#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lhl s VAL 2 N 0.00 4.13 0.63 3.15 1.01 -1.26 -1.14 120.40 126.91 1lhl s VAL 2 Ca 0.00 -1.10 -0.15 0.00 0.00 0.00 0.00 61.98 60.73 1lhl s VAL 2 Cb 0.00 -3.37 -0.02 0.00 0.00 0.00 0.00 36.38 32.99 1lhl s VAL 2 CO 0.00 -0.27 1.07 -0.36 0.00 0.00 0.00 175.10 175.55 1lhl s PHE 3 N 1.45 2.89 0.30 5.22 0.08 -0.34 -5.02 117.98 122.57 1lhl s PHE 3 Ca 0.01 1.51 -0.10 0.00 0.12 0.00 0.00 56.93 58.47 1lhl s PHE 3 Cb -0.20 -3.04 -0.07 0.00 -0.57 0.00 0.00 43.02 39.15 1lhl s PHE 3 CO 0.04 -1.30 0.63 -1.21 -0.10 0.00 0.00 175.22 173.28 1lhl s GLU 4 N -4.21 3.79 0.09 0.44 0.41 -1.26 -4.86 118.70 113.09 1lhl s GLU 4 Ca 0.64 0.32 -0.24 0.00 -0.41 0.00 0.00 54.97 55.27 1lhl s GLU 4 Cb -0.17 -2.55 -0.09 0.00 -1.78 0.00 0.00 34.13 29.53 1lhl s GLU 4 CO 0.41 0.19 1.40 -0.09 -0.49 0.00 0.00 175.26 176.67 1lhl h ARG 5 N 2.01 -0.39 -0.24 1.61 2.43 -1.96 -1.33 114.38 116.51 1lhl h ARG 5 Ca -0.47 0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 58.66 1lhl h ARG 5 Cb 1.18 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 1lhl h ARG 5 CO 0.67 -0.26 -0.13 0.00 -1.51 0.00 0.00 179.97 178.73 1lhl h GLU 7 N 0.38 0.97 -0.51 0.00 4.81 -1.89 -1.22 114.58 117.11 1lhl h GLU 7 Ca 0.07 -0.06 -0.11 0.00 -0.13 0.00 0.00 59.36 59.14 1lhl h GLU 7 Cb 0.46 -0.22 -0.02 0.00 0.63 0.00 0.00 28.75 29.61 1lhl h GLU 7 CO 0.03 0.64 -0.10 1.25 -0.73 0.00 0.00 179.01 180.10 1lhl h LEU 8 N 1.00 0.98 -0.51 1.64 5.85 -0.68 -1.68 115.31 121.91 1lhl h LEU 8 Ca 0.31 -0.35 0.03 0.00 0.84 0.00 0.00 57.88 58.71 1lhl h LEU 8 Cb -0.00 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 40.72 1lhl h LEU 8 CO -0.11 1.10 0.30 0.00 -0.34 0.00 0.00 178.44 179.39 1lhl h ALA 9 N 0.91 0.65 -0.57 1.25 0.00 -0.98 0.18 119.26 120.70 1lhl h ALA 9 Ca 0.13 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.95 1lhl h ALA 9 Cb 0.66 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.29 1lhl h ALA 9 CO 0.05 -0.00 -0.00 0.00 0.00 0.00 0.00 179.25 179.29 1lhl h ARG 10 N 0.59 0.98 0.22 0.00 3.08 -1.15 -1.58 114.38 116.52 1lhl h ARG 10 Ca 0.21 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.95 1lhl h ARG 10 Cb 0.03 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.99 1lhl h ARG 10 CO -0.10 0.97 -0.11 1.15 -1.07 0.00 0.00 179.97 180.82 1lhl h THR 11 N 0.90 0.82 -0.95 2.04 2.02 -0.72 -1.78 112.91 115.24 1lhl h THR 11 Ca 0.16 -0.17 0.06 0.00 0.77 0.00 0.00 66.41 67.23 1lhl h THR 11 Cb 0.53 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 67.80 1lhl h THR 11 CO 0.03 0.04 0.62 -0.07 0.37 0.00 0.00 175.52 176.50 1lhl h LEU 12 N -0.38 0.97 -0.31 2.58 3.38 -0.56 -1.69 115.31 119.30 1lhl h LEU 12 Ca -0.03 0.00 0.01 0.00 0.09 0.00 0.00 57.88 57.95 1lhl h LEU 12 Cb 0.29 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 1lhl h LEU 12 CO 0.05 0.63 0.19 0.50 0.09 0.00 0.00 178.44 179.90 1lhl h LYS 13 N 1.11 0.38 -0.18 1.13 3.64 -1.06 -1.93 116.57 119.66 1lhl h LYS 13 Ca 0.40 -0.02 -0.01 0.00 -1.27 0.00 0.00 60.65 59.75 1lhl h LYS 13 Cb 0.16 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 1lhl h LYS 13 CO -0.15 0.25 0.06 -0.09 -2.27 0.00 0.00 179.45 177.25 1lhl h ARG 14 N 0.39 0.24 -0.12 1.90 2.43 -0.86 -1.52 114.38 116.85 1lhl h ARG 14 Ca 0.12 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1lhl h ARG 14 Cb -0.02 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.48 1lhl h ARG 14 CO -0.05 0.22 0.00 1.28 -1.51 0.00 0.00 179.97 179.91 1lhl n LEU 15 N -4.45 0.89 -0.67 3.80 4.77 -0.68 -4.92 117.00 115.75 1lhl n LEU 15 Ca -0.00 -0.40 -0.05 0.00 -0.03 0.00 0.00 56.01 55.52 1lhl n LEU 15 Cb 0.13 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1lhl n LEU 15 CO 0.35 0.20 -0.04 0.61 -1.33 0.00 0.00 177.39 177.18 1lhl n GLY 16 N 0.90 0.24 0.10 -0.72 0.00 -0.57 -4.96 105.19 100.17 1lhl n GLY 16 Ca 0.12 -0.65 0.12 0.00 0.00 0.00 0.00 46.02 45.61 1lhl n GLY 16 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1lhl h MET 17 N -0.10 0.00 -6.18 1.61 2.86 -1.58 -3.41 114.93 108.13 1lhl h MET 17 Ca -0.12 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 56.95 1lhl h MET 17 