#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mm5 n ASN 2 N 0.00 4.38 0.02 7.83 4.13 -1.26 -4.71 115.26 125.64 1mm5 n ASN 2 Ca 0.00 -2.87 -0.08 0.00 1.68 0.00 0.00 54.58 53.31 1mm5 n ASN 2 Cb 0.00 -1.70 -0.06 0.00 -1.54 0.00 0.00 39.78 36.49 1mm5 n ASN 2 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1mm5 h ALA 3 N 7.29 -0.16 0.00 5.41 0.00 -2.05 -2.32 119.26 127.43 1mm5 h ALA 3 Ca 0.47 -0.20 -0.14 0.00 0.00 0.00 0.00 54.91 55.04 1mm5 h ALA 3 Cb 0.80 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 1mm5 h ALA 3 CO 1.59 -0.18 -0.66 -0.44 0.00 0.00 0.00 179.25 179.55 1mm5 h ASP 4 N -0.97 0.00 0.66 0.00 3.32 -2.00 -2.91 116.42 114.52 1mm5 h ASP 4 Ca -0.02 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.92 1mm5 h ASP 4 Cb 0.44 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1mm5 h ASP 4 CO 0.03 0.66 -0.56 -0.33 -1.72 0.00 0.00 179.24 177.32 1mm5 h GLU 5 N 0.00 0.00 0.09 3.56 5.08 -1.92 -2.74 114.58 118.65 1mm5 h GLU 5 Ca -0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1mm5 h GLU 5 Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1mm5 h GLU 5 CO 0.09 0.56 -0.04 -1.49 -1.00 0.00 0.00 179.01 177.12 1mm5 h TRP 6 N 0.00 -0.11 -0.36 4.33 4.06 -1.33 -3.23 115.95 119.31 1mm5 h TRP 6 Ca -0.01 -0.00 0.10 0.00 2.06 0.00 0.00 58.89 61.04 1mm5 h TRP 6 Cb 1.04 0.04 -0.01 0.00 -1.00 0.00 0.00 29.16 29.22 1mm5 h TRP 6 CO 0.00 0.41 0.26 0.00 -3.56 0.00 0.00 178.44 175.55 1mm5 h MET 7 N -0.87 0.01 0.59 0.49 -0.00 -1.58 -2.03 114.93 111.54 1mm5 h MET 7 Ca -0.01 -0.00 -0.03 0.00 -0.00 0.00 0.00 59.70 59.66 1mm5 h MET 7 Cb 0.58 -0.00 0.01 0.00 -0.00 0.00 0.00 31.60 32.18 1mm5 h MET 7 CO 0.02 0.01 -0.28 1.15 -0.00 0.00 0.00 176.91 177.81 1mm5 h THR 8 N 0.01 0.42 -0.52 -0.10 2.02 -1.53 0.57 112.91 113.79 1mm5 h THR 8 Ca 0.17 -0.04 -0.00 0.00 0.77 0.00 0.00 66.41 67.31 1mm5 h THR 8 Cb 0.67 0.44 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1mm5 h THR 8 CO -0.00 0.01 0.32 0.71 0.37 0.00 0.00 175.52 176.92 1mm5 h THR 9 N -0.82 1.15 -0.65 3.16 1.35 -1.45 0.21 112.91 115.87 1mm5 h THR 9 Ca -0.08 -0.33 -0.06 0.00 -0.55 0.00 0.00 66.41 65.39 1mm5 h THR 9 Cb 0.62 0.44 -0.03 0.00 -1.73 0.00 0.00 68.15 67.45 1mm5 h THR 9 CO 0.13 0.16 0.18 -0.26 -0.25 0.00 0.00 175.52 175.47 1mm5 h PHE 10 N 0.70 1.07 -0.04 4.73 -1.00 -1.29 -1.28 116.94 119.82 1mm5 h PHE 10 Ca 0.19 -0.12 -0.12 