#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lks s VAL 2 N 0.00 3.69 0.59 3.15 1.01 -1.26 -0.98 120.40 126.60 1lks s VAL 2 Ca 0.00 -1.03 -0.17 0.00 0.00 0.00 0.00 61.98 60.78 1lks s VAL 2 Cb 0.00 -3.02 -0.03 0.00 0.00 0.00 0.00 36.38 33.32 1lks s VAL 2 CO 0.00 -0.07 1.10 -0.36 0.00 0.00 0.00 175.10 175.77 1lks s PHE 3 N 1.41 2.73 0.52 5.22 0.40 -0.48 -5.00 117.98 122.77 1lks s PHE 3 Ca -0.01 1.54 -0.11 0.00 -0.60 0.00 0.00 56.93 57.75 1lks s PHE 3 Cb -0.19 -3.18 -0.06 0.00 0.51 0.00 0.00 43.02 40.11 1lks s PHE 3 CO 0.02 -1.49 0.92 0.20 0.70 0.00 0.00 175.22 175.57 1lks s GLY 4 N -2.28 1.81 0.11 4.36 0.00 -1.26 -4.85 107.32 105.23 1lks s GLY 4 Ca 0.68 -0.11 -0.21 0.00 0.00 0.00 0.00 44.72 45.09 1lks s GLY 4 CO 0.34 0.13 1.74 -0.09 0.00 0.00 0.00 173.10 175.21 1lks h ARG 5 N 0.49 0.08 -0.16 2.90 2.43 -1.97 -0.41 114.38 117.74 1lks h ARG 5 Ca -0.46 -0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 58.54 1lks h ARG 5 Cb 1.19 -0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.72 1lks h ARG 5 CO 0.62 0.05 -0.58 0.00 -1.51 0.00 0.00 179.97 178.56 1lks h GLU 7 N 0.38 0.90 -0.44 0.00 3.07 -1.94 -1.03 114.58 115.52 1lks h GLU 7 Ca 0.00 -0.19 -0.09 0.00 -0.50 0.00 0.00 59.36 58.58 1lks h GLU 7 Cb 1.12 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.88 1lks h GLU 7 CO 0.11 0.80 -0.09 1.25 -1.40 0.00 0.00 179.01 179.68 1lks h LEU 8 N 0.82 0.84 -0.79 1.33 5.85 -0.96 -2.10 115.31 120.28 1lks h LEU 8 Ca 0.19 -0.35 0.06 0.00 0.84 0.00 0.00 57.88 58.62 1lks h LEU 8 Cb 0.28 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 41.02 1lks h LEU 8 CO -0.01 0.99 0.48 0.00 -0.34 0.00 0.00 178.44 179.56 1lks h ALA 9 N 0.87 1.09 -0.51 1.25 0.00 -1.00 0.71 119.26 121.67 1lks h ALA 9 Ca 0.11 0.00 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1lks h ALA 9 Cb 0.62 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1lks h ALA 9 CO 0.04 0.19 0.04 0.00 0.00 0.00 0.00 179.25 179.52 1lks h ALA 10 N 1.39 0.68 -0.43 0.00 0.00 -1.01 0.30 119.26 120.18 1lks h ALA 10 Ca 0.35 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1lks h ALA 10 Cb 0.19 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 1lks h ALA 10 CO -0.18 0.45 0.15 0.00 0.00 0.00 0.00 179.25 179.67 1lks h ALA 11 N 0.95 0.56 -0.76 0.00 0.00 -0.93 -1.09 119.26 118.00 1lks h ALA 11 Ca 0.15 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1lks h ALA 11 Cb 0.46 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.05 1lks h ALA 11 CO 0.02 0.20 0.38 0.52 0.00 0.00 0.00 179.25 180.36 1lks h MET 12 N 0.56 1.09 -0.65 0.00 2.86 -0.66 -2.26 114.93 115.87 1lks h MET 12 Ca 0.14 -0.15 -0.03 0.00 -2.06 0.00 0.00 59.70 57.60 1lks h MET 12 Cb 0.23 -0.20 -0.03 0.00 0.06 0.00 0.00 31.60 31.66 1lks h MET 12 CO -0.01 0.84 0.29 -0.22 1.06 0.00 0.00 176.91 178.87 1lks h LYS 13 N 1.07 0.95 -0.06 1.72 3.64 -0.65 -2.41 116.57 120.83 1lks h LYS 13 Ca 0.26 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 1lks h LYS 13 Cb 0.10 -0.16 -0.00 0.00 -0.41 0.00 0.00 32.23 31.75 1lks h LYS 13 CO -0.04 0.78 -0.03 0.00 -2.27 0.00 0.00 179.45 177.89 1lks h ARG 14 N 0.90 0.08 -0.47 1.90 3.08 -0.97 -1.90 114.38 117.00 1lks h ARG 14 Ca 0.22 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.26 1lks h ARG 14 Cb 0.16 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.20 1lks h ARG 14 CO -0.02 0.12 0.00 0.72 -1.07 0.00 0.00 179.97 179.72 1lks n HIS 15 N -4.45 0.66 -0.59 3.04 8.25 -0.87 -4.95 115.22 116.30 1lks n HIS 15 Ca -0.02 -0.31 0.00 0.00 -0.26 0.00 0.00 57.72 57.13 1lks n HIS 15 Cb 0.14 -0.04 0.00 0.00 1.12 0.00 0.00 29.99 31.22 1lks n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1lks n GLY 16 N 1.11 0.69 0.21 -1.41 0.00 -0.71 -4.97 105.19 100.11 1lks n GLY 16 Ca 0.15 -0.12 0.11 0.00 0.00 0.00 0.00 46.02 46.15 1lks n GLY 16 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1lks h LEU 17 N 0.00 0.00 -9.18 0.99 3.38 -1.65 -3.40 115.31 105.46 1lks h LEU 17 Ca 0.00 0.00 -0.55 0.00 0.09 0.00 0.00 57.88 57.42 1lks h LEU 17 Cb 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1lks