#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2lhm s VAL 2 N 0.00 4.04 0.52 3.15 1.01 -1.26 -1.08 120.40 126.78 2lhm s VAL 2 Ca 0.00 -1.01 -0.20 0.00 0.00 0.00 0.00 61.98 60.78 2lhm s VAL 2 Cb 0.00 -3.26 -0.07 0.00 0.00 0.00 0.00 36.38 33.05 2lhm s VAL 2 CO 0.00 -0.17 1.10 -0.36 0.00 0.00 0.00 175.10 175.67 2lhm s PHE 3 N 1.46 2.78 0.31 5.22 0.40 -0.61 -5.01 117.98 122.52 2lhm s PHE 3 Ca -0.00 1.55 -0.10 0.00 -0.60 0.00 0.00 56.93 57.78 2lhm s PHE 3 Cb -0.19 -3.21 -0.07 0.00 0.51 0.00 0.00 43.02 40.06 2lhm s PHE 3 CO 0.04 -1.32 0.65 -1.21 0.70 0.00 0.00 175.22 174.08 2lhm s GLU 4 N -3.27 3.81 0.14 0.44 0.41 -1.26 -4.88 118.70 114.09 2lhm s GLU 4 Ca 0.71 0.37 -0.28 0.00 -0.41 0.00 0.00 54.97 55.36 2lhm s GLU 4 Cb -0.21 -2.53 -0.03 0.00 -1.78 0.00 0.00 34.13 29.58 2lhm s GLU 4 CO 0.25 0.17 1.57 -0.09 -0.49 0.00 0.00 175.26 176.67 2lhm h ARG 5 N 1.98 -0.37 -0.16 1.61 2.43 -1.96 -1.38 114.38 116.53 2lhm h ARG 5 Ca -0.47 0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 58.63 2lhm h ARG 5 Cb 1.18 0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.80 2lhm h ARG 5 CO 0.66 -0.25 -0.32 0.00 -1.51 0.00 0.00 179.97 178.55 2lhm h GLU 7 N 0.28 0.96 -0.32 0.00 4.81 -1.87 -0.91 114.58 117.53 2lhm h GLU 7 Ca 0.04 -0.12 -0.16 0.00 -0.13 0.00 0.00 59.36 58.99 2lhm h GLU 7 Cb 0.71 -0.18 -0.00 0.00 0.63 0.00 0.00 28.75 29.90 2lhm h GLU 7 CO 0.05 0.72 -0.43 1.25 -0.73 0.00 0.00 179.01 179.88 2lhm h LEU 8 N 0.94 0.92 -0.41 1.64 5.85 -0.93 -2.30 115.31 121.02 2lhm h LEU 8 Ca 0.24 -0.50 0.08 0.00 0.84 0.00 0.00 57.88 58.54 2lhm h LEU 8 Cb 0.05 -0.26 -0.08 0.00 0.37 0.00 0.00 40.66 40.74 2lhm h LEU 8 CO -0.04 1.24 -0.10 0.00 -0.34 0.00 0.00 178.44 179.21 2lhm h ALA 9 N 0.71 0.28 -0.30 1.25 0.00 -0.96 0.31 119.26 120.55 2lhm h ALA 9 Ca 0.04 0.16 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 2lhm h ALA 9 Cb 1.02 0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.11 2lhm h ALA 9 CO 0.10 -0.45 -0.24 0.00 0.00 0.00 0.00 179.25 178.66 2lhm h ARG 10 N 0.00 0.57 -0.09 0.00 3.08 -1.15 -2.26 114.38 114.54 2lhm h ARG 10 Ca 0.20 -0.22 -0.01 0.00 0.07 0.00 0.00 59.98 60.02 2lhm h ARG 10 Cb 0.30 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.32 2lhm h ARG 10 CO -0.42 0.77 0.02 1.15 -1.07 0.00 0.00 179.97 180.42 2lhm h THR 11 N 0.50 1.20 -0.54 2.04 2.02 -0.70 -2.50 112.91 114.93 2lhm h THR 11 Ca 0.07 -0.60 -0.03 0.00 0.77 0.00 0.00 66.41 66.62 2lhm h THR 11 Cb 0.69 1.43 -0.03 0.00 -1.74 0.00 0.00 68.15 68.50 2lhm h THR 11 CO 0.05 0.17 0.23 -0.07 0.37 0.00 0.00 175.52 176.27 2lhm h LEU 12 N -0.07 0.70 0.14 2.58 3.38 -0.89 -2.37 115.31 118.78 2lhm h LEU 12 Ca 0.03 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 2lhm h LEU 12 Cb 0.25 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 2lhm h LEU 12 CO 0.00 0.62 -0.08 0.50 0.09 0.00 0.00 178.44 179.57 2lhm h LYS 13 N 0.77 -0.21 -0.45 1.13 3.64 -1.27 -1.63 116.57 118.54 2lhm h LYS 13 Ca 0.19 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.67 2lhm h LYS 13 Cb 0.13 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 2lhm h LYS 13 CO -0.02 -0.14 0.31 -0.09 -2.27 0.00 0.00 179.45 177.24 2lhm h ARG 14 N -0.22 0.23 -0.06 1.90 2.43 -1.23 -0.72 114.38 116.71 2lhm h ARG 14 Ca -0.01 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.14 2lhm h ARG 14 Cb 0.18 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 2lhm h ARG 14 CO 0.02 0.15 0.00 1.28 -1.51 0.00 0.00 179.97 179.91 2lhm n LEU 15 N -4.46 0.76 -1.13 3.80 4.77 -0.91 -4.93 117.00 114.90 2lhm n LEU 15 Ca 0.07 -0.30 -0.07 0.00 -0.03 0.00 0.00 56.01 55.68 2lhm n LEU 15 Cb 0.36 -0.04 0.01 0.00 -2.33 0.00 0.00 43.42 41.42 2lhm n LEU 15 CO 0.35 0.15 0.01 0.61 -1.33 0.00 0.00 177.39 177.18 2lhm n GLY 16 N 0.98 0.35 0.12 -0.72 0.00 -0.28 -4.98 105.19 100.65 2lhm n GLY 16 Ca 0.17 -0.49 0.03 0.00 0.00 0.00 0.00 46.02 45.73 2lhm n GLY 16 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 2lhm h MET 17 N -0.48 0.00 -5.95 1.61 2.86 -1.46 -3.42 114.93 108.08 2lhm h MET 17 Ca -0.16 0.00 -0.58 0.00 -2.06 0.00 0.00 59.70 56.90 2lhm h MET 17 Cb 1.11 