0.00 2.81 0.00 0.00 57.97 60.73 1mm5 h PHE 10 Cb -0.02 -0.30 -0.01 0.00 3.61 0.00 0.00 35.95 39.22 1mm5 h PHE 10 CO -0.03 0.88 -0.53 -0.09 -1.61 0.00 0.00 178.31 176.93 1mm5 h ARG 11 N 0.95 0.11 -0.01 1.51 2.43 0.50 -1.85 114.38 118.02 1mm5 h ARG 11 Ca 0.21 -0.07 -0.15 0.00 -0.81 0.00 0.00 59.98 59.16 1mm5 h ARG 11 Cb 0.33 0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1mm5 h ARG 11 CO -0.00 0.62 -0.69 1.49 -1.51 0.00 0.00 179.97 179.88 1mm5 h GLU 12 N 0.09 0.04 0.11 0.20 4.81 -0.26 -0.42 114.58 119.15 1mm5 h GLU 12 Ca -0.00 -0.03 -0.21 0.00 -0.13 0.00 0.00 59.36 58.99 1mm5 h GLU 12 Cb 0.97 0.01 0.02 0.00 0.63 0.00 0.00 28.75 30.38 1mm5 h GLU 12 CO 0.08 0.71 -0.89 -0.91 -0.73 0.00 0.00 179.01 177.27 1mm5 h ASN 13 N 0.03 0.60 -0.11 1.04 4.21 -1.07 -2.47 115.58 117.80 1mm5 h ASN 13 Ca -0.01 -0.87 -0.07 0.00 1.21 0.00 0.00 56.30 56.56 1mm5 h ASN 13 Cb 1.22 -0.19 0.00 0.00 -1.12 0.00 0.00 38.32 38.23 1mm5 h ASN 13 CO 0.09 1.41 -0.22 0.40 -1.29 0.00 0.00 177.43 177.83 1mm5 h ILE 14 N -0.13 1.39 -0.76 2.81 2.04 -1.38 -2.58 117.51 118.91 1mm5 h ILE 14 Ca -0.14 -1.50 -0.03 0.00 1.00 0.00 0.00 64.86 64.19 1mm5 h ILE 14 Cb 1.65 2.09 -0.03 0.00 -0.74 0.00 0.00 36.82 39.78 1mm5 h ILE 14 CO 0.17 0.43 0.36 0.00 0.00 0.00 0.00 178.15 179.11 1mm5 h ALA 15 N 0.52 0.98 -0.31 1.87 0.00 -1.20 0.13 119.26 121.24 1mm5 h ALA 15 Ca 0.00 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.75 1mm5 h ALA 15 Cb 0.80 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 1mm5 h ALA 15 CO 0.05 0.54 0.17 1.96 0.00 0.00 0.00 179.25 181.97 1mm5 h GLN 16 N 1.07 0.44 -0.02 0.00 4.20 -1.47 0.10 115.11 119.43 1mm5 h GLN 16 Ca 0.26 -0.05 -0.12 0.00 0.06 0.00 0.00 58.65 58.80 1mm5 h GLN 16 Cb 0.12 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.80 1mm5 h GLN 16 CO -0.03 0.38 -0.53 1.15 -0.67 0.00 0.00 178.83 179.13 1mm5 h THR 17 N 0.38 1.38 -0.23 -0.54 2.02 -1.24 0.13 112.91 114.80 1mm5 h THR 17 Ca 0.11 -1.82 -0.20 0.00 0.77 0.00 0.00 66.41 65.27 1mm5 h THR 17 Cb 0.07 1.96 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 1mm5 h THR 17 CO -0.02 0.53 -0.64 -0.50 0.37 0.00 0.00 175.52 175.26 1mm5 h TRP 18 N 0.05 1.07 0.00 3.16 -0.00 -0.36 -3.40 115.95 116.47 1mm5 h TRP 18 Ca -0.00 -0.42 0.00 0.00 -0.00 0.00 0.00 58.89 58.47 1mm5 h TRP 18 Cb 0.96 -0.19 0.00 0.00 -0.00 0.00 0.00 29.16 29.93 1mm5 h TRP 18 