h LEU 17 CO 0.00 0.11 1.16 -0.62 0.09 0.00 0.00 178.44 179.17 1lks s ASP 18 N -6.19 6.44 -0.92 -0.43 2.15 -1.26 -1.93 116.67 114.52 1lks s ASP 18 Ca 0.05 2.07 0.00 0.00 0.43 0.00 0.00 52.55 55.10 1lks s ASP 18 Cb 0.06 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.15 1lks s ASP 18 CO 0.67 -1.14 0.00 -3.20 -0.17 0.00 0.00 175.17 171.32 1lks n ASN 19 N 8.02 -4.01 -4.67 -0.34 5.15 -0.44 -4.88 115.26 114.09 1lks n ASN 19 Ca 0.19 0.21 -0.42 0.00 -0.60 0.00 0.00 54.58 53.95 1lks n ASN 19 Cb 0.43 -2.33 -0.03 0.00 -0.53 0.00 0.00 39.78 37.33 1lks n ASN 19 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1lks s TYR 20 N -2.33 2.59 -1.11 1.20 5.04 -0.81 -2.32 117.35 119.61 1lks s TYR 20 Ca 0.00 0.72 -0.03 0.00 -2.44 0.00 0.00 57.07 55.32 1lks s TYR 20 Cb 0.00 -3.67 0.02 0.00 0.35 0.00 0.00 41.96 38.66 1lks s TYR 20 CO 0.00 -2.53 0.16 0.54 -1.34 0.00 0.00 175.55 172.38 1lks n ARG 21 N 6.42 -2.70 -0.82 4.97 5.12 -1.26 -1.83 116.66 126.56 1lks n ARG 21 Ca 0.15 0.57 0.00 0.00 -1.93 0.00 0.00 57.85 56.63 1lks n ARG 21 Cb 0.44 -5.20 0.00 0.00 -1.16 0.00 0.00 32.46 26.53 1lks n ARG 21 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1lks n GLY 22 N -0.93 0.57 3.41 -0.13 0.00 -0.98 -5.03 105.19 102.10 1lks n GLY 22 Ca -0.11 -0.24 -0.38 0.00 0.00 0.00 0.00 46.02 45.29 1lks n GLY 22 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1lks s TYR 23 N -2.00 3.16 0.76 1.61 2.02 -0.76 -4.92 117.35 117.22 1lks s TYR 23 Ca 0.00 -0.69 -0.14 0.00 -0.37 0.00 0.00 57.07 55.86 1lks s TYR 23 Cb 0.00 -2.32 0.06 0.00 -0.40 0.00 0.00 41.96 39.30 1lks s TYR 23 CO 0.00 -0.49 1.21 -1.54 -1.57 0.00 0.00 175.55 173.16 1lks s SER 24 N 1.58 3.93 0.28 2.29 1.04 -1.26 -1.33 113.70 120.23 1lks s SER 24 Ca 0.04 2.37 0.02 0.00 0.48 0.00 0.00 55.95 58.86 1lks s SER 24 Cb -0.17 -2.59 0.66 0.00 0.10 0.00 0.00 66.02 64.02 1lks s SER 24 CO 0.05 -2.44 1.73 0.25 0.98 0.00 0.00 173.24 173.81 1lks h LEU 25 N -0.55 0.47 -1.88 2.42 5.85 -1.90 -0.86 115.31 118.85 1lks h LEU 25 Ca -0.47 0.12 -0.02 0.00 0.84 0.00 0.00 57.88 58.35 1lks h LEU 25 Cb 1.30 0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.39 1lks h LEU 25 CO 0.48 0.12 -0.10 1.23 -0.34 0.00 0.00 178.44 179.83 1lks h GLY 26 N 0.53 0.00 1.01 3.75 0.00 -1.91 -1.41 103.07 105.04 1lks h GLY 26 Ca 0.53 0.00 0.01 0.00 0.00 0.00 0.00 47.33 47.86 1lks h GLY 26 CO -0.45 0.00 0.52 3.43 0.00 0.00 0.00 176.54 180.05 1lks h ASN 27 N 0.00 0.93 -0.36 0.19 2.35 -1.39 -0.66 115.58 116.63 1lks h ASN 27 Ca -0.00 -0.03 -0.14 0.00 -0.55 0.00 0.00 56.30 55.58 1lks h ASN 27 Cb 0.18 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.31 1lks h ASN 27 CO 0.01 0.68 -0.30 -0.50 -1.65 0.00 0.00 177.43 175.67 1lks h TRP 28 N 1.09 1.01 -0.46 1.19 4.06 -1.34 -0.78 115.95 120.72 1lks h TRP 28 Ca 0.29 -0.29 -0.08 0.00 2.06 0.00 0.00 58.89 60.87 1lks h TRP 28 Cb -0.11 -0.22 -0.02 0.00 -1.00 0.00 0.00 29.16 27.81 1lks h TRP 28 CO -0.01 1.08 -0.03 0.28 -3.56 0.00 0.00 178.44 176.19 1lks h VAL 29 N 0.65 1.27 -0.54 1.49 2.07 -1.34 -1.92 116.25 117.92 1lks h VAL 29 Ca 0.07 -1.11 0.00 0.00 0.82 0.00 0.00 66.70 66.48 1lks h VAL 29 Cb 0.88 1.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.69 1lks h VAL 29 CO 0.08 0.38 0.35 0.00 0.02 0.00 0.00 177.57 178.40 1lks h ALA 31 N 1.19 0.46 -0.83 0.00 0.00 -0.99 -2.17 119.26 116.93 1lks h ALA 31 Ca 0.20 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1lks h ALA 31 Cb -0.07 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.57 1lks h ALA 31 CO -0.04 -0.13 0.41 0.00 0.00 0.00 0.00 179.25 179.49 1lks h ALA 32 N 1.16 1.16 -0.12 0.00 0.00 -1.03 0.05 119.26 120.48 1lks h ALA 32 Ca 0.14 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1lks h ALA 32 Cb -0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1lks h ALA 32 CO -0.06 0.64 -0.02 -0.22 0.00 0.00 0.00 179.25 179.59 1lks h LYS 33 N 1.17 0.02 0.00 0.00 1.63 -0.79 -1.93 116.57 116.67 1lks h LYS 33 Ca 0.29 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.08 1lks h LYS 33 Cb 0.10 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.72 