 -0.38 0.00 0.00 -0.55 0.00 0.00 56.30 55.52 1lz1 h ASN 114 Cb 0.53 -0.22 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1lz1 h ASN 114 CO 0.03 1.12 -0.21 0.54 -1.65 0.00 0.00 177.43 177.25 1lz1 n ARG 115 N -4.02 2.97 0.00 0.81 5.12 0.04 -4.85 116.66 116.74 1lz1 n ARG 115 Ca -0.03 -0.36 0.00 0.00 -1.93 0.00 0.00 57.85 55.53 1lz1 n ARG 115 Cb 0.56 -0.96 0.00 0.00 -1.16 0.00 0.00 32.46 30.91 1lz1 n ARG 115 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1lz1 n GLN 117 N -1.98 2.37 -3.96 0.00 7.27 0.17 -2.53 117.38 118.72 1lz1 n GLN 117 Ca 0.00 0.84 -0.32 0.00 0.07 0.00 0.00 57.00 57.59 1lz1 n GLN 117 Cb 0.21 -2.55 -0.01 0.00 2.41 0.00 0.00 30.24 30.30 1lz1 n GLN 117 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 1lz1 n ASN 118 N 2.01 -3.92 -4.38 1.69 5.03 -1.26 -4.97 115.26 109.47 1lz1 n ASN 118 Ca 0.09 -0.82 -0.19 0.00 0.87 0.00 0.00 54.58 54.54 1lz1 n ASN 118 Cb 0.34 -3.18 -0.10 0.00 -1.02 0.00 0.00 39.78 35.82 1lz1 n ASN 118 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1lz1 s ARG 119 N -6.66 1.42 -0.39 3.52 0.52 -1.05 -5.10 118.95 111.21 1lz1 s ARG 119 Ca 0.66 -1.69 -0.29 0.00 -0.52 0.00 0.00 55.73 53.89 1lz1 s ARG 119 Cb -0.35 -1.02 0.01 0.00 0.52 0.00 0.00 34.95 34.10 1lz1 s ARG 119 CO 0.81 0.06 1.44 0.34 0.02 0.00 0.00 175.30 177.97 1lz1 s ASP 120 N -3.37 6.33 -0.03 0.23 2.15 -1.26 -4.87 116.67 115.85 1lz1 s ASP 120 Ca 0.26 0.93 0.13 0.00 0.43 0.00 0.00 52.55 54.30 1lz1 s ASP 120 Cb 0.03 -2.54 0.39 0.00 -0.30 0.00 0.00 42.92 40.49 1lz1 s ASP 120 CO 0.09 -1.42 1.32 1.33 -0.17 0.00 0.00 175.17 176.33 1lz1 n VAL 121 N 7.00 1.22 0.19 1.11 0.24 -1.26 -4.64 118.33 122.18 1lz1 n VAL 121 Ca 0.17 -1.13 0.08 0.00 -2.04 0.00 0.00 64.34 61.42 1lz1 n VAL 121 Cb 0.48 0.38 0.61 0.00 -1.47 0.00 0.00 33.84 33.83 1lz1 n VAL 121 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1lz1 h ARG 122 N 2.30 0.10 -0.26 7.34 3.08 -1.92 -1.87 114.38 123.14 1lz1 h ARG 122 Ca 0.00 -0.01 0.08 0.00 0.07 0.00 0.00 59.98 60.12 1lz1 h ARG 122 Cb 0.89 -0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.90 1lz1 h ARG 122 CO 0.04 0.06 0.21 -0.56 -1.07 0.00 0.00 179.97 178.66 1lz1 h GLN 123 N 0.10 0.00 0.00 0.04 3.07 -1.98 -1.82 115.11 114.52 1lz1 h GLN 123 Ca 0.05 0.00 -0.06 0.00 0.09 0.00 0.00 58.65 58.73 1lz1 h GLN 123 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.63 1lz1 h GLN 123 CO -0.01 0.00 -0.31 1.88 0.09 0.00 0.00 178.83 180.49 1lz1 h TYR 124 N 0.00 0.00 -0.01 0.06 0.05 -1.67 -3.22 116.97 112.18 1lz1 h TYR 124 Ca 0.12 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.90 1lz1 h TYR 124 Cb 0.55 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.29 1lz1 h TYR 124 CO 0.00 0.31 -0.17 1.33 -1.05 0.00 0.00 178.16 178.58 1lz1 n VAL 125 N -3.59 0.00 -1.68 -2.88 0.24 -0.72 -4.87 118.33 104.82 1lz1 n VAL 125 Ca -0.01 -0.42 -0.45 0.00 -2.04 0.00 0.00 64.34 61.43 1lz1 n VAL 125 Cb 0.44 1.18 -0.04 0.00 -1.47 0.00 0.00 33.84 33.95 1lz1 n VAL 125 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lz1 n GLN 126 N 0.09 2.38 -0.31 7.34 1.13 -0.99 -2.40 117.38 124.62 1lz1 n GLN 126 Ca 0.06 0.86 0.00 0.00 -1.94 0.00 0.00 57.00 55.98 1lz1 n GLN 126 Cb 0.28 -2.67 0.00 0.00 0.11 0.00 0.00 30.24 27.95 1lz1 n GLN 126 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1lz1 n GLY 127 N 3.78 1.15 0.16 1.08 0.00 -1.26 -4.93 105.19 105.17 1lz1 n GLY 127 Ca 0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.33 1lz1 n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lz1 n GLY 129 N 1.34 0.38 0.64 0.00 0.00 -1.26 -4.82 105.19 101.47 1lz1 n GLY 129 Ca 0.12 -0.90 0.08 0.00 0.00 0.00 0.00 46.02 45.33 1lz1 n GLY 129 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65