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.77 2lhm h MET 17 CO 0.17 0.27 1.50 0.34 1.06 0.00 0.00 176.91 180.26 2lhm s ASP 18 N -5.91 5.35 -0.01 1.22 2.15 -1.26 -1.69 116.67 116.52 2lhm s ASP 18 Ca 0.00 1.79 0.00 0.00 0.43 0.00 0.00 52.55 54.77 2lhm s ASP 18 Cb 0.08 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.19 2lhm s ASP 18 CO 0.78 -2.06 0.00 0.61 -0.17 0.00 0.00 175.17 174.33 2lhm n GLY 19 N 5.79 0.45 3.65 2.66 0.00 0.24 -4.89 105.19 113.08 2lhm n GLY 19 Ca 0.30 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 2lhm n GLY 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2lhm s TYR 20 N -2.00 1.55 -1.41 1.61 5.04 -0.68 -1.88 117.35 119.57 2lhm s TYR 20 Ca 0.00 -0.02 -0.10 0.00 -2.44 0.00 0.00 57.07 54.50 2lhm s TYR 20 Cb 0.00 -4.08 0.07 0.00 0.35 0.00 0.00 41.96 38.30 2lhm s TYR 20 CO 0.00 -4.58 0.64 0.54 -1.34 0.00 0.00 175.55 170.81 2lhm n ARG 21 N 7.62 -4.14 -1.06 4.97 5.12 -1.26 -1.19 116.66 126.73 2lhm n ARG 21 Ca 0.20 0.57 -0.02 0.00 -1.93 0.00 0.00 57.85 56.67 2lhm n ARG 21 Cb 0.43 -5.35 -0.01 0.00 -1.16 0.00 0.00 32.46 26.37 2lhm n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2lhm n GLY 22 N -1.37 0.54 3.56 -0.13 0.00 -0.79 -5.03 105.19 101.97 2lhm n GLY 22 Ca -0.01 -0.71 -0.39 0.00 0.00 0.00 0.00 46.02 44.91 2lhm n GLY 22 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2lhm s ILE 23 N -2.04 5.23 0.64 -0.61 1.01 -0.33 -4.90 121.20 120.20 2lhm s ILE 23 Ca 0.00 -0.00 -0.17 0.00 0.00 0.00 0.00 60.65 60.48 2lhm s ILE 23 Cb 0.00 -3.56 -0.01 0.00 0.01 0.00 0.00 42.46 38.90 2lhm s ILE 23 CO 0.00 0.16 1.18 -0.94 0.00 0.00 0.00 174.94 175.33 2lhm s SER 24 N 1.73 4.95 0.29 3.58 1.04 -1.26 -0.60 113.70 123.44 2lhm s SER 24 Ca 0.07 2.27 0.01 0.00 0.48 0.00 0.00 55.95 58.77 2lhm s SER 24 Cb -0.16 -2.58 0.53 0.00 0.10 0.00 0.00 66.02 63.90 2lhm s SER 24 CO 0.10 -1.75 1.88 0.25 0.98 0.00 0.00 173.24 174.71 2lhm h LEU 25 N 0.40 0.93 -1.73 2.42 5.85 -1.90 -1.64 115.31 119.63 2lhm h LEU 25 Ca -0.49 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.25 2lhm h LEU 25 Cb 1.28 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.13 2lhm h LEU 25 CO 0.54 0.56 0.14 0.00 -0.34 0.00 0.00 178.44 179.34 2lhm h ALA 26 N 1.51 1.80 -0.11 1.25 0.00 -1.92 -0.33 119.26 121.47 2lhm h ALA 26 Ca 0.43 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.29 2lhm h ALA 26 Cb 0.31 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 2lhm h ALA 26 CO -0.19 0.18 -0.02 -0.91 0.00 0.00 0.00 179.25 178.31 2lhm h ASN 27 N 0.33 0.20 -0.49 0.00 2.35 -1.63 0.35 115.58 116.68 2lhm h ASN 27 Ca 0.09 -0.36 -0.02 0.00 -0.55 0.00 0.00 56.30 55.47 2lhm h ASN 27 Cb -0.01 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.28 2lhm h ASN 27 CO -0.02 0.51 0.26 -0.50 -1.65 0.00 0.00 177.43 176.03 2lhm h TRP 28 N -0.11 0.71 -0.28 1.19 4.06 -1.10 -0.83 115.95 119.59 2lhm h TRP 28 Ca 0.03 -0.01 -0.03 0.00 2.06 0.00 0.00 58.89 60.93 2lhm h TRP 28 Cb 0.42 -0.23 -0.01 0.00 -1.00 0.00 0.00 29.16 28.34 2lhm h TRP 28 CO 0.05 0.52 0.05 0.52 -3.56 0.00 0.00 178.44 176.01 2lhm h MET 29 N 0.73 0.47 -0.45 0.49 2.86 -0.91 -1.80 114.93 116.31 2lhm h MET 29 Ca 0.18 -0.13 0.05 0.00 -2.06 0.00 0.00 59.70 57.74 2lhm h MET 29 Cb 0.06 -0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.63 2lhm h MET 29 CO -0.03 0.58 0.20 0.00 1.06 0.00 0.00 176.91 178.72 2lhm h LEU 31 N 0.40 -1.08 -1.49 0.00 5.85 -1.02 -2.21 115.31 115.77 2lhm h LEU 31 Ca 0.20 0.08 0.03 0.00 0.84 0.00 0.00 57.88 59.03 2lhm h LEU 31 Cb 0.15 0.35 -0.03 0.00 0.37 0.00 0.00 40.66 41.49 2lhm h LEU 31 CO -0.17 -0.58 0.38 0.00 -0.34 0.00 0.00 178.44 177.73 2lhm h ALA 32 N -0.56 1.69 0.02 1.25 0.00 -1.10 0.18 119.26 120.75 2lhm h ALA 32 Ca -0.05 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 2lhm h ALA 32 Cb 0.76 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.36 2lhm h ALA 32 CO -0.02 0.25 -0.01 -0.22 0.00 0.00 0.00 179.25 179.25 2lhm h LYS 33 N 0.68 -0.03 0.00 0.00 1.63 -1.09 -1.47 116.57 116.28 2lhm h LYS 33 Ca 0.23 0.00 -0.13 0.00 -0.85 0.00 0.00 60.65 59.90 2lhm h LYS 33 Cb 0.07 0.01 -0.02 0.00 -0.60 0.00 0.00 32.23 31.69 2lhm