Cb 1.09 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.72 1lhl h MET 17 CO 0.14 0.00 1.33 0.34 1.06 0.00 0.00 176.91 179.78 1lhl s ASP 18 N -4.91 5.73 0.00 1.22 2.15 -1.26 -1.96 116.67 117.63 1lhl s ASP 18 Ca 0.03 1.34 0.00 0.00 0.43 0.00 0.00 52.55 54.35 1lhl s ASP 18 Cb 0.11 -2.52 0.00 0.00 -0.30 0.00 0.00 42.92 40.21 1lhl s ASP 18 CO 0.74 -1.83 0.00 0.61 -0.17 0.00 0.00 175.17 174.52 1lhl n GLY 19 N 5.52 0.65 3.68 2.66 0.00 0.73 -4.87 105.19 113.56 1lhl n GLY 19 Ca 0.24 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.84 1lhl n GLY 19 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1lhl n TYR 20 N -2.69 2.59 -4.05 1.61 9.36 -0.83 -1.42 117.16 121.73 1lhl n TYR 20 Ca 0.00 -0.18 -0.34 0.00 3.32 0.00 0.00 57.90 60.70 1lhl n TYR 20 Cb 0.00 -2.74 -0.02 0.00 -0.63 0.00 0.00 39.34 35.95 1lhl n TYR 20 CO 0.00 0.00 0.00 0.54 0.22 0.00 0.00 176.86 177.62 1lhl n ARG 21 N 5.97 -3.29 -1.00 2.98 5.12 -1.26 -0.63 116.66 124.55 1lhl n ARG 21 Ca 0.18 0.39 0.00 0.00 -1.93 0.00 0.00 57.85 56.49 1lhl n ARG 21 Cb 0.38 -5.13 0.00 0.00 -1.16 0.00 0.00 32.46 26.55 1lhl n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1lhl n GLY 22 N -1.35 0.57 3.50 -0.13 0.00 -0.51 -5.00 105.19 102.27 1lhl n GLY 22 Ca 0.07 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.69 1lhl n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1lhl s ILE 23 N -2.30 4.95 0.70 -0.61 1.01 0.19 -4.89 121.20 120.25 1lhl s ILE 23 Ca 0.00 -0.24 -0.15 0.00 0.00 0.00 0.00 60.65 60.26 1lhl s ILE 23 Cb 0.00 -3.50 0.02 0.00 0.01 0.00 0.00 42.46 38.99 1lhl s ILE 23 CO 0.00 0.08 1.14 -0.94 0.00 0.00 0.00 174.94 175.22 1lhl s SER 24 N 1.68 4.72 0.26 3.58 1.04 -1.26 -0.19 113.70 123.53 1lhl s SER 24 Ca 0.06 2.10 -0.02 0.00 0.48 0.00 0.00 55.95 58.57 1lhl s SER 24 Cb -0.17 -2.56 0.51 0.00 0.10 0.00 0.00 66.02 63.90 1lhl s SER 24 CO 0.08 -1.89 1.75 0.25 0.98 0.00 0.00 173.24 174.41 1lhl h LEU 25 N -0.19 0.41 -1.99 2.42 5.85 -1.90 -0.25 115.31 119.67 1lhl h LEU 25 Ca -0.47 0.10 0.04 0.00 0.84 0.00 0.00 57.88 58.39 1lhl h LEU 25 Cb 1.26 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.33 1lhl h LEU 25 CO 0.52 0.16 0.10 0.00 -0.34 0.00 0.00 178.44 178.89 1lhl h ALA 26 N 1.56 2.11 -0.15 1.25 0.00 -1.92 -0.67 119.26 121.45 1lhl h ALA 26 Ca 0.44 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.27 1lhl h ALA 26 Cb 0.66 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.45 1lhl h ALA 26 CO -0.38 -0.15 -0.22 -0.91 0.00 0.00 0.00 179.25 177.59 1lhl h ASN 27 N 0.02 0.45 -0.78 0.00 2.35 -1.37 -0.75 115.58 115.50 1lhl h ASN 27 Ca 0.07 -0.52 -0.00 0.00 -0.55 0.00 0.00 56.30 55.29 1lhl h ASN 27 Cb 0.24 -0.13 -0.04 0.00 0.05 0.00 0.00 38.32 38.45 1lhl h ASN 27 CO -0.00 0.88 0.48 -0.50 -1.65 0.00 0.00 177.43 176.64 1lhl h TRP 28 N 0.03 1.02 0.05 1.19 4.06 -0.97 -0.53 115.95 120.80 1lhl h TRP 28 Ca 0.01 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.97 1lhl h TRP 28 Cb 0.79 -0.34 -0.01 0.00 -1.00 0.00 0.00 29.16 28.60 1lhl h TRP 28 CO 0.09 0.68 -0.05 0.52 -3.56 0.00 0.00 178.44 176.11 1lhl h MET 29 N 1.07 -0.12 -0.60 0.49 2.86 -1.10 -0.58 114.93 116.95 1lhl h MET 29 Ca 0.28 0.01 0.08 0.00 -2.06 0.00 0.00 59.70 58.01 1lhl h MET 29 Cb -0.06 0.03 -0.06 0.00 0.06 0.00 0.00 31.60 31.57 1lhl h MET 29 CO -0.05 -0.08 0.26 0.00 1.06 0.00 0.00 176.91 178.10 1lhl h LEU 31 N 0.47 -0.04 -1.12 0.00 5.85 -0.73 -2.11 115.31 117.63 1lhl h LEU 31 Ca 0.29 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.97 1lhl h LEU 31 Cb 0.30 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.31 1lhl h LEU 31 CO -0.25 0.00 0.43 0.00 -0.34 0.00 0.00 178.44 178.28 1lhl h ALA 32 N 0.88 1.34 0.05 1.25 0.00 -0.66 0.12 119.26 122.23 1lhl h ALA 32 Ca -0.01 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1lhl h ALA 32 Cb 0.07 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.55 1lhl h ALA 32 CO 0.01 0.55 -0.02 -0.22 0.00 0.00 0.00 179.25 179.57 1lhl h LYS 33 N 1.05 -0.06 0.00 0.00 3.11 -0.93 -1.42 116.57 118.31 1lhl h LYS 33 Ca 0.27 0.00 -0.13 0.00 -2.81 0.00 0.00 60.65 57.98 1lhl h LYS 33 Cb -0.00 0.01 -0.02 0.00 -1.00 0.00 0.00 