CO 0.00 1.25 0.00 0.94 -0.00 0.00 0.00 178.44 180.63 1mm5 n GLN 19 N -3.97 0.00 -2.24 0.49 7.27 0.32 -4.94 117.38 114.31 1mm5 n GLN 19 Ca -0.05 0.26 -0.36 0.00 0.07 0.00 0.00 57.00 56.92 1mm5 n GLN 19 Cb 0.68 -0.73 -0.00 0.00 2.41 0.00 0.00 30.24 32.59 1mm5 n GLN 19 CO 0.00 0.00 0.00 -0.65 0.07 0.00 0.00 177.06 176.48 1mm5 s GLN 20 N -0.82 3.55 0.00 3.69 -0.21 0.44 -5.04 119.66 121.27 1mm5 s GLN 20 Ca 0.00 1.71 0.00 0.00 0.02 0.00 0.00 55.36 57.09 1mm5 s GLN 20 Cb 0.00 -2.22 0.00 0.00 1.00 0.00 0.00 33.01 31.79 1mm5 s GLN 20 CO 0.00 -0.71 0.00 -0.35 -2.12 0.00 0.00 175.29 172.11 1mm5 n PRO 21 N -0.88 -0.38 -1.70 2.91 -0.04 -1.26 -4.33 135.00 129.34 1mm5 n PRO 21 Ca 0.09 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.53 1mm5 n PRO 21 Cb 0.49 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 33.98 1mm5 n PRO 21 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1mm5 n GLU 22 N -1.07 0.55 -4.02 0.54 1.02 -1.26 -4.90 120.64 111.50 1mm5 n GLU 22 Ca 0.00 -0.78 -0.35 0.00 -0.02 0.00 0.00 57.16 56.01 1mm5 n GLU 22 Cb 0.00 0.38 -0.13 0.00 -0.02 0.00 0.00 31.44 31.67 1mm5 n GLU 22 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1mm5 s HIS 23 N 0.05 3.02 -0.30 -0.32 3.76 -1.26 -4.34 115.29 115.90 1mm5 s HIS 23 Ca 0.04 -0.55 0.02 0.00 -0.15 0.00 0.00 55.06 54.42 1mm5 s HIS 23 Cb 0.18 -2.10 0.07 0.00 1.11 0.00 0.00 32.58 31.84 1mm5 s HIS 23 CO -0.05 -0.31 -0.03 -0.47 -0.85 0.00 0.00 174.74 173.02 1mm5 s TYR 24 N 1.14 3.40 -0.10 1.40 5.04 -0.68 -4.49 117.35 123.06 1mm5 s TYR 24 Ca 0.03 -2.39 0.01 0.00 -2.44 0.00 0.00 57.07 52.28 1mm5 s TYR 24 Cb -0.14 -2.27 -0.02 0.00 0.35 0.00 0.00 41.96 39.88 1mm5 s TYR 24 CO 0.01 -0.89 -0.15 -0.51 -1.34 0.00 0.00 175.55 172.68 1mm5 s ASP 25 N 1.13 3.90 -0.22 4.32 1.01 -1.07 -1.14 116.67 124.60 1mm5 s ASP 25 Ca -0.03 -0.32 -0.09 0.00 0.71 0.00 0.00 52.55 52.82 1mm5 s ASP 25 Cb -0.20 -1.37 -0.05 0.00 1.01 0.00 0.00 42.92 42.31 1mm5 s ASP 25 CO -0.05 0.21 0.12 -0.76 0.21 0.00 0.00 175.17 174.91 1mm5 s LEU 26 N 0.07 3.98 -0.21 1.23 1.02 -0.92 -0.82 118.68 123.02 1mm5 s LEU 26 Ca -0.06 0.08 -0.10 0.00 0.02 0.00 0.00 54.13 54.07 1mm5 s LEU 26 Cb -0.15 -2.05 -0.05 0.00 0.02 0.00 0.00 46.19 43.97 1mm5 s LEU 26 CO 0.05 0.10 0.13 -0.47 0.02 0.00 0.00 176.35 176.17 1mm5 s TYR 27 N 0.86 3.35 0.08 0.29 5.04 -0.97 -2.60 117.35 123.41 1mm5 s TYR 27 Ca 0.06 