h LYS 33 CO -0.06 0.11 -0.64 -1.49 -3.45 0.00 0.00 179.45 173.92 2lhm h TRP 34 N -0.16 0.00 0.02 1.91 4.06 -0.99 -2.12 115.95 118.67 2lhm h TRP 34 Ca -0.00 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.95 2lhm h TRP 34 Cb 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.31 2lhm h TRP 34 CO -0.03 0.64 -0.01 0.93 -3.56 0.00 0.00 178.44 176.40 2lhm h GLU 35 N 0.00 -0.03 0.00 0.49 4.39 -0.61 -3.42 114.58 115.40 2lhm h GLU 35 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 2lhm h GLU 35 Cb 1.38 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 30.04 2lhm h GLU 35 CO 0.08 0.68 0.00 -1.13 -1.16 0.00 0.00 179.01 177.48 2lhm n SER 36 N -4.71 0.47 -1.58 1.42 3.41 -0.61 -4.87 113.62 107.15 2lhm n SER 36 Ca -0.08 -0.78 -0.13 0.00 -0.26 0.00 0.00 58.87 57.62 2lhm n SER 36 Cb 0.35 0.24 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 2lhm n SER 36 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2lhm n GLY 37 N 0.24 -0.13 2.25 5.00 0.00 -0.80 -2.23 105.19 109.53 2lhm n GLY 37 Ca 0.00 -0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.58 2lhm n GLY 37 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2lhm n TYR 38 N -4.01 -0.55 -3.62 1.61 4.01 -1.10 -4.82 117.16 108.67 2lhm n TYR 38 Ca -0.13 0.00 -0.38 0.00 -0.16 0.00 0.00 57.90 57.23 2lhm n TYR 38 Cb 0.61 -2.76 -0.11 0.00 -0.31 0.00 0.00 39.34 36.76 2lhm n TYR 38 CO 0.00 0.00 0.00 1.21 -0.46 0.00 0.00 176.86 177.61 2lhm s ASN 39 N -2.47 5.81 0.38 7.72 3.84 -0.94 -1.57 114.94 127.70 2lhm s ASN 39 Ca 0.00 -0.10 0.27 0.00 0.21 0.00 0.00 52.86 53.24 2lhm s ASN 39 Cb 0.00 -2.07 0.88 0.00 -0.55 0.00 0.00 41.25 39.51 2lhm s ASN 39 CO 0.00 -0.06 1.78 0.71 -2.79 0.00 0.00 177.10 176.73 2lhm h THR 40 N 5.43 0.00 -0.12 -5.21 1.35 -1.43 -3.21 112.91 109.72 2lhm h THR 40 Ca -0.35 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.94 2lhm h THR 40 Cb 1.18 1.51 0.00 0.00 -1.73 0.00 0.00 68.15 69.11 2lhm h THR 40 CO 0.56 0.00 0.00 -2.11 -0.25 0.00 0.00 175.52 173.72 2lhm n ARG 41 N -2.71 2.24 -1.69 4.72 1.85 -1.26 -4.21 116.66 115.60 2lhm n ARG 41 Ca 0.03 -1.82 -0.43 0.00 -1.00 0.00 0.00 57.85 54.63 2lhm n ARG 41 Cb 0.38 -1.47 -0.01 0.00 -1.05 0.00 0.00 32.46 30.30 2lhm n ARG 41 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2lhm n ALA 42 N 1.14 1.28 -2.98 2.89 0.00 -1.22 -4.79 120.51 116.84 2lhm n ALA 42 Ca 0.16 0.37 -0.11 0.00 0.00 0.00 0.00 53.44 53.86 2lhm n ALA 42 Cb 0.55 -2.26 -0.12 0.00 0.00 0.00 0.00 19.45 17.61 2lhm n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2lhm s THR 43 N -0.86 0.04 -0.14 0.00 -4.23 -1.26 -1.12 115.64 108.07 2lhm s THR 43 Ca 0.58 -0.30 -0.04 0.00 -1.18 0.00 0.00 61.69 60.76 2lhm s THR 43 Cb -0.58 -0.19 0.05 0.00 1.34 0.00 0.00 72.50 73.11 2lhm s THR 43 CO 0.59 -0.16 0.06 0.21 -0.54 0.00 0.00 174.62 174.78 2lhm s ASN 44 N -0.49 2.15 -0.04 3.99 2.47 -0.65 -4.97 114.94 117.40 2lhm s ASN 44 Ca -0.06 -0.47 -0.29 0.00 0.42 0.00 0.00 52.86 52.47 2lhm s ASN 44 Cb -0.04 -0.31 -0.03 0.00 -1.45 0.00 0.00 41.25 39.42 2lhm s ASN 44 CO 0.00 -0.31 0.93 -0.47 -3.72 0.00 0.00 177.10 173.54 2lhm s TYR 45 N 2.07 3.61 -0.65 0.43 5.04 -1.26 -0.97 117.35 125.61 2lhm s TYR 45 Ca 0.02 1.58 -0.14 0.00 -2.44 0.00 0.00 57.07 56.10 2lhm s TYR 45 Cb -0.15 -3.08 0.16 0.00 0.35 0.00 0.00 41.96 39.25 2lhm s TYR 45 CO -0.07 -0.05 0.59 -0.80 -1.34 0.00 0.00 175.55 173.87 2lhm s ASN 46 N 1.00 6.32 0.46 4.32 0.01 0.12 -4.92 114.94 122.25 2lhm s ASN 46 Ca 0.48 -2.20 0.19 0.00 -0.71 0.00 0.00 52.86 50.62 2lhm s ASN 46 Cb -0.20 -2.17 1.17 0.00 0.41 0.00 0.00 41.25 40.46 2lhm s ASN 46 CO 0.24 -0.71 1.95 0.00 -1.51 0.00 0.00 177.10 177.07 2lhm h ALA 47 N 8.33 2.24 -0.68 0.60 0.00 -1.95 0.28 119.26 128.08 2lhm h ALA 47 Ca -0.12 -0.01 0.11 0.00 0.00 0.00 0.00 54.91 54.89 2lhm h ALA 47 Cb 1.07 -0.03 -0.08 0.00 0.00 0.00 0.00 17.79 18.75 2lhm h ALA 47 CO 0.90 -0.42 0.28 0.78 0.00 0.00 0.00 179.25 180.78 2lhm h GLY 48 N 0.27 1.00 0.00 0.00 0.00 -1.94 -3.25 103.07 99.16 2lhm h GLY 48 Ca 0.32 -0.15 0.00 0.00 0.00 0.00 0.00 47.33 47.50 2lhm h GLY 48 CO -0.08 -0.03 0.00 2.09 0.00 0.00 0.00 176.54 178.53 