32.23 31.22 1lhl h LYS 33 CO -0.05 -0.02 -0.63 -1.49 -2.81 0.00 0.00 179.45 174.46 1lhl h TRP 34 N -0.09 0.00 0.04 1.91 4.06 -1.12 -1.30 115.95 119.46 1lhl h TRP 34 Ca -0.01 0.00 -0.12 0.00 2.06 0.00 0.00 58.89 60.82 1lhl h TRP 34 Cb 0.07 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.24 1lhl h TRP 34 CO -0.07 0.63 -0.51 0.93 -3.56 0.00 0.00 178.44 175.86 1lhl h GLU 35 N 0.00 0.27 0.00 0.49 4.39 -0.72 -3.43 114.58 115.58 1lhl h GLU 35 Ca -0.01 -0.35 0.00 0.00 0.34 0.00 0.00 59.36 59.35 1lhl h GLU 35 Cb 1.45 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 30.21 1lhl h GLU 35 CO 0.08 1.09 0.00 -1.13 -1.16 0.00 0.00 179.01 177.89 1lhl n SER 36 N -4.31 0.43 -1.58 1.42 3.41 -0.58 -4.86 113.62 107.55 1lhl n SER 36 Ca -0.11 -1.08 -0.13 0.00 -0.26 0.00 0.00 58.87 57.29 1lhl n SER 36 Cb 0.65 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.61 1lhl n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1lhl n GLY 37 N -0.04 -0.12 2.48 5.00 0.00 -0.49 -2.30 105.19 109.72 1lhl n GLY 37 Ca 0.00 -0.32 -0.18 0.00 0.00 0.00 0.00 46.02 45.52 1lhl n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1lhl n TYR 38 N -4.01 -1.09 -3.66 1.61 0.53 -1.13 -4.77 117.16 104.63 1lhl n TYR 38 Ca -0.13 0.13 -0.38 0.00 -1.02 0.00 0.00 57.90 56.50 1lhl n TYR 38 Cb 0.60 -3.68 -0.12 0.00 -1.03 0.00 0.00 39.34 35.11 1lhl n TYR 38 CO 0.00 0.00 0.00 1.21 -1.02 0.00 0.00 176.86 177.05 1lhl s ASN 39 N -2.35 5.57 0.37 7.72 2.47 -0.97 -1.20 114.94 126.54 1lhl s ASN 39 Ca 0.07 -0.38 0.27 0.00 0.42 0.00 0.00 52.86 53.24 1lhl s ASN 39 Cb -0.03 -2.01 0.89 0.00 -1.45 0.00 0.00 41.25 38.65 1lhl s ASN 39 CO 0.09 -0.15 1.78 0.71 -3.72 0.00 0.00 177.10 175.81 1lhl h THR 40 N 5.58 0.00 -0.02 -5.21 1.35 -1.45 -3.13 112.91 110.03 1lhl h THR 40 Ca -0.34 -0.55 0.00 0.00 -0.55 0.00 0.00 66.41 64.98 1lhl h THR 40 Cb 1.16 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 69.06 1lhl h THR 40 CO 0.60 0.00 -0.06 -2.11 -0.25 0.00 0.00 175.52 173.70 1lhl n ARG 41 N -2.67 1.86 -1.73 4.72 1.85 -1.26 -4.08 116.66 115.35 1lhl n ARG 41 Ca 0.03 -1.37 -0.42 0.00 -1.00 0.00 0.00 57.85 55.09 1lhl n ARG 41 Cb 0.37 -1.47 -0.01 0.00 -1.05 0.00 0.00 32.46 30.30 1lhl n ARG 41 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1lhl n ALA 42 N 0.63 1.87 -2.92 2.89 0.00 -1.19 -4.78 120.51 117.01 1lhl n ALA 42 Ca 0.15 0.36 -0.11 0.00 0.00 0.00 0.00 53.44 53.85 1lhl n ALA 42 Cb 0.48 -2.35 -0.13 0.00 0.00 0.00 0.00 19.45 17.45 1lhl n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1lhl s THR 43 N -0.77 0.04 -0.10 0.00 -4.23 -1.26 -0.46 115.64 108.87 1lhl s THR 43 Ca 0.58 -0.35 -0.03 0.00 -1.18 0.00 0.00 61.69 60.70 1lhl s THR 43 Cb -0.53 -0.12 0.05 0.00 1.34 0.00 0.00 72.50 73.24 1lhl s THR 43 CO 0.59 -0.19 0.12 0.21 -0.54 0.00 0.00 174.62 174.80 1lhl s ASN 44 N -0.57 1.25 0.17 3.99 2.47 -0.63 -4.98 114.94 116.64 1lhl s ASN 44 Ca -0.06 0.01 -0.21 0.00 0.42 0.00 0.00 52.86 53.02 1lhl s ASN 44 Cb -0.04 0.05 -0.08 0.00 -1.45 0.00 0.00 41.25 39.74 1lhl s ASN 44 CO -0.00 -0.28 0.70 -0.47 -3.72 0.00 0.00 177.10 173.33 1lhl s TYR 45 N 2.23 3.75 -0.53 0.43 6.14 -1.26 -0.57 117.35 127.54 1lhl s TYR 45 Ca 0.04 1.42 -0.04 0.00 0.64 0.00 0.00 57.07 59.13 1lhl s TYR 45 Cb -0.13 -2.62 0.14 0.00 0.42 0.00 0.00 41.96 39.76 1lhl s TYR 45 CO -0.06 0.44 0.35 -0.80 0.64 0.00 0.00 175.55 176.12 1lhl s ASN 46 N -1.41 5.33 0.40 4.32 0.01 0.02 -4.96 114.94 118.65 1lhl s ASN 46 Ca 0.38 -2.45 0.13 0.00 -0.71 0.00 0.00 52.86 50.21 1lhl s ASN 46 Cb -0.19 -1.87 0.96 0.00 0.41 0.00 0.00 41.25 40.56 1lhl s ASN 46 CO 0.22 -0.47 1.90 -0.65 -1.51 0.00 0.00 177.10 176.59 1lhl h PRO 47 N 7.57 0.51 -0.66 -0.60 0.11 -1.96 0.88 132.00 137.84 1lhl h PRO 47 Ca -0.07 -0.03 0.11 0.00 0.11 0.00 0.00 66.00 66.11 1lhl h PRO 47 Cb 1.00 -0.12 -0.08 0.00 0.11 0.00 0.00 31.00 31.92 1lhl h PRO 47 CO 0.72 0.34 0.26 0.78 -0.21 0.00 0.00 178.00 179.89 1lhl h GLY 48 N 0.53 0.96 0.00 -0.55 0.00 -1.94 -3.24 103.07 98.82 1lhl h GLY 48 Ca 0.40 -0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.59 1lhl h GLY 48 CO -0.15 -0.04 0.00 2.09 0.00 0.00 0.00 176.54 178.44 1lhl n ASP 49 