1lks h LYS 33 CO -0.04 0.01 -0.42 0.74 -3.45 0.00 0.00 179.45 176.30 1lks h PHE 34 N 0.02 0.00 0.01 1.91 0.04 -1.24 -0.20 116.94 117.48 1lks h PHE 34 Ca 0.06 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.80 1lks h PHE 34 Cb 0.08 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.23 1lks h PHE 34 CO -0.15 0.00 -0.11 0.93 -0.60 0.00 0.00 178.31 178.37 1lks h GLU 35 N 0.00 0.06 0.00 1.51 4.39 -0.93 -3.43 114.58 116.19 1lks h GLU 35 Ca 0.00 -0.08 0.00 0.00 0.34 0.00 0.00 59.36 59.62 1lks h GLU 35 Cb 0.90 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.57 1lks h GLU 35 CO 0.00 0.90 0.00 -1.13 -1.16 0.00 0.00 179.01 177.62 1lks n SER 36 N -4.60 0.45 -3.40 1.42 3.41 -0.74 -4.88 113.62 105.28 1lks n SER 36 Ca -0.10 -0.88 -0.25 0.00 -0.26 0.00 0.00 58.87 57.38 1lks n SER 36 Cb 0.47 0.08 0.03 0.00 -0.26 0.00 0.00 64.21 64.53 1lks n SER 36 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1lks n ASN 37 N -0.08 -5.10 -0.70 4.04 5.15 -0.08 -2.15 115.26 116.33 1lks n ASN 37 Ca 0.00 -0.46 -0.09 0.00 -0.60 0.00 0.00 54.58 53.42 1lks n ASN 37 Cb 0.10 -4.12 -0.04 0.00 -0.53 0.00 0.00 39.78 35.19 1lks n ASN 37 CO 0.00 0.00 0.00 0.49 1.40 0.00 0.00 177.26 179.15 1lks n PHE 38 N -4.43 0.00 -3.40 1.20 3.72 -1.21 -4.83 117.46 108.50 1lks n PHE 38 Ca -0.03 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 56.96 1lks n PHE 38 Cb 0.57 -1.99 -0.09 0.00 -0.94 0.00 0.00 39.48 37.03 1lks n PHE 38 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 1lks s ASN 39 N -2.64 6.17 0.46 4.37 3.84 -0.91 -1.38 114.94 124.84 1lks s ASN 39 Ca 0.00 -0.31 0.31 0.00 0.21 0.00 0.00 52.86 53.07 1lks s ASN 39 Cb 0.00 -2.19 1.44 0.00 -0.55 0.00 0.00 41.25 39.95 1lks s ASN 39 CO 0.00 -0.36 1.94 0.71 -2.79 0.00 0.00 177.10 176.60 1lks h THR 40 N 5.56 0.00 -0.19 -5.21 1.35 -1.39 -2.82 112.91 110.21 1lks h THR 40 Ca -0.29 -0.25 0.00 0.00 -0.55 0.00 0.00 66.41 65.31 1lks h THR 40 Cb 1.14 1.10 0.00 0.00 -1.73 0.00 0.00 68.15 68.66 1lks h THR 40 CO 0.70 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.97 1lks n GLN 41 N -2.72 2.19 -1.73 4.72 6.02 -1.26 -4.07 117.38 120.53 1lks n GLN 41 Ca 0.00 -1.77 -0.42 0.00 -0.01 0.00 0.00 57.00 54.79 1lks n GLN 41 Cb 0.20 -1.47 -0.02 0.00 1.02 0.00 0.00 30.24 29.97 1lks n GLN 41 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1lks n ALA 42 N 1.05 2.27 -2.77 -1.58 0.00 -1.06 -4.78 120.51 113.63 1lks n ALA 42 Ca 0.17 0.38 -0.15 0.00 0.00 0.00 0.00 53.44 53.84 1lks n ALA 42 Cb 0.52 -2.43 -0.14 0.00 0.00 0.00 0.00 19.45 17.40 1lks n ALA 42 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1lks s THR 43 N 0.04 0.37 -0.19 0.00 -4.23 -1.26 -0.30 115.64 110.07 1lks s THR 43 Ca 0.65 -0.22 0.00 0.00 -1.18 0.00 0.00 61.69 60.94 1lks s THR 43 Cb -0.53 -0.32 0.05 0.00 1.34 0.00 0.00 72.50 73.04 1lks s THR 43 CO 0.48 0.09 -0.07 0.21 -0.54 0.00 0.00 174.62 174.79 1lks s ASN 44 N -0.15 3.20 -0.33 3.99 2.47 -0.43 -4.97 114.94 118.71 1lks s ASN 44 Ca 0.01 -0.83 -0.19 0.00 0.42 0.00 0.00 52.86 52.27 1lks s ASN 44 Cb -0.02 -1.05 -0.01 0.00 -1.45 0.00 0.00 41.25 38.72 1lks s ASN 44 CO -0.00 -0.19 0.58 -0.13 -3.72 0.00 0.00 177.10 173.64 1lks s ARG 45 N 1.52 3.77 0.42 0.43 0.52 -1.26 -0.98 118.95 123.37 1lks s ARG 45 Ca -0.01 0.09 0.00 0.00 -0.52 0.00 0.00 55.73 55.29 1lks s ARG 45 Cb -0.16 -3.77 -0.01 0.00 0.52 0.00 0.00 34.95 31.53 1lks s ARG 45 CO -0.08 -0.61 0.64 -0.80 0.02 0.00 0.00 175.30 174.47 1lks s ASN 46 N 1.71 5.98 0.00 0.23 0.01 0.01 -4.99 114.94 117.89 1lks s ASN 46 Ca 0.22 0.36 0.29 0.00 -0.71 0.00 0.00 52.86 53.02 1lks s ASN 46 Cb -0.15 -1.70 1.36 0.00 0.41 0.00 0.00 41.25 41.18 1lks s ASN 46 CO 0.13 -0.59 1.96 0.35 -1.51 0.00 0.00 177.10 177.45 1lks n THR 47 N -2.01 0.06 1.20 1.60 -2.24 -1.26 -2.95 114.28 108.68 1lks n THR 47 Ca -0.00 0.02 0.10 0.00 -2.27 0.00 0.00 64.05 61.89 1lks n THR 47 Cb 0.57 -0.54 0.35 0.00 -2.10 0.00 0.00 70.33 68.62 1lks n THR 47 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1lks n ASP 48 N -1.36 1.67 0.00 3.42 5.68 -1.26 -4.90 116.55 119.80 1lks n ASP 48 Ca 0.11 -1.74 0.00 0.00 -0.50 0.00 0.00 54.79 52.67 1lks n ASP 48 Cb 0.26 -0.12 0.00 0.00 -1.14 0.00 0.00 41.12 40.13 1lks n ASP 48 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lks n GLY 49 N 1.12 0.62 3.95 6.12 0.00 -1.15 -4.77 105.19 111.07 1lks n GLY 49 Ca 0.16 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 1lks n GLY 49 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lks s SER 50 N -2.38 5.89 0.01 1.61 1.04 -1.26 -4.28 113.70 114.33 1lks s SER 50 Ca 0.00 0.34 0.02 0.00 0.48 0.00 0.00 55.95 56.78 1lks s SER 50 Cb 0.00 -1.61 -0.01 0.00 0.10 0.00 0.00 66.02 64.50 1lks s SER 50 CO 0.00 -0.67 -0.06 -0.89 0.98 0.00 0.00 173.24 172.60 1lks s THR 51 N -2.55 0.43 -0.19 2.02 2.01 -1.26 -0.81 115.64 115.29 1lks s THR 51 Ca 0.48 -0.54 -0.09 0.00 0.31 0.00 0.00 61.69 61.85 1lks s THR 51 Cb -0.10 -0.43 -0.05 0.00 0.01 0.00 0.00 72.50 71.94 1lks s THR 51 CO 0.38 -0.09 0.10 -1.81 -0.69 0.00 0.00 174.62 172.51 1lks s ASP 52 N -0.68 5.93 -0.07 3.53 1.01 -0.16 -1.40 116.67 124.83 1lks s ASP 52 Ca -0.03 0.16 0.05 0.00 0.71 0.00 0.00 52.55 53.44 1lks s ASP 52 Cb -0.05 -2.03 -0.00 0.00 1.01 0.00 0.00 42.92 41.85 1lks s ASP 52 CO 0.00 0.18 -0.21 -0.31 0.21 0.00 0.00 175.17 175.04 1lks s TYR 53 N 0.36 2.14 0.00 4.23 1.51 -0.14 -1.31 117.35 124.15 1lks s TYR 53 Ca 0.06 -0.72 0.00 0.00 -1.01 0.00 0.00 57.07 55.39 1lks s TYR 53 Cb -0.12 -1.44 0.00 0.00 -0.11 0.00 0.00 41.96 40.30 1lks s TYR 53 CO -0.01 -0.27 0.00 0.41 -1.11 0.00 0.00 175.55 174.57 1lks n GLY 54 N 3.27 -1.98 0.29 0.71 0.00 0.59 -1.83 105.19 106.23 1lks n GLY 54 Ca -0.19 -1.48 0.11 0.00 0.00 0.00 0.00 46.02 44.47 1lks n GLY 54 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1lks h ILE 55 N 0.00 0.94 -0.34 -0.61 2.10 -1.70 -1.35 117.51 116.55 1lks h ILE 55 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1lks h ILE 55 Cb 0.00 0.94 0.00 0.00 -1.09 0.00 0.00 36.82 36.67 1lks h ILE 55 CO 0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.15 177.25 1lks n LEU 56 N -4.50 2.93 -3.72 2.19 4.77 -1.26 -4.11 117.00 113.30 1lks n LEU 56 Ca -0.00 -2.02 -0.26 0.00 -0.03 0.00 0.00 56.01 53.70 1lks n LEU 56 Cb 0.21 -0.23 0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1lks n LEU 56 CO 0.35 0.73 -0.10 0.00 -1.33 0.00 0.00 177.39 177.03 1lks n GLN 57 N 0.48 -2.92 -2.80 3.23 1.13 -0.51 -4.91 117.38 111.08 1lks n GLN 57 Ca 0.12 0.53 -0.41 0.00 -1.94 0.00 0.00 57.00 55.29 1lks n GLN 57 Cb 0.43 -4.67 -0.04 0.00 0.11 0.00 0.00 30.24 26.07 1lks n GLN 57 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1lks s ILE 58 N -3.64 4.85 0.16 5.09 1.01 -0.76 -4.41 121.20 123.50 1lks s ILE 58 Ca 0.22 1.90 -0.19 0.00 0.00 0.00 0.00 60.65 62.57 1lks s ILE 58 Cb -0.07 -4.25 -0.07 0.00 0.01 0.00 0.00 42.46 38.08 1lks s ILE 58 CO 0.84 0.21 0.65 0.21 0.00 0.00 0.00 174.94 176.86 1lks s ASN 59 N 0.77 7.06 0.00 3.58 3.84 -1.26 -0.96 114.94 127.96 1lks s ASN 59 Ca 0.47 1.34 0.26 0.00 0.21 0.00 0.00 52.86 55.14 1lks s ASN 59 Cb -0.21 -2.39 1.20 0.00 -0.55 0.00 0.00 41.25 39.31 1lks s ASN 59 CO 0.26 0.14 1.86 -1.54 -2.79 0.00 0.00 177.10 175.03 1lks n SER 60 N 1.15 0.00 0.09 -4.21 3.41 -0.49 -2.37 113.62 111.20 1lks n SER 60 Ca -0.06 0.25 -0.11 0.00 -0.26 0.00 0.00 58.87 58.70 1lks n SER 60 Cb 0.51 -0.41 -0.07 0.00 -0.26 0.00 0.00 64.21 63.98 1lks n SER 60 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 1lks h ARG 61 N 0.00 -0.30 0.00 4.33 2.43 -1.85 -3.40 114.38 115.59 1lks h ARG 61 Ca 0.00 0.02 -0.28 0.00 -0.81 0.00 0.00 59.98 58.91 1lks h ARG 61 Cb 0.36 0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.93 1lks h ARG 61 CO 0.00 0.07 -1.96 0.91 -1.51 0.00 0.00 179.97 177.49 1lks n TRP 62 N -5.00 0.51 -0.08 2.20 7.02 -1.25 -1.26 117.44 119.58 1lks n TRP 62 Ca -0.08 0.18 -0.11 0.00 -1.02 0.00 0.00 57.50 56.47 1lks n TRP 62 Cb 0.26 -1.04 -0.09 0.00 -2.42 0.00 0.00 31.31 28.02 1lks n TRP 62 CO 0.00 0.00 0.00 0.91 -2.02 0.00 0.00 177.69 176.58 1lks n TRP 63 N -2.83 0.00 -4.14 -5.99 7.02 -1.00 -1.07 117.44 109.43 1lks n TRP 63 Ca -0.21 0.00 -0.11 0.00 -1.02 0.00 0.00 57.50 56.16 1lks n