2lhm n ASP 49 N -4.97 0.88 -0.56 0.19 5.75 -1.09 -5.02 116.55 111.74 2lhm n ASP 49 Ca 0.11 -1.24 -0.07 0.00 -0.01 0.00 0.00 54.79 53.58 2lhm n ASP 49 Cb 0.32 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.38 2lhm n ASP 49 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 2lhm n ARG 50 N -0.12 -0.58 -3.64 0.11 1.74 0.07 -4.81 116.66 109.43 2lhm n ARG 50 Ca 0.00 0.73 -0.21 0.00 -0.77 0.00 0.00 57.85 57.61 2lhm n ARG 50 Cb 0.18 -4.55 -0.03 0.00 -1.02 0.00 0.00 32.46 27.04 2lhm n ARG 50 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2lhm s SER 51 N -2.83 5.28 0.02 0.55 1.04 -1.18 -4.54 113.70 112.03 2lhm s SER 51 Ca 0.00 -0.56 0.04 0.00 0.48 0.00 0.00 55.95 55.92 2lhm s SER 51 Cb 0.00 -0.82 -0.02 0.00 0.10 0.00 0.00 66.02 65.28 2lhm s SER 51 CO 0.00 -0.50 -0.13 -0.89 0.98 0.00 0.00 173.24 172.70 2lhm s THR 52 N -2.36 1.05 -0.16 2.02 2.01 -1.26 -0.70 115.64 116.24 2lhm s THR 52 Ca 0.45 -0.82 -0.07 0.00 0.31 0.00 0.00 61.69 61.56 2lhm s THR 52 Cb -0.05 -0.93 -0.04 0.00 0.01 0.00 0.00 72.50 71.49 2lhm s THR 52 CO 0.28 0.10 0.08 -1.81 -0.69 0.00 0.00 174.62 172.58 2lhm s ASP 53 N -0.82 5.84 0.01 3.53 1.01 -0.15 -1.21 116.67 124.89 2lhm s ASP 53 Ca 0.03 0.19 0.07 0.00 0.71 0.00 0.00 52.55 53.55 2lhm s ASP 53 Cb -0.07 -1.95 -0.02 0.00 1.01 0.00 0.00 42.92 41.90 2lhm s ASP 53 CO 0.01 0.25 -0.22 -0.31 0.21 0.00 0.00 175.17 175.10 2lhm s TYR 54 N -0.07 1.97 0.00 4.23 1.51 0.09 -1.63 117.35 123.45 2lhm s TYR 54 Ca 0.08 -0.38 0.00 0.00 -1.01 0.00 0.00 57.07 55.76 2lhm s TYR 54 Cb -0.12 -1.23 0.00 0.00 -0.11 0.00 0.00 41.96 40.50 2lhm s TYR 54 CO 0.01 0.02 0.00 0.41 -1.11 0.00 0.00 175.55 174.88 2lhm n GLY 55 N 2.25 -2.00 0.31 0.71 0.00 -0.28 -1.28 105.19 104.90 2lhm n GLY 55 Ca -0.16 -1.39 0.06 0.00 0.00 0.00 0.00 46.02 44.53 2lhm n GLY 55 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2lhm h ILE 56 N -0.00 1.05 -0.12 -0.61 2.10 -1.72 -1.46 117.51 116.75 2lhm h ILE 56 Ca 0.00 -0.14 0.00 0.00 1.08 0.00 0.00 64.86 65.80 2lhm h ILE 56 Cb 0.00 0.60 0.00 0.00 -1.09 0.00 0.00 36.82 36.33 2lhm h ILE 56 CO 0.00 0.08 0.00 0.49 -1.08 0.00 0.00 178.15 177.64 2lhm n PHE 57 N -4.49 0.13 -3.62 2.19 3.72 -1.26 -3.81 117.46 110.32 2lhm n PHE 57 Ca 0.03 -0.07 -0.26 0.00 -0.05 0.00 0.00 57.45 57.09 2lhm n PHE 57 Cb 0.12 -0.00 0.03 0.00 -0.94 0.00 0.00 39.48 38.69 2lhm n PHE 57 CO 0.00 0.00 0.00 1.04 -0.05 0.00 0.00 176.76 177.75 2lhm n GLN 58 N 1.23 -1.25 -2.61 -1.08 1.13 -0.55 -4.90 117.38 109.35 2lhm n GLN 58 Ca 0.14 0.64 -0.42 0.00 -1.94 0.00 0.00 57.00 55.42 2lhm n GLN 58 Cb 0.54 -3.99 -0.03 0.00 0.11 0.00 0.00 30.24 26.87 2lhm n GLN 58 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 2lhm s ILE 59 N -3.32 4.59 0.12 5.09 1.01 -0.40 -4.49 121.20 123.80 2lhm s ILE 59 Ca 0.33 1.87 -0.27 0.00 0.00 0.00 0.00 60.65 62.58 2lhm s ILE 59 Cb -0.12 -4.20 -0.07 0.00 0.01 0.00 0.00 42.46 38.08 2lhm s ILE 59 CO 0.85 0.07 0.84 0.21 0.00 0.00 0.00 174.94 176.91 2lhm s ASN 60 N 1.14 7.38 0.27 3.58 3.84 -1.26 -0.73 114.94 129.17 2lhm s ASN 60 Ca 0.53 1.65 0.23 0.00 0.21 0.00 0.00 52.86 55.47 2lhm s ASN 60 Cb -0.22 -2.52 1.01 0.00 -0.55 0.00 0.00 41.25 38.97 2lhm s ASN 60 CO 0.23 0.07 1.71 -1.54 -2.79 0.00 0.00 177.10 174.78 2lhm n SER 61 N 2.30 0.67 -0.01 -4.21 3.41 -0.35 -1.91 113.62 113.52 2lhm n SER 61 Ca -0.02 0.68 -0.08 0.00 -0.26 0.00 0.00 58.87 59.19 2lhm n SER 61 Cb 0.49 -0.82 0.08 0.00 -0.26 0.00 0.00 64.21 63.71 2lhm n SER 61 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2lhm h ARG 62 N 0.00 0.59 0.00 4.33 2.43 -1.83 -3.40 114.38 116.50 2lhm h ARG 62 Ca 0.00 -0.32 0.00 0.00 -0.81 0.00 0.00 59.98 58.85 2lhm h ARG 62 Cb 0.32 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.88 2lhm h ARG 62 CO 0.00 0.92 -0.99 0.66 -1.51 0.00 0.00 179.97 179.04 2lhm n TYR 63 N -4.01 0.00 -0.10 2.20 4.01 -1.20 -0.61 117.16 117.44 2lhm n TYR 63 Ca -0.02 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.60 2lhm n TYR 63 Cb 0.54 0.00 -0.15 0.00 -0.31 0.00 0.00 39.34 39.42 2lhm n TYR 63 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 2lhm n TRP 64 N -2.09 0.03 -4.26 -0.72 