N -4.99 1.22 -1.12 0.19 5.75 -1.03 -5.01 116.55 111.56 1lhl n ASP 49 Ca 0.11 -1.60 -0.15 0.00 -0.01 0.00 0.00 54.79 53.15 1lhl n ASP 49 Cb 0.32 0.00 -0.06 0.00 -1.03 0.00 0.00 41.12 40.35 1lhl n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1lhl n ARG 50 N -0.30 -1.02 -3.09 0.11 1.74 0.27 -4.80 116.66 109.57 1lhl n ARG 50 Ca 0.00 1.01 -0.18 0.00 -0.77 0.00 0.00 57.85 57.92 1lhl n ARG 50 Cb 0.33 -5.13 0.00 0.00 -1.02 0.00 0.00 32.46 26.65 1lhl n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1lhl s SER 51 N -2.84 5.59 0.02 0.55 1.04 -1.19 -4.51 113.70 112.36 1lhl s SER 51 Ca 0.00 -0.45 0.03 0.00 0.48 0.00 0.00 55.95 56.01 1lhl s SER 51 Cb 0.00 -0.67 -0.01 0.00 0.10 0.00 0.00 66.02 65.44 1lhl s SER 51 CO 0.00 -0.74 -0.09 -0.89 0.98 0.00 0.00 173.24 172.50 1lhl s THR 52 N -2.36 0.71 -0.16 2.02 2.01 -1.26 -0.80 115.64 115.79 1lhl s THR 52 Ca 0.54 -0.70 -0.11 0.00 0.31 0.00 0.00 61.69 61.73 1lhl s THR 52 Cb -0.09 -0.66 -0.05 0.00 0.01 0.00 0.00 72.50 71.71 1lhl s THR 52 CO 0.32 -0.02 0.20 -1.81 -0.69 0.00 0.00 174.62 172.62 1lhl s ASP 53 N -0.80 6.34 -0.02 3.53 1.01 0.27 -1.13 116.67 125.88 1lhl s ASP 53 Ca -0.01 0.40 0.06 0.00 0.71 0.00 0.00 52.55 53.71 1lhl s ASP 53 Cb -0.06 -2.13 -0.01 0.00 1.01 0.00 0.00 42.92 41.73 1lhl s ASP 53 CO 0.00 0.19 -0.19 -0.31 0.21 0.00 0.00 175.17 175.07 1lhl s TYR 54 N 0.12 1.76 0.00 4.23 2.02 -0.09 -1.61 117.35 123.79 1lhl s TYR 54 Ca 0.13 -0.36 0.00 0.00 -0.37 0.00 0.00 57.07 56.46 1lhl s TYR 54 Cb -0.12 -1.14 0.00 0.00 -0.40 0.00 0.00 41.96 40.30 1lhl s TYR 54 CO 0.02 -0.05 0.00 0.41 -1.57 0.00 0.00 175.55 174.35 1lhl n GLY 55 N 2.68 -1.52 0.24 0.71 0.00 0.39 -1.80 105.19 105.89 1lhl n GLY 55 Ca -0.15 -1.30 0.07 0.00 0.00 0.00 0.00 46.02 44.63 1lhl n GLY 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1lhl h ILE 56 N 0.00 1.05 -0.34 -0.61 2.10 -1.70 -1.95 117.51 116.06 1lhl h ILE 56 Ca 0.00 -0.35 0.00 0.00 1.08 0.00 0.00 64.86 65.59 1lhl h ILE 56 Cb 0.00 1.19 0.00 0.00 -1.09 0.00 0.00 36.82 36.92 1lhl h ILE 56 CO 0.00 0.10 0.00 0.49 -1.08 0.00 0.00 178.15 177.66 1lhl n PHE 57 N -4.39 0.43 -3.79 2.19 3.01 -1.26 -3.99 117.46 109.67 1lhl n PHE 57 Ca -0.03 -0.27 -0.32 0.00 1.01 0.00 0.00 57.45 57.85 1lhl n PHE 57 Cb 0.18 -0.01 0.03 0.00 -0.01 0.00 0.00 39.48 39.67 1lhl n PHE 57 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1lhl n GLN 58 N 1.19 -1.64 -2.60 -1.08 1.13 -0.73 -4.91 117.38 108.73 1lhl n GLN 58 Ca 0.16 0.40 -0.42 0.00 -1.94 0.00 0.00 57.00 55.21 1lhl n GLN 58 Cb 0.52 -4.05 -0.03 0.00 0.11 0.00 0.00 30.24 26.79 1lhl n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1lhl s ILE 59 N -3.59 4.50 0.11 5.09 1.01 -0.75 -4.40 121.20 123.18 1lhl s ILE 59 Ca 0.36 1.82 -0.28 0.00 0.00 0.00 0.00 60.65 62.55 1lhl s ILE 59 Cb -0.14 -4.17 -0.06 0.00 0.01 0.00 0.00 42.46 38.10 1lhl s ILE 59 CO 0.88 0.16 0.90 0.21 0.00 0.00 0.00 174.94 177.08 1lhl s ASN 60 N 0.93 7.44 0.31 3.58 3.84 -1.26 -0.92 114.94 128.86 1lhl s ASN 60 Ca 0.54 1.72 0.26 0.00 0.21 0.00 0.00 52.86 55.58 1lhl s ASN 60 Cb -0.25 -2.55 1.05 0.00 -0.55 0.00 0.00 41.25 38.95 1lhl s ASN 60 CO 0.29 -0.00 1.77 0.77 -2.79 0.00 0.00 177.10 177.13 1lhl h SER 61 N 5.35 0.00 0.21 -4.21 4.64 -1.38 -2.06 113.55 116.10 1lhl h SER 61 Ca -0.44 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 60.81 1lhl h SER 61 Cb 1.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.29 1lhl h SER 61 CO 0.71 0.00 -0.30 -0.09 -0.87 0.00 0.00 176.83 176.28 1lhl h ARG 62 N 0.00 0.16 0.00 4.77 2.43 -1.83 -3.39 114.38 116.51 1lhl h ARG 62 Ca 0.00 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 1lhl h ARG 62 Cb 0.41 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1lhl h ARG 62 CO 0.00 0.45 -0.88 0.66 -1.51 0.00 0.00 179.97 178.69 1lhl n TYR 63 N -4.14 0.00 -0.10 2.20 4.02 -1.17 -0.44 117.16 117.54 1lhl n TYR 63 Ca -0.01 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.76 1lhl n TYR 63 Cb 0.38 0.00 -0.14 0.00 -0.02 0.00 0.00 39.34 39.56 1lhl n TYR 63 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 176.86 176.76 1lhl n TRP 64 N -1.78 0.00 -4.16 -0.72 7.02 -0.78 -0.53 