0.25 -0.21 0.00 -2.44 0.00 0.00 57.07 54.73 1mm5 s TYR 27 Cb -0.13 -2.19 0.05 0.00 0.35 0.00 0.00 41.96 40.04 1mm5 s TYR 27 CO 0.03 0.19 0.50 0.96 -1.34 0.00 0.00 175.55 175.88 1mm5 s ILE 28 N 0.61 0.04 1.07 3.14 -4.36 -1.00 -2.47 121.20 118.23 1mm5 s ILE 28 Ca 0.07 -0.29 -0.17 0.00 -0.26 0.00 0.00 60.65 60.00 1mm5 s ILE 28 Cb -0.12 -1.01 0.09 0.00 1.25 0.00 0.00 42.46 42.66 1mm5 s ILE 28 CO 0.01 -0.16 0.12 -2.65 0.24 0.00 0.00 174.94 172.50 1mm5 n PRO 29 N 0.19 -1.24 0.00 0.37 -0.02 -1.26 -1.01 135.00 132.03 1mm5 n PRO 29 Ca -0.18 -0.34 0.00 0.00 -2.02 0.00 0.00 63.50 60.97 1mm5 n PRO 29 Cb 0.61 -1.75 0.00 0.00 -0.02 0.00 0.00 33.50 32.35 1mm5 n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mm5 n ALA 30 N -4.19 2.46 -3.02 3.55 0.00 -1.23 -3.81 120.51 114.27 1mm5 n ALA 30 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.36 1mm5 n ALA 30 Cb 0.60 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 1mm5 n ALA 30 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1mm5 s ILE 31 N -0.62 0.10 -0.23 0.00 1.09 -1.26 -4.99 121.20 115.29 1mm5 s ILE 31 Ca 0.00 -0.79 -0.12 0.00 -1.10 0.00 0.00 60.65 58.64 1mm5 s ILE 31 Cb 0.00 -0.53 0.08 0.00 -1.06 0.00 0.00 42.46 40.95 1mm5 s ILE 31 CO 0.00 -0.44 0.55 -0.89 -0.10 0.00 0.00 174.94 174.07 1mm5 s THR 32 N -1.68 -0.18 -0.08 2.92 2.01 -1.26 -2.07 115.64 115.30 1mm5 s THR 32 Ca -0.13 0.05 0.02 0.00 0.31 0.00 0.00 61.69 61.95 1mm5 s THR 32 Cb -0.06 -0.82 0.01 0.00 0.01 0.00 0.00 72.50 71.64 1mm5 s THR 32 CO 0.00 0.02 -0.14 0.86 -0.69 0.00 0.00 174.62 174.67 1mm5 s TRP 33 N 1.78 1.75 -0.03 4.92 -0.00 -1.26 -5.12 118.94 120.98 1mm5 s TRP 33 Ca -0.09 -0.72 -0.01 0.00 -0.00 0.00 0.00 56.10 55.28 1mm5 s TRP 33 Cb -0.08 -1.26 -0.04 0.00 -0.00 0.00 0.00 33.47 32.09 1mm5 s TRP 33 CO -0.16 -0.36 0.06 -1.58 -0.00 0.00 0.00 176.95 174.91 1mm5 s HIS 34 N 0.77 3.27 -0.24 5.86 2.46 -1.26 -4.81 115.29 121.34 1mm5 s HIS 34 Ca -0.12 0.22 -0.03 0.00 0.47 0.00 0.00 55.06 55.61 1mm5 s HIS 34 Cb -0.16 -1.76 0.11 0.00 -0.13 0.00 0.00 32.58 30.64 1mm5 s HIS 34 CO 0.02 0.55 0.26 0.00 -2.47 0.00 0.00 174.74 173.10 1mm5 s ALA 35 N -1.11 -0.39 0.26 1.58 0.00 -1.26 -4.99 121.76 115.85 1mm5 s ALA 35 Ca 0.20 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.27 1mm5 s ALA 35 Cb -0.12 -1.51 0.00 0.00 0.00 0.00 0.00 23.12 21.49 1mm5 s ALA 35 CO 0.11 -1.38 0.00 -2.13 