TRP 63 Cb 1.02 -0.68 -0.10 0.00 -2.42 0.00 0.00 31.31 29.13 1lks n TRP 63 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1lks s ASN 65 N -2.79 6.14 0.00 0.00 2.47 -0.43 -4.55 114.94 115.79 1lks s ASN 65 Ca 0.08 0.15 0.08 0.00 0.42 0.00 0.00 52.86 53.59 1lks s ASN 65 Cb 0.03 -2.14 0.08 0.00 -1.45 0.00 0.00 41.25 37.77 1lks s ASN 65 CO -0.05 -0.03 0.80 -0.90 -3.72 0.00 0.00 177.10 173.21 1lks n ASP 66 N 4.72 1.79 0.00 -4.21 5.68 -1.26 -1.10 116.55 122.17 1lks n ASP 66 Ca -0.13 -1.41 0.00 0.00 -0.50 0.00 0.00 54.79 52.75 1lks n ASP 66 Cb 0.52 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.48 1lks n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1lks n GLY 67 N 0.45 0.42 0.00 6.12 0.00 -1.26 -4.77 105.19 106.14 1lks n GLY 67 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 1lks n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lks n ARG 68 N -1.61 1.89 -3.66 1.61 1.74 -1.26 -5.04 116.66 110.33 1lks n ARG 68 Ca 0.00 -0.15 -0.36 0.00 -0.77 0.00 0.00 57.85 56.57 1lks n ARG 68 Cb 0.11 -0.55 -0.09 0.00 -1.02 0.00 0.00 32.46 30.92 1lks n ARG 68 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1lks s THR 69 N -0.31 5.37 0.49 0.55 2.01 -1.26 -4.86 115.64 117.63 1lks s THR 69 Ca 0.00 0.25 -0.23 0.00 0.31 0.00 0.00 61.69 62.03 1lks s THR 69 Cb 0.00 -3.51 -0.06 0.00 0.01 0.00 0.00 72.50 68.93 1lks s THR 69 CO 0.00 0.38 1.26 -2.84 -0.69 0.00 0.00 174.62 172.73 1lks s PRO 70 N 0.73 3.50 -0.78 4.92 0.02 -1.26 -3.64 135.00 138.48 1lks s PRO 70 Ca 0.09 2.01 0.00 0.00 0.02 0.00 0.00 61.00 63.12 1lks s PRO 70 Cb -0.12 -2.36 0.00 0.00 0.02 0.00 0.00 34.50 32.03 1lks s PRO 70 CO 0.02 -0.83 0.00 0.41 -0.33 0.00 0.00 177.00 176.27 1lks n GLY 71 N 0.58 0.63 3.72 0.52 0.00 -1.26 -4.86 105.19 104.52 1lks n GLY 71 Ca 0.08 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 45.05 1lks n GLY 71 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1lks s SER 72 N -2.81 6.53 -0.22 1.61 0.15 -1.24 -4.78 113.70 112.94 1lks s SER 72 Ca 0.00 2.69 0.11 0.00 0.70 0.00 0.00 55.95 59.45 1lks s SER 72 Cb 0.00 -2.60 -0.21 0.00 -1.71 0.00 0.00 66.02 61.50 1lks s SER 72 CO 0.00 -0.86 -0.05 0.54 1.20 0.00 0.00 173.24 174.06 1lks n ARG 73 N 3.94 0.71 -3.77 5.44 1.74 -0.38 -5.03 116.66 119.31 1lks n ARG 73 Ca 0.14 0.06 -0.31 0.00 -0.77 0.00 0.00 57.85 56.97 1lks n ARG 73 Cb 0.38 -1.51 0.03 0.00 -1.02 0.00 0.00 32.46 30.34 1lks n ARG 73 CO 0.00 0.00 0.00 -1.71 -1.52 0.00 0.00 177.63 174.40 1lks n ASN 74 N -2.95 -3.99 0.21 0.55 5.15 -1.08 -4.87 115.26 108.29 1lks n ASN 74 Ca -0.38 -1.03 0.09 0.00 -0.60 0.00 0.00 54.58 52.67 1lks n ASN 74 Cb 1.07 -3.19 0.39 0.00 -0.53 0.00 0.00 39.78 37.52 1lks n ASN 74 CO 0.00 0.00 0.00 -0.07 1.40 0.00 0.00 177.26 178.59 1lks h LEU 75 N -1.94 0.00 -0.04 1.20 3.38 -1.04 -1.96 115.31 114.92 1lks h LEU 75 Ca -0.66 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.31 1lks h LEU 75 Cb 1.37 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.12 1lks h LEU 75 CO 0.52 0.24 -0.12 0.00 0.09 0.00 0.00 178.44 179.17 1lks n ASN 77 N -1.37 -1.69 -3.87 0.00 5.15 -0.74 -4.98 115.26 107.76 1lks n ASN 77 Ca 0.09 -0.72 -0.11 0.00 -0.60 0.00 0.00 54.58 53.24 1lks n ASN 77 Cb 0.31 -4.60 -0.09 0.00 -0.53 0.00 0.00 39.78 34.87 1lks n ASN 77 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 1lks s ILE 78 N -3.51 0.10 0.45 -1.44 -4.36 -1.26 -5.07 121.20 106.11 1lks s ILE 78 Ca 0.01 -0.86 -0.24 0.00 -0.26 0.00 0.00 60.65 59.31 1lks s ILE 78 Cb -0.00 -0.75 -0.08 0.00 1.25 0.00 0.00 42.46 42.88 1lks s ILE 78 CO 0.77 -0.47 1.19 -2.16 0.24 0.00 0.00 174.94 174.51 1lks s PRO 79 N -2.16 3.79 0.52 0.37 0.04 -1.26 -1.31 135.00 134.99 1lks s PRO 79 Ca -0.08 1.85 0.24 0.00 0.04 0.00 0.00 61.00 63.04 1lks s PRO 79 Cb -0.03 -2.48 1.43 0.00 0.04 0.00 0.00 34.50 33.46 1lks s PRO 79 CO -0.02 -0.54 2.11 0.00 0.04 0.00 0.00 177.00 178.58 1lks h SER 81 N 0.00 0.00 0.42 0.00 4.64 -1.91 -0.85 113.55 115.85 1lks h SER 81 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1lks h SER 81 Cb 0.22 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1lks