117.44 116.48 1lhl n TRP 64 Ca 0.00 0.00 -0.10 0.00 -1.02 0.00 0.00 57.50 56.38 1lhl n TRP 64 Cb 0.41 -0.94 -0.10 0.00 -2.42 0.00 0.00 31.31 28.25 1lhl n TRP 64 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1lhl s ASN 66 N -3.04 6.31 0.00 0.00 2.47 0.35 -4.60 114.94 116.43 1lhl s ASN 66 Ca 0.14 0.35 0.00 0.00 0.42 0.00 0.00 52.86 53.77 1lhl s ASN 66 Cb 0.06 -2.14 0.00 0.00 -1.45 0.00 0.00 41.25 37.72 1lhl s ASN 66 CO -0.04 0.11 0.57 -0.90 -3.72 0.00 0.00 177.10 173.12 1lhl n ASP 67 N 3.73 1.12 0.00 -4.21 5.68 -1.26 -1.00 116.55 120.61 1lhl n ASP 67 Ca -0.13 -1.20 0.00 0.00 -0.50 0.00 0.00 54.79 52.95 1lhl n ASP 67 Cb 0.52 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.50 1lhl n ASP 67 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lhl n GLY 68 N -0.10 1.38 1.07 6.12 0.00 -1.26 -4.67 105.19 107.73 1lhl n GLY 68 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.14 1lhl n GLY 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1lhl n LYS 69 N -0.72 2.42 -3.44 1.61 2.85 -1.26 -4.87 118.16 114.75 1lhl n LYS 69 Ca 0.00 -2.12 -0.38 0.00 -1.05 0.00 0.00 58.31 54.76 1lhl n LYS 69 Cb 0.00 -1.49 -0.07 0.00 -0.65 0.00 0.00 35.03 32.81 1lhl n LYS 69 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 1lhl s THR 70 N -1.70 5.23 0.31 0.58 2.01 -1.26 -4.96 115.64 115.85 1lhl s THR 70 Ca 0.35 0.65 -0.28 0.00 0.31 0.00 0.00 61.69 62.71 1lhl s THR 70 Cb 0.22 -3.70 -0.10 0.00 0.01 0.00 0.00 72.50 68.94 1lhl s THR 70 CO 0.31 0.29 1.15 -2.16 -0.69 0.00 0.00 174.62 173.52 1lhl s PRO 71 N 1.08 4.48 -1.53 4.92 0.04 -1.26 -3.53 135.00 139.20 1lhl s PRO 71 Ca 0.18 1.88 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1lhl s PRO 71 Cb -0.14 -3.06 0.00 0.00 0.04 0.00 0.00 34.50 31.34 1lhl s PRO 71 CO 0.07 0.04 0.00 0.41 0.04 0.00 0.00 177.00 177.56 1lhl n GLY 72 N 0.98 0.02 3.91 0.56 0.00 -1.26 -4.97 105.19 104.42 1lhl n GLY 72 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1lhl n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lhl s ALA 73 N -2.74 3.34 0.44 4.61 0.00 -1.23 -5.03 121.76 121.15 1lhl s ALA 73 Ca 0.00 -0.53 0.04 0.00 0.00 0.00 0.00 51.96 51.48 1lhl s ALA 73 Cb 0.00 -2.64 -0.05 0.00 0.00 0.00 0.00 23.12 20.43 1lhl s ALA 73 CO 0.00 -0.54 0.02 0.14 0.00 0.00 0.00 175.76 175.38 1lhl s VAL 74 N -2.87 1.56 -0.44 0.00 -7.23 0.42 -5.00 120.40 106.83 1lhl s VAL 74 Ca 0.50 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.76 1lhl s VAL 74 Cb -0.10 -2.66 0.27 0.00 0.56 0.00 0.00 36.38 34.45 1lhl s VAL 74 CO 0.46 0.00 0.62 -3.20 -0.31 0.00 0.00 175.10 172.67 1lhl n ASN 75 N -1.06 1.14 -0.10 4.85 5.15 -1.22 -3.73 115.26 120.28 1lhl n ASN 75 Ca -0.10 -2.93 0.12 0.00 -0.60 0.00 0.00 54.58 51.07 1lhl n ASN 75 Cb 0.67 -0.64 0.48 0.00 -0.53 0.00 0.00 39.78 39.76 1lhl n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1lhl h ALA 76 N 3.79 1.99 -0.00 5.20 0.00 -0.85 0.14 119.26 129.52 1lhl h ALA 76 Ca 0.10 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1lhl h ALA 76 Cb 0.84 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1lhl h ALA 76 CO 0.55 -0.13 -0.01 0.00 0.00 0.00 0.00 179.25 179.67 1lhl n HIS 78 N -1.31 -2.09 -3.98 0.00 -0.00 0.47 -4.99 115.22 103.32 1lhl n HIS 78 Ca 0.13 0.86 -0.08 0.00 -0.00 0.00 0.00 57.72 58.63 1lhl n HIS 78 Cb 0.26 -4.59 -0.09 0.00 -0.00 0.00 0.00 29.99 25.57 1lhl n HIS 78 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 1lhl s LEU 79 N -6.39 2.04 0.32 2.41 1.43 -1.26 -5.06 118.68 112.16 1lhl s LEU 79 Ca 0.08 -0.76 -0.27 0.00 -1.03 0.00 0.00 54.13 52.15 1lhl s LEU 79 Cb -0.02 0.50 -0.09 0.00 0.03 0.00 0.00 46.19 46.61 1lhl s LEU 79 CO 0.77 -0.58 1.01 -0.55 0.23 0.00 0.00 176.35 177.23 1lhl s SER 80 N -2.59 7.22 0.58 2.29 0.15 -1.26 -0.49 113.70 119.59 1lhl s SER 80 Ca 0.02 2.00 0.27 0.00 0.70 0.00 0.00 55.95 58.94 1lhl s SER 80 Cb 0.04 -2.60 1.73 0.00 -1.71 0.00 0.00 66.02 63.48 1lhl s SER 80 CO -0.08 -0.16 2.23 0.00 1.20 0.00 0.00 173.24 176.43 1lhl h SER 82 N 0.00 0.36 -0.06 0.00 0.87 -1.91 -0.87 113.55 111.94 1lhl h SER 82 Ca 0.01 0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.61 1lhl h SER 82 Cb 0.03 -0.05 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 1lhl h SER 82 CO -0.00 0.18 0.08 0.00 -0.53 0.00 0.00 176.83 176.56 1lhl h ALA 83 N 1.64 1.56 -0.18 6.23 0.00 -1.58 -1.42 119.26 125.51 1lhl h ALA 83 Ca 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 1lhl h ALA 83 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1lhl h ALA 83 CO -0.12 -0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.30 1lhl n LEU 84 N -3.73 1.54 -0.40 0.00 4.77 -0.33 -3.61 117.00 115.24 1lhl n LEU 84 Ca -0.01 -0.67 0.03 0.00 -0.03 0.00 0.00 56.01 55.33 1lhl n LEU 84 Cb 0.17 -0.12 0.10 0.00 -2.33 0.00 0.00 43.42 41.24 1lhl n LEU 84 CO 0.26 0.33 0.58 0.18 -1.33 0.00 0.00 177.39 177.42 1lhl n LEU 85 N 0.25 2.58 -4.84 2.23 4.77 -0.54 -3.36 117.00 118.09 1lhl n LEU 85 Ca 0.15 -2.01 -0.31 0.00 -0.03 0.00 0.00 56.01 53.81 1lhl n LEU 85 Cb 0.30 -0.15 0.03 0.00 -2.33 0.00 0.00 43.42 41.27 1lhl n LEU 85 CO 0.12 0.64 0.71 -1.10 -1.33 0.00 0.00 177.39 176.43 1lhl s GLN 86 N -1.01 3.28 0.24 3.23 -0.21 -1.24 -4.57 119.66 119.38 1lhl s GLN 86 Ca 0.15 0.91 0.02 0.00 0.02 0.00 0.00 55.36 56.45 1lhl s GLN 86 Cb 0.08 -2.04 0.28 0.00 1.00 0.00 0.00 33.01 32.33 1lhl s GLN 86 CO 0.10 -0.83 1.61 -0.44 -2.12 0.00 0.00 175.29 173.61 1lhl h ASP 87 N -0.36 0.43 -3.21 5.90 3.32 -1.94 -3.42 116.42 117.15 1lhl h ASP 87 Ca -0.44 -0.20 -0.57 0.00 0.02 0.00 0.00 57.03 55.83 1lhl h ASP 87 Cb 1.20 -0.12 -0.05 0.00 0.22 0.00 0.00 39.33 40.58 1lhl h ASP 87 CO 0.59 0.83 0.61 0.21 -1.72 0.00 0.00 179.24 179.76 1lhl s ASN 88 N -6.88 7.14 -0.04 6.45 3.84 -1.26 -4.88 114.94 119.31 1lhl s ASN 88 Ca -0.06 1.41 0.13 0.00 0.21 0.00 0.00 52.86 54.55 1lhl s ASN 88 Cb 0.12 -2.53 0.45 0.00 -0.55 0.00 0.00 41.25 38.74 1lhl s ASN 88 CO 0.80 -0.51 1.34 2.30 -2.79 0.00 0.00 177.10 178.24 1lhl n ILE 89 N 4.85 0.91 -0.21 -5.21 -5.35 -1.26 -4.49 119.36 108.60 1lhl n ILE 89 Ca 0.09 -0.70 -0.00 0.00 -0.27 0.00 0.00 62.75 61.86 1lhl n ILE 89 Cb 0.48 0.16 0.11 0.00 -1.74 0.00 0.00 39.64 38.64 1lhl n ILE 89 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1lhl h ALA 90 N 3.74 0.81 -0.44 -1.28 0.00 -1.95 0.14 119.26 120.27 1lhl h ALA 90 Ca 0.00 0.07 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1lhl h ALA 90 Cb 0.83 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1lhl h ALA 90 CO 0.08 -0.14 -0.15 -0.44 0.00 0.00 0.00 179.25 178.59 1lhl h ASP 91 N 0.47 0.88 -0.80 0.00 3.45 -1.87 -0.95 116.42 117.60 1lhl h ASP 91 Ca 0.30 -0.38 -0.00 0.00 0.43 0.00 0.00 57.03 57.38 1lhl h ASP 91 Cb 0.34 -0.24 -0.04 0.00 -0.56 0.00 0.00 39.33 38.83 1lhl h ASP 91 CO -0.27 1.06 0.49 0.00 -1.57 0.00 0.00 179.24 178.95 1lhl h ALA 92 N 0.85 1.01 -0.31 3.45 0.00 -1.59 -1.45 119.26 121.23 1lhl h ALA 92 Ca 0.10 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.89 1lhl h ALA 92 Cb 0.70 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 1lhl h ALA 92 CO 0.05 0.47 0.05 0.28 0.00 0.00 0.00 179.25 180.10 1lhl h VAL 93 N 1.09 1.23 -0.60 0.00 2.07 -0.59 0.91 116.25 120.36 1lhl h VAL 93 Ca 0.29 -0.81 0.01 0.00 0.82 0.00 0.00 66.70 67.01 1lhl h VAL 93 Cb -0.05 1.17 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1lhl h VAL 93 CO -0.06 0.26 0.39 0.00 0.02 0.00 0.00 177.57 178.19 1lhl h ALA 94 N 0.88 1.57 -0.11 1.67 0.00 -0.82 -0.01 119.26 122.44 1lhl h ALA 94 Ca 0.09 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 54.82 1lhl h ALA 94 Cb 0.34 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.90 1lhl h ALA 94 CO 0.01 0.40 -0.47 0.00 0.00 0.00 0.00 179.25 179.19 1lhl h ALA 96 N 0.49 1.53 -0.70 0.00 0.00 -0.29 0.01 119.26 120.30 1lhl h ALA 96 Ca -0.03 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1lhl h ALA 96 Cb 1.10 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.59 1lhl h ALA 96 CO 0.10 0.36 0.26 0.87 0.00 0.00 0.00 179.25 180.84 1lhl h LYS 97 N 0.99 1.05 -0.46 0.00 1.57 -0.89 -2.27 116.57 116.57 1lhl h LYS 97 Ca 0.35 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1lhl h LYS 97 Cb 0.13 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 32.25 1lhl h LYS 97 CO -0.12 0.88 0.25 -0.09 -0.57 0.00 0.00 179.45 179.80 1lhl h ARG 