7.02 -0.80 -0.87 117.44 115.75 2lhm n TRP 64 Ca 0.00 0.01 -0.14 0.00 -1.02 0.00 0.00 57.50 56.35 2lhm n TRP 64 Cb 0.50 -1.01 -0.10 0.00 -2.42 0.00 0.00 31.31 28.28 2lhm n TRP 64 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2lhm s ASN 66 N -3.20 5.88 0.00 0.00 2.47 0.49 -4.58 114.94 116.00 2lhm s ASN 66 Ca 0.23 0.15 0.00 0.00 0.42 0.00 0.00 52.86 53.66 2lhm s ASN 66 Cb 0.05 -2.02 0.00 0.00 -1.45 0.00 0.00 41.25 37.83 2lhm s ASN 66 CO 0.04 0.18 0.46 -0.90 -3.72 0.00 0.00 177.10 173.16 2lhm n ASP 67 N 3.52 0.91 0.00 -4.21 5.75 -1.26 -1.29 116.55 119.97 2lhm n ASP 67 Ca -0.16 -1.10 0.00 0.00 -0.01 0.00 0.00 54.79 53.52 2lhm n ASP 67 Cb 0.52 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.61 2lhm n ASP 67 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2lhm n GLY 68 N -0.05 0.84 1.08 6.12 0.00 -1.26 -4.67 105.19 107.26 2lhm n GLY 68 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.09 2lhm n GLY 68 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2lhm n LYS 69 N 0.00 2.62 -3.59 1.61 2.85 -1.26 -4.84 118.16 115.55 2lhm n LYS 69 Ca 0.00 -1.90 -0.38 0.00 -1.05 0.00 0.00 58.31 54.98 2lhm n LYS 69 Cb 0.00 -1.58 -0.11 0.00 -0.65 0.00 0.00 35.03 32.69 2lhm n LYS 69 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 177.40 178.34 2lhm s THR 70 N -1.60 5.24 0.36 0.58 2.01 -1.26 -4.96 115.64 116.01 2lhm s THR 70 Ca 0.34 0.05 -0.27 0.00 0.31 0.00 0.00 61.69 62.12 2lhm s THR 70 Cb 0.21 -3.54 -0.09 0.00 0.01 0.00 0.00 72.50 69.08 2lhm s THR 70 CO 0.19 0.19 1.27 -2.16 -0.69 0.00 0.00 174.62 173.42 2lhm s PRO 71 N 1.74 4.21 -1.88 4.92 0.04 -1.26 -3.24 135.00 139.53 2lhm s PRO 71 Ca 0.07 2.11 0.00 0.00 0.04 0.00 0.00 61.00 63.21 2lhm s PRO 71 Cb -0.16 -2.92 0.00 0.00 0.04 0.00 0.00 34.50 31.45 2lhm s PRO 71 CO 0.10 -0.27 0.00 0.41 0.04 0.00 0.00 177.00 177.29 2lhm n GLY 72 N 0.76 1.73 3.83 0.56 0.00 -1.26 -4.97 105.19 105.85 2lhm n GLY 72 Ca 0.02 -0.12 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 2lhm n GLY 72 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2lhm s ALA 73 N -2.61 2.83 0.27 4.61 0.00 -1.20 -4.99 121.76 120.66 2lhm s ALA 73 Ca 0.00 0.05 0.06 0.00 0.00 0.00 0.00 51.96 52.07 2lhm s ALA 73 Cb 0.00 -3.15 -0.06 0.00 0.00 0.00 0.00 23.12 19.92 2lhm s ALA 73 CO 0.00 -1.01 -0.04 0.14 0.00 0.00 0.00 175.76 174.85 2lhm s VAL 74 N -3.04 1.50 -0.50 0.00 -7.23 0.22 -5.01 120.40 106.34 2lhm s VAL 74 Ca 0.57 -2.10 0.07 0.00 -1.81 0.00 0.00 61.98 58.71 2lhm s VAL 74 Cb -0.13 -2.42 0.24 0.00 0.56 0.00 0.00 36.38 34.62 2lhm s VAL 74 CO 0.53 -0.31 0.58 -3.20 -0.31 0.00 0.00 175.10 172.39 2lhm n ASN 75 N -0.54 1.49 0.21 4.85 5.15 -1.22 -3.70 115.26 121.49 2lhm n ASN 75 Ca -0.05 -2.94 0.08 0.00 -0.60 0.00 0.00 54.58 51.06 2lhm n ASN 75 Cb 0.63 -0.65 0.61 0.00 -0.53 0.00 0.00 39.78 39.84 2lhm n ASN 75 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2lhm h ALA 76 N 4.30 1.98 0.00 5.20 0.00 -0.98 -2.21 119.26 127.54 2lhm h ALA 76 Ca 0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2lhm h ALA 76 Cb 0.80 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.57 2lhm h ALA 76 CO 0.59 0.01 -0.38 0.00 0.00 0.00 0.00 179.25 179.47 2lhm n HIS 78 N -1.55 -2.00 -4.04 0.00 -0.00 -0.83 -4.98 115.22 101.82 2lhm n HIS 78 Ca 0.06 0.82 -0.11 0.00 -0.00 0.00 0.00 57.72 58.49 2lhm n HIS 78 Cb 0.34 -4.63 -0.11 0.00 -0.00 0.00 0.00 29.99 25.60 2lhm n HIS 78 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.34 175.83 2lhm s LEU 79 N -5.88 2.29 0.19 2.41 1.43 -1.26 -5.06 118.68 112.80 2lhm s LEU 79 Ca 0.10 -0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 52.29 2lhm s LEU 79 Cb -0.04 -0.01 -0.08 0.00 0.03 0.00 0.00 46.19 46.09 2lhm s LEU 79 CO 0.63 -0.30 1.14 -0.55 0.23 0.00 0.00 176.35 177.50 2lhm s SER 80 N -1.76 7.18 0.57 2.29 0.15 -1.26 -0.38 113.70 120.49 2lhm s SER 80 Ca -0.09 2.18 0.28 0.00 0.70 0.00 0.00 55.95 59.01 2lhm s SER 80 Cb -0.07 -2.61 1.68 0.00 -1.71 0.00 0.00 66.02 63.31 2lhm s SER 80 CO -0.02 -0.28 2.21 0.00 1.20 0.00 0.00 173.24 176.35 2lhm h SER 82 N 0.00 0.53 -0.04 0.00 0.87 -1.91 -2.48 113.55 110.53 2lhm h SER 82 Ca -0.00 0.02 