h SER 81 CO 0.01 0.01 -0.05 0.00 -0.87 0.00 0.00 176.83 175.93 1lks h ALA 82 N 1.99 1.14 -0.00 5.18 0.00 -1.71 -2.08 119.26 123.78 1lks h ALA 82 Ca -0.00 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1lks h ALA 82 Cb 0.04 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1lks h ALA 82 CO 0.00 0.07 -0.02 1.28 0.00 0.00 0.00 179.25 180.58 1lks n LEU 83 N -3.36 0.05 -1.47 0.00 4.77 -0.32 -3.61 117.00 113.06 1lks n LEU 83 Ca -0.02 0.26 0.07 0.00 -0.03 0.00 0.00 56.01 56.29 1lks n LEU 83 Cb 0.20 -0.28 0.34 0.00 -2.33 0.00 0.00 43.42 41.35 1lks n LEU 83 CO 0.26 0.01 0.82 0.18 -1.33 0.00 0.00 177.39 177.33 1lks n LEU 84 N -1.26 4.98 -4.81 2.23 4.77 -0.78 -4.07 117.00 118.06 1lks n LEU 84 Ca 0.14 -3.01 -0.33 0.00 -0.03 0.00 0.00 56.01 52.78 1lks n LEU 84 Cb 0.25 -0.63 -0.01 0.00 -2.33 0.00 0.00 43.42 40.69 1lks n LEU 84 CO 0.23 0.67 0.71 -0.55 -1.33 0.00 0.00 177.39 177.13 1lks s SER 85 N -1.32 6.11 0.47 -1.43 0.15 -1.24 -4.58 113.70 111.86 1lks s SER 85 Ca 0.49 1.81 0.26 0.00 0.70 0.00 0.00 55.95 59.22 1lks s SER 85 Cb 0.39 -2.54 0.96 0.00 -1.71 0.00 0.00 66.02 63.12 1lks s SER 85 CO 0.12 -0.94 1.83 0.77 1.20 0.00 0.00 173.24 176.23 1lks h SER 86 N 0.90 0.00 -3.38 5.45 4.64 -1.94 -3.42 113.55 115.80 1lks h SER 86 Ca -0.48 0.00 -0.56 0.00 -0.47 0.00 0.00 61.79 60.29 1lks h SER 86 Cb 1.21 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.26 1lks h SER 86 CO 0.59 0.14 0.11 -0.62 -0.87 0.00 0.00 176.83 176.18 1lks s ASP 87 N -6.05 7.07 0.00 4.97 2.15 -1.26 -4.95 116.67 118.60 1lks s ASP 87 Ca 0.02 1.28 0.29 0.00 0.43 0.00 0.00 52.55 54.57 1lks s ASP 87 Cb 0.09 -2.43 1.29 0.00 -0.30 0.00 0.00 42.92 41.57 1lks s ASP 87 CO 0.62 -0.07 1.88 2.30 -0.17 0.00 0.00 175.17 179.73 1lks n ILE 88 N 3.43 0.00 -0.07 4.11 -5.35 -1.26 -4.47 119.36 115.74 1lks n ILE 88 Ca -0.02 -0.14 -0.07 0.00 -0.27 0.00 0.00 62.75 62.25 1lks n ILE 88 Cb 0.51 0.13 -0.01 0.00 -1.74 0.00 0.00 39.64 38.53 1lks n ILE 88 CO 0.00 0.00 0.00 0.74 -1.76 0.00 0.00 176.55 175.53 1lks h THR 89 N 1.34 0.42 -0.81 7.28 2.02 -1.95 -0.89 112.91 120.32 1lks h THR 89 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1lks h THR 89 Cb 0.34 0.42 -0.04 0.00 -1.74 0.00 0.00 68.15 67.14 1lks h THR 89 CO 0.00 0.00 0.34 0.00 0.37 0.00 0.00 175.52 176.23 1lks h ALA 90 N 0.96 1.07 -0.56 6.16 0.00 -1.85 0.20 119.26 125.25 1lks h ALA 90 Ca 0.16 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.86 1lks h ALA 90 Cb 0.43 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 1lks h ALA 90 CO -0.41 0.67 0.26 0.77 0.00 0.00 0.00 179.25 180.54 1lks h SER 91 N 1.18 0.74 -0.31 0.00 0.02 -1.70 -1.54 113.55 111.94 1lks h SER 91 Ca 0.27 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1lks h SER 91 Cb 0.19 -0.19 -0.01 0.00 0.14 0.00 0.00 62.40 62.52 1lks h SER 91 CO -0.03 0.68 0.14 0.58 -1.14 0.00 0.00 176.83 177.06 1lks h VAL 92 N 0.76 1.16 -0.84 2.27 2.07 -0.83 0.17 116.25 121.02 1lks h VAL 92 Ca 0.19 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 67.25 1lks h VAL 92 Cb 0.14 0.90 -0.04 0.00 -1.52 0.00 0.00 31.29 30.77 1lks h VAL 92 CO -0.02 0.16 0.51 0.78 0.02 0.00 0.00 177.57 179.03 1lks h ASN 93 N 0.36 1.00 0.05 0.57 2.35 -0.84 -0.58 115.58 118.48 1lks h ASN 93 Ca 0.10 -0.06 -0.19 0.00 -0.55 0.00 0.00 56.30 55.61 1lks h ASN 93 Cb 0.13 -0.25 -0.00 0.00 0.05 0.00 0.00 38.32 38.25 1lks h ASN 93 CO -0.01 0.76 -0.70 0.00 -1.65 0.00 0.00 177.43 175.83 1lks h ALA 95 N 0.81 1.41 -0.63 0.00 0.00 -0.58 -0.63 119.26 119.64 1lks h ALA 95 Ca -0.03 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.66 1lks h ALA 95 Cb 1.28 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1lks h ALA 95 CO 0.13 0.43 0.15 0.87 0.00 0.00 0.00 179.25 180.83 1lks h LYS 96 N 0.59 0.99 -0.47 0.00 1.57 -0.97 -2.37 116.57 115.90 1lks h LYS 96 Ca 0.13 -0.22 -0.10 0.00 -1.87 0.00 0.00 60.65 58.59 1lks h LYS 96 Cb 0.23 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 32.39 1lks h LYS 96 CO -0.00 0.88 -0.11 -0.22 -0.57 0.00 0.00 179.45 179.43 1lks h LYS 97 N 0.95 0.86 -0.43 3.15 1.63 -0.92 0.06 116.57 