98 N 1.00 0.64 -0.57 3.15 9.65 -0.60 -2.77 114.38 124.88 1lhl h ARG 98 Ca 0.23 -0.08 0.07 0.00 -1.10 0.00 0.00 59.98 59.10 1lhl h ARG 98 Cb 0.24 -0.12 -0.06 0.00 -1.39 0.00 0.00 29.97 28.64 1lhl h ARG 98 CO -0.02 0.52 0.26 0.28 2.80 0.00 0.00 179.97 183.81 1lhl h VAL 99 N 0.60 0.88 0.00 0.20 2.07 -0.70 -1.90 116.25 117.40 1lhl h VAL 99 Ca 0.16 -0.17 0.00 0.00 0.82 0.00 0.00 66.70 67.51 1lhl h VAL 99 Cb 0.06 0.35 0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1lhl h VAL 99 CO -0.02 0.09 0.00 1.33 0.02 0.00 0.00 177.57 178.98 1lhl n VAL 100 N -4.92 0.17 0.65 2.57 0.24 -0.89 -2.49 118.33 113.68 1lhl n VAL 100 Ca 0.07 0.04 0.12 0.00 -2.04 0.00 0.00 64.34 62.53 1lhl n VAL 100 Cb 0.20 -0.64 0.47 0.00 -1.47 0.00 0.00 33.84 32.40 1lhl n VAL 100 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 1lhl n ARG 101 N -1.24 0.15 -1.89 7.34 1.74 -0.71 -4.19 116.66 117.87 1lhl n ARG 101 Ca 0.13 0.21 -0.31 0.00 -0.77 0.00 0.00 57.85 57.11 1lhl n ARG 101 Cb 0.18 -1.71 0.01 0.00 -1.02 0.00 0.00 32.46 29.92 1lhl n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1lhl s ASP 102 N -3.92 6.23 0.34 0.55 -0.00 -1.04 -4.96 116.67 113.88 1lhl s ASP 102 Ca 0.10 1.41 0.11 0.00 -0.00 0.00 0.00 52.55 54.16 1lhl s ASP 102 Cb 0.13 -2.46 0.88 0.00 -0.00 0.00 0.00 42.92 41.47 1lhl s ASP 102 CO 0.50 -0.87 1.79 -0.65 -0.00 0.00 0.00 175.17 175.94 1lhl h PRO 103 N -0.31 0.60 0.00 8.23 0.11 -1.88 -1.19 132.00 137.55 1lhl h PRO 103 Ca -0.44 -0.04 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1lhl h PRO 103 Cb 1.19 -0.13 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 1lhl h PRO 103 CO 0.62 0.39 -0.07 1.96 -0.21 0.00 0.00 178.00 180.70 1lhl h GLN 104 N 0.61 0.00 0.00 1.05 4.20 -1.90 -3.48 115.11 115.59 1lhl h GLN 104 Ca 0.57 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.28 1lhl h GLN 104 Cb 1.09 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.87 1lhl h GLN 104 CO -0.33 0.07 0.00 0.41 -0.67 0.00 0.00 178.83 178.30 1lhl n GLY 105 N -0.72 2.59 0.30 3.46 0.00 -0.45 -1.66 105.19 108.71 1lhl n GLY 105 Ca -0.02 -0.42 0.20 0.00 0.00 0.00 0.00 46.02 45.78 1lhl n GLY 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1lhl h ILE 106 N 0.00 0.00 0.00 -0.61 6.09 -1.91 -2.65 117.51 118.44 1lhl h ILE 106 Ca 0.00 -0.16 0.00 0.00 -1.37 0.00 0.00 64.86 63.33 1lhl h ILE 106 Cb 0.00 1.12 0.00 0.00 0.47 0.00 0.00 36.82 38.41 1lhl h ILE 106 CO 0.00 0.00 0.00 0.54 -3.07 0.00 0.00 178.15 175.62 1lhl n ARG 107 N -3.01 0.02 0.30 2.19 1.74 -0.67 -2.81 116.66 114.42 1lhl n ARG 107 Ca -0.02 0.35 0.16 0.00 -0.77 0.00 0.00 57.85 57.58 1lhl n ARG 107 Cb 0.14 -1.54 0.95 0.00 -1.02 0.00 0.00 32.46 31.00 1lhl n ARG 107 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lhl h ALA 108 N 2.31 1.47 -2.70 7.54 0.00 -1.60 -3.38 119.26 122.91 1lhl h ALA 108 Ca 0.00 -0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.25 1lhl h ALA 108 Cb 0.17 0.00 -0.18 0.00 0.00 0.00 0.00 17.79 17.79 1lhl h ALA 108 CO 0.00 -0.03 -0.40 -1.58 0.00 0.00 0.00 179.25 177.24 1lhl s TRP 109 N -4.56 3.22 0.38 0.00 0.51 -1.12 -4.96 118.94 112.41 1lhl s TRP 109 Ca -0.05 -0.05 0.17 0.00 -2.12 0.00 0.00 56.10 54.05 1lhl s TRP 109 Cb 0.15 -2.54 0.94 0.00 -0.81 0.00 0.00 33.47 31.21 1lhl s TRP 109 CO 0.53 -0.34 1.91 -0.24 -0.51 0.00 0.00 176.95 178.29 1lhl h VAL 110 N 5.48 1.06 -0.06 4.03 3.04 -1.89 -1.07 116.25 126.84 1lhl h VAL 110 Ca -0.31 -0.98 -0.01 0.00 -1.01 0.00 0.00 66.70 64.38 1lhl h VAL 110 Cb 1.16 1.55 -0.00 0.00 -2.01 0.00 0.00 31.29 31.98 1lhl h VAL 110 CO 0.64 0.27 -0.03 0.00 -1.01 0.00 0.00 177.57 177.44 1lhl h ALA 111 N 1.73 1.85 -0.49 3.17 0.00 -1.93 -0.75 119.26 122.83 1lhl h ALA 111 Ca -0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1lhl h ALA 111 Cb 0.53 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1lhl h ALA 111 CO 0.04 0.12 0.23 2.35 0.00 0.00 0.00 179.25 181.98 1lhl h TRP 112 N 0.08 0.71 -0.36 0.00 7.01 -1.50 0.45 115.95 122.34 1lhl h TRP 112 Ca 0.02 -0.04 -0.03 0.00 2.11 0.00 0.00 58.89 60.95 1lhl h TRP 112 Cb 0.11 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 26.94 1lhl h TRP 112 CO 