0.01 0.00 -1.23 0.00 0.00 61.79 60.59 2lhm h SER 82 Cb 0.07 -0.09 -0.00 0.00 -0.44 0.00 0.00 62.40 61.94 2lhm h SER 82 CO 0.00 0.30 0.04 0.00 -0.53 0.00 0.00 176.83 176.64 2lhm h ALA 83 N 1.63 1.61 -0.33 6.23 0.00 -1.59 -1.99 119.26 124.80 2lhm h ALA 83 Ca 0.37 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.28 2lhm h ALA 83 Cb 0.62 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2lhm h ALA 83 CO -0.14 -0.06 0.00 1.28 0.00 0.00 0.00 179.25 180.33 2lhm n LEU 84 N -3.87 2.58 -0.10 0.00 4.77 -0.93 -4.03 117.00 115.42 2lhm n LEU 84 Ca -0.02 -1.30 0.01 0.00 -0.03 0.00 0.00 56.01 54.67 2lhm n LEU 84 Cb 0.13 -0.40 0.02 0.00 -2.33 0.00 0.00 43.42 40.85 2lhm n LEU 84 CO 0.28 0.47 0.48 0.18 -1.33 0.00 0.00 177.39 177.47 2lhm n LEU 85 N 0.47 1.98 -4.91 2.23 4.77 -0.75 -3.30 117.00 117.49 2lhm n LEU 85 Ca 0.13 -1.82 -0.28 0.00 -0.03 0.00 0.00 56.01 54.01 2lhm n LEU 85 Cb 0.49 -0.03 0.07 0.00 -2.33 0.00 0.00 43.42 41.62 2lhm n LEU 85 CO 0.12 0.49 0.71 -0.62 -1.33 0.00 0.00 177.39 176.76 2lhm s ASP 86 N -0.85 4.81 0.17 -1.43 -1.08 -1.26 -4.50 116.67 112.53 2lhm s ASP 86 Ca 0.04 0.73 0.24 0.00 -0.52 0.00 0.00 52.55 53.03 2lhm s ASP 86 Cb 0.02 -1.35 0.90 0.00 -1.46 0.00 0.00 42.92 41.04 2lhm s ASP 86 CO 0.03 -1.67 1.72 0.47 0.52 0.00 0.00 175.17 176.23 2lhm n ASP 87 N -3.10 0.52 -4.84 -0.34 8.00 -1.26 -4.73 116.55 110.80 2lhm n ASP 87 Ca 0.08 0.59 -0.37 0.00 0.71 0.00 0.00 54.79 55.80 2lhm n ASP 87 Cb 0.60 -0.72 -0.06 0.00 -0.02 0.00 0.00 41.12 40.92 2lhm n ASP 87 CO 0.00 0.00 0.00 0.21 -0.39 0.00 0.00 177.20 177.02 2lhm s ASN 88 N -3.97 6.53 -0.18 -2.24 3.84 -1.26 -4.83 114.94 112.83 2lhm s ASN 88 Ca 0.08 0.63 0.17 0.00 0.21 0.00 0.00 52.86 53.95 2lhm s ASN 88 Cb 0.11 -2.15 0.51 0.00 -0.55 0.00 0.00 41.25 39.18 2lhm s ASN 88 CO 0.45 0.33 1.40 2.30 -2.79 0.00 0.00 177.10 178.79 2lhm n ILE 89 N 2.21 2.27 -0.28 -5.21 -5.35 -1.26 -4.62 119.36 107.11 2lhm n ILE 89 Ca -0.17 -1.92 -0.04 0.00 -0.27 0.00 0.00 62.75 60.36 2lhm n ILE 89 Cb 0.54 -0.26 0.08 0.00 -1.74 0.00 0.00 39.64 38.26 2lhm n ILE 89 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2lhm h ALA 90 N 1.67 1.01 -0.36 -1.28 0.00 -1.96 0.25 119.26 118.58 2lhm h ALA 90 Ca 0.00 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.71 2lhm h ALA 90 Cb 1.42 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 2lhm h ALA 90 CO 0.21 0.37 -0.37 -0.44 0.00 0.00 0.00 179.25 179.02 2lhm h ASP 91 N 1.03 0.95 -0.65 0.00 3.32 -1.89 -1.69 116.42 117.49 2lhm h ASP 91 Ca 0.30 -0.47 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 2lhm h ASP 91 Cb -0.07 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.18 2lhm h ASP 91 CO -0.08 1.23 0.36 0.44 -1.72 0.00 0.00 179.24 179.46 2lhm h ASP 92 N 0.69 0.81 -0.22 6.45 5.19 -1.75 -1.64 116.42 125.94 2lhm h ASP 92 Ca 0.05 -0.09 -0.04 0.00 -0.62 0.00 0.00 57.03 56.33 2lhm h ASP 92 Cb 0.97 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 40.26 2lhm h ASP 92 CO 0.09 0.67 -0.04 0.58 -3.12 0.00 0.00 179.24 177.43 2lhm h VAL 93 N 0.88 1.28 -0.74 -1.35 2.07 -0.91 0.77 116.25 118.24 2lhm h VAL 93 Ca 0.23 -1.00 0.00 0.00 0.82 0.00 0.00 66.70 66.75 2lhm h VAL 93 Cb 0.04 1.49 -0.04 0.00 -1.52 0.00 0.00 31.29 31.27 2lhm h VAL 93 CO -0.04 0.31 0.46 0.00 0.02 0.00 0.00 177.57 178.32 2lhm h ALA 94 N 0.76 1.42 -0.09 1.67 0.00 -1.20 -1.64 119.26 120.18 2lhm h ALA 94 Ca 0.06 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 2lhm h ALA 94 Cb 0.47 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2lhm h ALA 94 CO 0.02 0.52 -0.27 0.00 0.00 0.00 0.00 179.25 179.52 2lhm h ALA 96 N 0.48 1.74 -0.78 0.00 0.00 -0.68 0.80 119.26 120.82 2lhm h ALA 96 Ca -0.01 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 2lhm h ALA 96 Cb 0.89 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 18.47 2lhm h ALA 96 CO 0.06 0.11 0.30 0.87 0.00 0.00 0.00 179.25 180.58 2lhm h LYS 97 N 0.74 1.18 -0.35 0.00 1.57 -1.27 -2.16 116.57 116.27 2lhm h LYS 97 Ca 0.35 -0.22 -0.07 0.00 -1.87 0.00 0.00 60.65 58.85 2lhm h LYS 97 Cb 0.40 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.51 2lhm h LYS 97 CO -0.13 0.96 -0.03 -0.09 -0.57 0.00 0.00 179.45 179.59 2lhm h ARG 98 N 1.14 0.65 -0.36 3.15 9.65 -0.64 -2.87 114.38 125.09 2lhm h ARG 98 Ca 0.26 -0.22 0.06 0.00 -1.10 0.00 0.00 59.98 58.97 2lhm h ARG 98 Cb 0.24 -0.05 -0.05 0.00 -1.39 0.00 0.00 29.97 28.72 2lhm h ARG 98 CO -0.02 0.78 0.06 0.28 2.80 0.00 0.00 179.97 183.87 2lhm h VAL 99 N 0.45 0.80 0.00 0.20 2.07 -0.61 -1.82 116.25 117.34 2lhm h VAL 99 Ca 0.10 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.56 2lhm h VAL 99 Cb 0.51 0.61 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 2lhm h VAL 99 CO 0.02 0.03 0.00 1.33 0.02 0.00 0.00 177.57 178.98 2lhm n VAL 100 N -5.11 0.71 0.59 2.57 0.24 -0.85 -2.52 118.33 113.97 2lhm n VAL 100 Ca 0.02 0.18 0.12 0.00 -2.04 0.00 0.00 64.34 62.62 2lhm n VAL 100 Cb 0.17 -0.90 0.45 0.00 -1.47 0.00 0.00 33.84 32.09 2lhm n VAL 100 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2lhm n ARG 101 N -1.41 0.19 -2.79 7.34 1.74 -0.68 -4.22 116.66 116.82 2lhm n ARG 101 Ca 0.06 0.25 -0.31 0.00 -0.77 0.00 0.00 57.85 57.08 2lhm n ARG 101 Cb 0.17 -1.77 -0.04 0.00 -1.02 0.00 0.00 32.46 29.81 2lhm n ARG 101 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2lhm s ASP 102 N -4.16 6.57 0.30 0.55 1.11 -1.05 -4.96 116.67 115.04 2lhm s ASP 102 Ca 0.09 1.24 -0.00 0.00 0.18 0.00 0.00 52.55 54.05 2lhm s ASP 102 Cb 0.12 -2.37 0.69 0.00 1.07 0.00 0.00 42.92 42.43 2lhm s ASP 102 CO 0.50 -0.42 1.58 -0.65 1.18 0.00 0.00 175.17 177.37 2lhm h PRO 103 N 1.29 0.03 -0.52 8.23 0.10 -1.89 0.20 132.00 139.43 2lhm h PRO 103 Ca -0.47 -0.00 0.11 0.00 0.10 0.00 0.00 66.00 65.74 2lhm h PRO 103 Cb 1.19 -0.01 -0.03 0.00 0.10 0.00 0.00 31.00 32.25 2lhm h PRO 103 CO 0.63 0.02 0.36 1.96 0.10 0.00 0.00 178.00 181.07 2lhm h GLN 104 N 0.03 0.20 0.00 1.05 4.20 -1.91 -3.47 115.11 115.21 2lhm h GLN 104 Ca 0.56 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 59.26 2lhm h GLN 104 Cb 1.12 -0.05 0.00 0.00 0.30 0.00 0.00 27.48 28.86 2lhm h GLN 104 CO -0.89 0.13 0.00 0.41 -0.67 0.00 0.00 178.83 177.81 2lhm n GLY 105 N -1.57 1.57 0.15 3.46 0.00 0.69 -2.15 105.19 107.35 2lhm n GLY 105 Ca 0.09 -0.62 0.12 0.00 0.00 0.00 0.00 46.02 45.61 2lhm n GLY 105 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2lhm h ILE 106 N 0.00 0.00 0.00 -0.61 2.10 -1.89 -2.82 117.51 114.29 2lhm h ILE 106 Ca 0.00 -0.18 0.00 0.00 1.08 0.00 0.00 64.86 65.76 2lhm h ILE 106 Cb 0.00 0.87 0.00 0.00 -1.09 0.00 0.00 36.82 36.60 2lhm h ILE 106 CO 0.00 0.00 0.00 0.54 -1.08 0.00 0.00 178.15 177.61 2lhm n ARG 107 N -2.31 0.18 0.17 2.19 1.74 -0.91 -2.47 116.66 115.25 2lhm n ARG 107 Ca 0.01 0.51 0.18 0.00 -0.77 0.00 0.00 57.85 57.78 2lhm n ARG 107 Cb 0.18 -1.92 0.79 0.00 -1.02 0.00 0.00 32.46 30.50 2lhm n ARG 107 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2lhm h ALA 108 N 2.16 1.94 -2.65 7.54 0.00 -1.65 -3.36 119.26 123.24 2lhm h ALA 108 Ca 0.00 -0.01 -0.70 0.00 0.00 0.00 0.00 54.91 54.20 2lhm h ALA 108 Cb 0.23 0.02 -0.21 0.00 0.00 0.00 0.00 17.79 17.83 2lhm h ALA 108 CO 0.00 -0.38 -0.47 -1.58 0.00 0.00 0.00 179.25 176.82 2lhm s TRP 109 N -4.69 3.23 0.34 0.00 0.51 -1.03 -4.98 118.94 112.32 2lhm s TRP 109 Ca -0.05 -0.57 0.03 0.00 -2.12 0.00 0.00 56.10 53.39 2lhm s TRP 109 Cb 0.16 -2.51 0.61 0.00 -0.81 0.00 0.00 33.47 30.91 2lhm s TRP 109 CO 0.57 -0.53 1.94 -0.24 -0.51 0.00 0.00 176.95 178.18 2lhm h VAL 110 N 5.65 1.18 -0.20 4.03 3.04 -1.88 -2.04 116.25 126.03 2lhm h VAL 110 Ca -0.28 -0.52 0.06 0.00 -1.01 0.00 0.00 66.70 64.95 2lhm h VAL 110 Cb 1.13 0.55 -0.01 0.00 -2.01 0.00 0.00 31.29 30.95 2lhm h VAL 110 CO 0.68 0.21 0.21 0.00 -1.01 0.00 0.00 177.57 177.66 2lhm h ALA 111 N 1.54 1.88 -0.34 3.17 0.00 -1.93 -0.53 119.26 123.04 2lhm h ALA 111 Ca 0.18 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 55.00 2lhm h ALA 111 Cb 0.10 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2lhm h ALA 111 CO -0.02 -0.31 -0.11 2.35 0.00 0.00 0.00 179.25 181.16 2lhm h TRP 112 N 0.00 0.76 -0.38 0.00 7.01 -1.67 0.34 115.95 122.01 2lhm h TRP 112 Ca 0.10 -0.17 -0.06 0.00 2.11 0.00 0.00 58.89 60.87 2lhm h TRP 112 Cb 0.51 -0.18 -0.01 0.00 -2.10 0.00 0.00 29.16 27.37 2lhm h