121.87 1lks h LYS 97 Ca 0.20 -0.30 -0.00 0.00 -0.85 0.00 0.00 60.65 59.70 1lks h LYS 97 Cb 0.34 -0.06 -0.02 0.00 -0.60 0.00 0.00 32.23 31.89 1lks h LYS 97 CO 0.00 0.93 0.26 0.82 -3.45 0.00 0.00 179.45 178.01 1lks h ILE 98 N 0.77 1.13 -0.01 2.00 2.04 -0.71 0.32 117.51 123.06 1lks h ILE 98 Ca 0.13 -0.30 -0.16 0.00 1.00 0.00 0.00 64.86 65.53 1lks h ILE 98 Cb 0.62 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.25 1lks h ILE 98 CO 0.04 0.13 -0.73 0.58 0.00 0.00 0.00 178.15 178.18 1lks h VAL 99 N 0.57 1.50 0.00 1.67 2.07 -1.32 -3.13 116.25 117.60 1lks h VAL 99 Ca 0.15 -2.42 -0.04 0.00 0.82 0.00 0.00 66.70 65.21 1lks h VAL 99 Cb -0.01 2.31 -0.01 0.00 -1.52 0.00 0.00 31.29 32.06 1lks h VAL 99 CO -0.03 0.70 -0.19 0.28 0.02 0.00 0.00 177.57 178.34 1lks h SER 100 N 0.04 0.00 -0.35 0.57 0.02 -0.12 -2.85 113.55 110.85 1lks h SER 100 Ca -0.01 0.00 -0.21 0.00 -0.84 0.00 0.00 61.79 60.73 1lks h SER 100 Cb 1.28 0.00 -0.10 0.00 0.14 0.00 0.00 62.40 63.72 1lks h SER 100 CO 0.10 0.19 0.27 0.47 -1.14 0.00 0.00 176.83 176.73 1lks n ASP 101 N -3.31 4.85 -2.04 3.07 8.00 0.11 -4.75 116.55 122.47 1lks n ASP 101 Ca 0.01 -2.74 -0.11 0.00 0.71 0.00 0.00 54.79 52.66 1lks n ASP 101 Cb 0.44 -0.87 0.04 0.00 -0.02 0.00 0.00 41.12 40.71 1lks n ASP 101 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lks n GLY 102 N 0.32 0.19 3.16 0.44 0.00 -1.08 -5.05 105.19 103.17 1lks n GLY 102 Ca 0.22 -0.22 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 1lks n GLY 102 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lks s ASN 103 N -3.27 1.79 0.00 1.61 4.22 -1.20 -5.08 114.94 113.02 1lks s ASN 103 Ca 0.22 -0.48 0.00 0.00 -2.14 0.00 0.00 52.86 50.47 1lks s ASN 103 Cb -0.10 -0.12 0.00 0.00 1.28 0.00 0.00 41.25 42.31 1lks s ASN 103 CO 0.35 0.04 0.00 0.61 -2.04 0.00 0.00 177.10 176.07 1lks n GLY 104 N 1.84 1.16 0.00 0.45 0.00 -1.26 -4.06 105.19 103.32 1lks n GLY 104 Ca -0.18 -1.76 0.08 0.00 0.00 0.00 0.00 46.02 44.16 1lks n GLY 104 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1lks n MET 105 N 0.00 0.38 0.03 1.61 0.00 -1.26 -2.58 117.12 115.30 1lks n MET 105 Ca 0.00 0.06 0.08 0.00 0.00 0.00 0.00 57.70 57.84 1lks n MET 105 Cb 0.00 -1.50 0.33 0.00 0.00 0.00 0.00 33.22 32.05 1lks n MET 105 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 1lks n ASN 106 N -1.12 0.14 0.29 7.83 3.02 -1.26 -1.41 115.26 122.76 1lks n ASN 106 Ca 0.10 0.54 0.18 0.00 -0.03 0.00 0.00 54.58 55.37 1lks n ASN 106 Cb 0.08 -0.56 0.86 0.00 -0.61 0.00 0.00 39.78 39.55 1lks n ASN 106 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1lks h ALA 107 N 2.42 1.04 -2.70 5.41 0.00 -1.86 -3.38 119.26 120.20 1lks h ALA 107 Ca 0.00 -0.02 -0.71 0.00 0.00 0.00 0.00 54.91 54.18 1lks h ALA 107 Cb 0.26 -0.00 -0.23 0.00 0.00 0.00 0.00 17.79 17.81 1lks h ALA 107 CO 0.00 0.03 -0.48 -1.58 0.00 0.00 0.00 179.25 177.22 1lks s TRP 108 N -3.89 3.24 0.33 0.00 0.51 -0.50 -4.97 118.94 113.66 1lks s TRP 108 Ca -0.01 -0.80 0.04 0.00 -2.12 0.00 0.00 56.10 53.20 1lks s TRP 108 Cb 0.11 -2.49 0.65 0.00 -0.81 0.00 0.00 33.47 30.93 1lks s TRP 108 CO 0.51 -0.62 1.91 0.28 -0.51 0.00 0.00 176.95 178.52 1lks h VAL 109 N 5.77 0.99 0.00 4.03 2.07 -1.85 -1.29 116.25 125.98 1lks h VAL 109 Ca -0.26 -0.30 -0.10 0.00 0.82 0.00 0.00 66.70 66.85 1lks h VAL 109 Cb 1.11 0.04 -0.01 0.00 -1.52 0.00 0.00 31.29 30.90 1lks h VAL 109 CO 0.69 0.16 -0.49 0.00 0.02 0.00 0.00 177.57 177.95 1lks h ALA 110 N 1.56 1.16 -0.10 1.67 0.00 -1.93 -1.48 119.26 120.14 1lks h ALA 110 Ca 0.39 -0.45 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1lks h ALA 110 Cb 0.35 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 1lks h ALA 110 CO -0.16 0.61 -0.01 2.35 0.00 0.00 0.00 179.25 182.05 1lks h TRP 111 N 0.00 0.20 -0.96 0.00 7.01 -1.56 -0.37 115.95 120.27 1lks h TRP 111 Ca -0.00 -0.04 0.04 0.00 2.11 0.00 0.00 58.89 61.00 1lks h TRP 111 Cb 0.88 -0.05 -0.06 0.00 -2.10 0.00 0.00 29.16 27.83 1lks h TRP 111 CO 0.00 0.45 0.62 -0.09 -2.79 0.00 0.00 178.44 176.63 1lks h ARG 112 N -0.10 1.15 0.00 2.65 2.43 -1.19 0.05 114.38 119.37 1lks h ARG 112 