0.00 0.57 0.12 0.00 -2.79 0.00 0.00 178.44 176.34 1lhl h ARG 113 N 0.64 0.56 -0.34 2.65 3.08 -1.37 0.32 114.38 119.92 1lhl h ARG 113 Ca 0.17 -0.12 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 1lhl h ARG 113 Cb 0.13 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1lhl h ARG 113 CO -0.02 0.57 0.00 -0.91 -1.07 0.00 0.00 179.97 178.54 1lhl h ASN 114 N 0.43 0.58 0.00 7.04 2.35 -0.95 -3.34 115.58 121.69 1lhl h ASN 114 Ca 0.12 -0.31 0.00 0.00 -0.55 0.00 0.00 56.30 55.56 1lhl h ASN 114 Cb 0.24 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.45 1lhl h ASN 114 CO -0.01 0.74 -1.03 0.54 -1.65 0.00 0.00 177.43 176.03 1lhl n ARG 115 N -4.53 1.70 0.00 0.81 5.12 0.13 -4.83 116.66 115.07 1lhl n ARG 115 Ca -0.02 -0.05 0.00 0.00 -1.93 0.00 0.00 57.85 55.85 1lhl n ARG 115 Cb 0.27 -1.22 0.00 0.00 -1.16 0.00 0.00 32.46 30.35 1lhl n ARG 115 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1lhl s GLN 117 N -1.81 4.14 -1.70 0.00 0.74 0.05 -2.40 119.66 118.69 1lhl s GLN 117 Ca 0.00 2.54 0.00 0.00 0.05 0.00 0.00 55.36 57.95 1lhl s GLN 117 Cb 0.00 -3.05 0.00 0.00 1.10 0.00 0.00 33.01 31.06 1lhl s GLN 117 CO 0.00 -0.64 0.00 0.09 -0.55 0.00 0.00 175.29 174.19 1lhl n ASN 118 N 2.74 -5.49 -4.65 6.67 5.03 -1.26 -4.98 115.26 113.34 1lhl n ASN 118 Ca 0.10 0.08 -0.24 0.00 0.87 0.00 0.00 54.58 55.40 1lhl n ASN 118 Cb 0.37 -4.62 -0.08 0.00 -1.02 0.00 0.00 39.78 34.44 1lhl n ASN 118 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 1lhl s ARG 119 N -4.86 2.16 -0.72 3.52 1.81 -1.01 -5.06 118.95 114.79 1lhl s ARG 119 Ca 0.00 -1.64 -0.27 0.00 -1.72 0.00 0.00 55.73 52.10 1lhl s ARG 119 Cb 0.00 -2.01 0.03 0.00 -0.45 0.00 0.00 34.95 32.52 1lhl s ARG 119 CO 0.00 0.19 1.26 0.34 -0.68 0.00 0.00 175.30 176.41 1lhl s ASP 120 N -3.72 6.18 0.00 0.23 2.15 -1.26 -4.84 116.67 115.41 1lhl s ASP 120 Ca 0.34 -0.43 0.21 0.00 0.43 0.00 0.00 52.55 53.10 1lhl s ASP 120 Cb -0.02 -2.55 0.53 0.00 -0.30 0.00 0.00 42.92 40.58 1lhl s ASP 120 CO 0.20 -1.80 1.44 1.33 -0.17 0.00 0.00 175.17 176.17 1lhl n VAL 121 N 6.38 0.51 -0.10 1.11 0.24 -1.26 -4.38 118.33 120.84 1lhl n VAL 121 Ca 0.03 -0.64 0.15 0.00 -2.04 0.00 0.00 64.34 61.83 1lhl n VAL 121 Cb 0.49 0.61 0.53 0.00 -1.47 0.00 0.00 33.84 34.00 1lhl n VAL 121 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 1lhl h ARG 122 N 3.47 0.34 -0.91 7.34 3.08 -1.92 -2.45 114.38 123.33 1lhl h ARG 122 Ca 0.00 -0.02 0.22 0.00 0.07 0.00 0.00 59.98 60.25 1lhl h ARG 122 Cb 0.77 -0.08 -0.12 0.00 0.08 0.00 0.00 29.97 30.63 1lhl h ARG 122 CO 0.00 0.22 0.43 -0.56 -1.07 0.00 0.00 179.97 179.00 1lhl h GLN 123 N 0.35 0.43 0.00 0.04 3.07 -1.98 -1.60 115.11 115.42 1lhl h GLN 123 Ca 0.31 -0.03 -0.03 0.00 0.09 0.00 0.00 58.65 59.00 1lhl h GLN 123 Cb 0.74 -0.10 -0.00 0.00 0.08 0.00 0.00 27.48 28.20 1lhl h GLN 123 CO -0.08 0.28 -0.12 1.88 0.09 0.00 0.00 178.83 180.88 1lhl h TYR 124 N 0.44 0.00 -0.03 0.06 0.05 -1.77 -3.02 116.97 112.69 1lhl h TYR 124 Ca 0.57 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.35 1lhl h TYR 124 Cb 1.08 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.82 1lhl h TYR 124 CO -0.11 0.12 0.00 1.33 -1.05 0.00 0.00 178.16 178.45 1lhl n VAL 125 N -3.82 0.17 -1.73 -2.88 0.24 -0.68 -4.85 118.33 104.78 1lhl n VAL 125 Ca -0.02 -0.59 -0.42 0.00 -2.04 0.00 0.00 64.34 61.27 1lhl n VAL 125 Cb 0.22 1.01 -0.02 0.00 -1.47 0.00 0.00 33.84 33.58 1lhl n VAL 125 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1lhl n GLN 126 N 0.25 2.76 -1.17 7.34 10.64 -0.76 -2.30 117.38 134.14 1lhl n GLN 126 Ca 0.04 0.99 -0.06 0.00 -1.83 0.00 0.00 57.00 56.14 1lhl n GLN 126 Cb 0.17 -2.81 -0.02 0.00 -0.86 0.00 0.00 30.24 26.71 1lhl n GLN 126 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 1lhl n GLY 127 N 3.27 0.75 0.13 2.61 0.00 -1.26 -4.91 105.19 105.77 1lhl n GLY 127 Ca 0.13 -0.25 0.13 0.00 0.00 0.00 0.00 46.02 46.03 1lhl n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lhl n GLY 129 N 1.40 0.24 0.43 0.00 0.00 -1.26 -4.83 105.19 101.17 1lhl n GLY 129 Ca 0.10 -0.68 0.05 0.00 0.00 0.00 0.00 46.02 45.49 1lhl n GLY 129 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65