TRP 112 CO 0.00 0.85 0.01 0.00 -2.79 0.00 0.00 178.44 176.51 2lhm h ARG 113 N 0.46 0.66 -0.28 2.65 3.08 -1.23 0.15 114.38 119.87 2lhm h ARG 113 Ca 0.08 -0.21 -0.17 0.00 0.07 0.00 0.00 59.98 59.76 2lhm h ARG 113 Cb 0.62 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 2lhm h ARG 113 CO 0.04 0.76 -0.50 -0.91 -1.07 0.00 0.00 179.97 178.28 2lhm h ASN 114 N 0.48 0.87 0.00 7.04 2.35 -1.00 -3.36 115.58 121.97 2lhm h ASN 114 Ca 0.11 -0.45 0.00 0.00 -0.55 0.00 0.00 56.30 55.41 2lhm h ASN 114 Cb 0.46 -0.25 0.00 0.00 0.05 0.00 0.00 38.32 38.58 2lhm h ASN 114 CO 0.02 1.22 -1.51 0.54 -1.65 0.00 0.00 177.43 176.04 2lhm n ARG 115 N -4.01 0.67 0.00 0.81 5.12 0.12 -4.86 116.66 114.51 2lhm n ARG 115 Ca -0.03 -0.11 0.00 0.00 -1.93 0.00 0.00 57.85 55.77 2lhm n ARG 115 Cb 0.60 -1.30 0.00 0.00 -1.16 0.00 0.00 32.46 30.59 2lhm n ARG 115 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2lhm n GLN 117 N -2.20 2.70 -2.83 0.00 7.27 0.16 -2.56 117.38 119.92 2lhm n GLN 117 Ca 0.00 0.96 -0.19 0.00 0.07 0.00 0.00 57.00 57.84 2lhm n GLN 117 Cb 0.48 -2.74 0.00 0.00 2.41 0.00 0.00 30.24 30.40 2lhm n GLN 117 CO 0.00 0.00 0.00 0.09 0.07 0.00 0.00 177.06 177.22 2lhm n ASN 118 N 1.96 -4.74 -4.57 1.69 5.03 -1.26 -4.98 115.26 108.38 2lhm n ASN 118 Ca 0.08 -0.12 -0.24 0.00 0.87 0.00 0.00 54.58 55.16 2lhm n ASN 118 Cb 0.37 -3.92 -0.09 0.00 -1.02 0.00 0.00 39.78 35.12 2lhm n ASN 118 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2lhm s ARG 119 N -5.47 1.96 -0.73 3.52 1.81 -1.06 -5.06 118.95 113.92 2lhm s ARG 119 Ca 0.19 -1.73 -0.27 0.00 -1.72 0.00 0.00 55.73 52.20 2lhm s ARG 119 Cb -0.09 -1.89 0.02 0.00 -0.45 0.00 0.00 34.95 32.54 2lhm s ARG 119 CO 0.23 0.23 1.41 0.34 -0.68 0.00 0.00 175.30 176.83 2lhm s ASP 120 N -3.63 5.99 0.00 0.23 2.15 -1.26 -4.86 116.67 115.29 2lhm s ASP 120 Ca 0.32 -0.35 0.23 0.00 0.43 0.00 0.00 52.55 53.19 2lhm s ASP 120 Cb -0.02 -2.55 0.56 0.00 -0.30 0.00 0.00 42.92 40.61 2lhm s ASP 120 CO 0.18 -1.94 1.47 1.33 -0.17 0.00 0.00 175.17 176.03 2lhm n VAL 121 N 6.58 0.23 -0.09 1.11 0.24 -1.26 -4.49 118.33 120.65 2lhm n VAL 121 Ca 0.08 -0.50 0.18 0.00 -2.04 0.00 0.00 64.34 62.06 2lhm n VAL 121 Cb 0.50 0.84 0.60 0.00 -1.47 0.00 0.00 33.84 34.30 2lhm n VAL 121 CO 0.00 0.00 0.00 0.03 -2.14 0.00 0.00 176.83 174.72 2lhm h ARG 122 N 3.54 0.21 -0.89 7.34 3.08 -1.92 -1.72 114.38 124.02 2lhm h ARG 122 Ca 0.00 -0.01 0.23 0.00 0.07 0.00 0.00 59.98 60.27 2lhm h ARG 122 Cb 0.77 -0.05 -0.05 0.00 0.08 0.00 0.00 29.97 30.72 2lhm h ARG 122 CO 0.00 0.14 0.61 -0.56 -1.07 0.00 0.00 179.97 179.09 2lhm h GLN 123 N 0.22 0.22 0.00 0.04 3.07 -1.97 -0.37 115.11 116.31 2lhm h GLN 123 Ca 0.32 -0.01 -0.05 0.00 0.09 0.00 0.00 58.65 58.99 2lhm h GLN 123 Cb 0.96 -0.05 -0.01 0.00 0.08 0.00 0.00 27.48 28.46 2lhm h GLN 123 CO -0.06 0.14 -0.26 1.88 0.09 0.00 0.00 178.83 180.62 2lhm h TYR 124 N 0.22 0.00 -0.03 0.06 0.05 -1.65 -3.20 116.97 112.43 2lhm h TYR 124 Ca 0.45 0.00 0.00 0.00 0.05 0.00 0.00 58.73 59.23 2lhm h TYR 124 Cb 1.41 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.15 2lhm h TYR 124 CO -0.00 0.26 0.00 1.33 -1.05 0.00 0.00 178.16 178.70 2lhm n VAL 125 N -3.79 0.12 -2.03 -2.88 0.24 -0.26 -4.85 118.33 104.88 2lhm n VAL 125 Ca -0.01 -0.56 -0.41 0.00 -2.04 0.00 0.00 64.34 61.31 2lhm n VAL 125 Cb 0.35 1.05 -0.02 0.00 -1.47 0.00 0.00 33.84 33.75 2lhm n VAL 125 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2lhm s GLN 126 N -0.54 4.28 -0.07 7.34 -2.07 -0.57 -2.47 119.66 125.57 2lhm s GLN 126 Ca 0.07 2.28 0.00 0.00 -1.82 0.00 0.00 55.36 55.89 2lhm s GLN 126 Cb 0.05 -3.12 0.00 0.00 -1.09 0.00 0.00 33.01 28.85 2lhm s GLN 126 CO 0.07 -0.41 0.00 0.41 -1.32 0.00 0.00 175.29 174.04 2lhm n GLY 127 N 2.29 0.37 0.11 2.60 0.00 -1.26 -4.91 105.19 104.39 2lhm n GLY 127 Ca 0.07 -0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.16 2lhm n GLY 127 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2lhm n GLY 129 N 1.43 0.15 0.49 0.00 0.00 -1.26 -4.81 105.19 101.20 2lhm n GLY 129 Ca 0.08 -0.65 0.06 0.00 0.00 0.00 0.00 46.02 45.51 2lhm n GLY 129 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65