Ca 0.03 -0.07 -0.18 0.00 -0.81 0.00 0.00 59.98 58.95 1lks h ARG 112 Cb 0.37 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 29.63 1lks h ARG 112 CO 0.01 0.76 -1.37 -0.91 -1.51 0.00 0.00 179.97 176.95 1lks h ASN 113 N 1.19 0.00 0.00 -3.80 2.35 -1.26 -3.38 115.58 110.68 1lks h ASN 113 Ca 0.39 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.14 1lks h ASN 113 Cb 0.05 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1lks h ASN 113 CO -0.14 0.62 -0.04 0.54 -1.65 0.00 0.00 177.43 176.77 1lks n ARG 114 N -2.94 5.71 -0.03 0.81 1.74 -0.15 -4.84 116.66 116.95 1lks n ARG 114 Ca -0.09 0.00 -0.05 0.00 -0.77 0.00 0.00 57.85 56.93 1lks n ARG 114 Cb 0.86 -0.45 -0.03 0.00 -1.02 0.00 0.00 32.46 31.82 1lks n ARG 114 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1lks n LYS 116 N -2.93 2.10 -0.68 0.00 4.81 -0.14 -1.63 118.16 119.69 1lks n LYS 116 Ca -0.12 0.76 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 1lks n LYS 116 Cb 0.60 -2.51 0.00 0.00 0.02 0.00 0.00 35.03 33.15 1lks n LYS 116 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1lks n GLY 117 N 3.19 0.83 3.88 3.14 0.00 -1.26 -4.92 105.19 110.05 1lks n GLY 117 Ca 0.16 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 1lks n GLY 117 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1lks s THR 118 N -3.32 2.73 -1.14 2.61 -4.23 -0.64 -5.03 115.64 106.63 1lks s THR 118 Ca 0.00 -1.34 -0.21 0.00 -1.18 0.00 0.00 61.69 58.96 1lks s THR 118 Cb 0.00 -3.01 0.06 0.00 1.34 0.00 0.00 72.50 70.89 1lks s THR 118 CO 0.00 -0.01 1.57 -0.62 -0.54 0.00 0.00 174.62 175.01 1lks s ASP 119 N -4.12 6.64 0.53 3.99 2.15 -1.26 -4.79 116.67 119.81 1lks s ASP 119 Ca 0.48 -1.88 0.33 0.00 0.43 0.00 0.00 52.55 51.91 1lks s ASP 119 Cb -0.03 -2.57 1.39 0.00 -0.30 0.00 0.00 42.92 41.41 1lks s ASP 119 CO 0.28 -1.36 1.98 -0.37 -0.17 0.00 0.00 175.17 175.53 1lks h VAL 120 N 6.27 0.00 0.00 1.11 -1.51 -1.91 -2.32 116.25 117.90 1lks h VAL 120 Ca 0.30 -0.45 -0.01 0.00 -1.23 0.00 0.00 66.70 65.31 1lks h VAL 120 Cb 0.95 1.42 -0.00 0.00 -2.13 0.00 0.00 31.29 31.53 1lks h VAL 120 CO 1.44 0.00 -0.05 -0.61 -1.23 0.00 0.00 177.57 177.12 1lks h GLN 121 N 0.00 0.00 -0.23 5.19 4.15 -1.88 -0.65 115.11 121.68 1lks h GLN 121 Ca 0.00 0.00 0.07 0.00 0.77 0.00 0.00 58.65 59.49 1lks h GLN 121 Cb 0.47 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.15 1lks h GLN 121 CO 0.00 0.05 0.25 0.00 -1.93 0.00 0.00 178.83 177.20 1lks h ALA 122 N 1.95 1.90 0.00 3.38 0.00 -1.82 -1.31 119.26 123.35 1lks h ALA 122 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1lks h ALA 122 Cb 0.12 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1lks h ALA 122 CO 0.01 -0.37 0.00 -1.49 0.00 0.00 0.00 179.25 177.40 1lks h TRP 123 N 0.00 0.00 -0.00 0.00 4.06 -1.32 -3.11 115.95 115.57 1lks h TRP 123 Ca 0.11 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.06 1lks h TRP 123 Cb 0.61 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.77 1lks h TRP 123 CO 0.00 0.00 -0.00 0.44 -3.56 0.00 0.00 178.44 175.32 1lks n ILE 124 N -2.57 0.00 -1.99 1.49 -5.35 -0.57 -4.75 119.36 105.60 1lks n ILE 124 Ca 0.03 -0.50 -0.41 0.00 -0.27 0.00 0.00 62.75 61.60 1lks n ILE 124 Cb 0.37 1.07 -0.02 0.00 -1.74 0.00 0.00 39.64 39.32 1lks n ILE 124 CO 0.00 0.00 0.00 -0.60 -1.76 0.00 0.00 176.55 174.19 1lks s ARG 125 N -0.30 4.26 0.00 6.28 3.52 -0.73 -2.19 118.95 129.79 1lks s ARG 125 Ca 0.04 2.33 0.00 0.00 -0.13 0.00 0.00 55.73 57.97 1lks s ARG 125 Cb 0.03 -3.09 0.00 0.00 -1.56 0.00 0.00 34.95 30.33 1lks s ARG 125 CO 0.04 -0.41 0.00 0.41 -0.81 0.00 0.00 175.30 174.53 1lks n GLY 126 N 1.85 2.33 3.83 8.12 0.00 -1.26 -5.03 105.19 115.03 1lks n GLY 126 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.74 1lks n GLY 126 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1lks n ARG 128 N -0.26 0.00 0.00 0.00 3.00 -1.26 -5.13 116.66 113.01 1lks n ARG 128 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.89 1lks n ARG 128 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.99 1lks n ARG 128 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91