0.00 0.00 0.00 175.76 172.35 1mm5 n ARG 36 N 5.32 0.00 -3.44 0.00 0.63 -1.26 -5.06 116.66 112.85 1mm5 n ARG 36 Ca -0.04 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.71 1mm5 n ARG 36 Cb 0.48 0.00 0.09 0.00 0.45 0.00 0.00 32.46 33.48 1mm5 n ARG 36 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 1mm5 n PHE 37 N -3.27 -2.26 -2.78 -0.14 7.35 -1.26 -5.00 117.46 110.10 1mm5 n PHE 37 Ca 0.00 0.94 -0.26 0.00 -0.76 0.00 0.00 57.45 57.37 1mm5 n PHE 37 Cb 0.00 -5.04 0.00 0.00 0.35 0.00 0.00 39.48 34.79 1mm5 n PHE 37 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1mm5 s ALA 38 N -3.35 3.48 -1.12 3.13 0.00 -1.26 -4.97 121.76 117.67 1mm5 s ALA 38 Ca 0.09 -0.66 -0.22 0.00 0.00 0.00 0.00 51.96 51.16 1mm5 s ALA 38 Cb -0.04 -2.45 -0.02 0.00 0.00 0.00 0.00 23.12 20.61 1mm5 s ALA 38 CO 0.72 -0.35 1.82 0.71 0.00 0.00 0.00 175.76 178.66 1mm5 s TYR 39 N -2.67 2.19 0.39 0.00 2.02 -1.26 -4.95 117.35 113.07 1mm5 s TYR 39 Ca 0.47 -0.16 -0.10 0.00 -0.37 0.00 0.00 57.07 56.90 1mm5 s TYR 39 Cb -0.10 -4.29 -0.06 0.00 -0.40 0.00 0.00 41.96 37.11 1mm5 s TYR 39 CO 0.42 -1.58 0.75 0.34 -1.57 0.00 0.00 175.55 173.92 1mm5 s ASP 40 N 6.12 6.53 -0.01 2.29 -1.08 -1.26 -5.01 116.67 124.25 1mm5 s ASP 40 Ca 0.62 1.12 -0.24 0.00 -0.52 0.00 0.00 52.55 53.53 1mm5 s ASP 40 Cb -0.01 -2.32 -0.19 0.00 -1.46 0.00 0.00 42.92 38.94 1mm5 s ASP 40 CO 0.05 -0.37 1.24 0.11 0.52 0.00 0.00 175.17 176.72 1mm5 h LYS 41 N 1.35 0.14 -0.15 4.34 6.56 -2.07 -3.28 116.57 123.45 1mm5 h LYS 41 Ca -0.47 -0.08 0.00 0.00 -1.06 0.00 0.00 60.65 59.04 1mm5 h LYS 41 Cb 1.19 0.01 -0.01 0.00 -0.57 0.00 0.00 32.23 32.85 1mm5 h LYS 41 CO 0.64 0.65 0.08 1.05 -2.06 0.00 0.00 179.45 179.81 1mm5 h GLU 42 N -0.36 0.17 -3.59 3.15 4.11 -2.01 -3.46 114.58 112.59 1mm5 h GLU 42 Ca 0.00 -0.01 -0.40 0.00 0.07 0.00 0.00 59.36 59.02 1mm5 h GLU 42 Cb 0.64 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1mm5 h GLU 42 CO 0.02 0.11 -0.54 1.17 0.07 0.00 0.00 179.01 179.84 1mm5 n LYS 43 N -5.01 -2.75 -0.09 1.06 0.00 -1.24 -4.86 118.16 105.27 1mm5 n LYS 43 Ca -0.04 0.93 -0.17 0.00 0.00 0.00 0.00 58.31 59.03 1mm5 n LYS 43 Cb 0.04 -5.66 -0.07 0.00 0.00 0.00 0.00 35.03 29.34 1mm5 n LYS 43 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 1mm5 n THR 44 N -4.11 0.96 -2.34 3.15 -2.24 -1.26 -5.11 114.28 103.32 1mm5 n THR 44 Ca -0.19 -0.28 -0.00 0.00 -2.27 0.00 0.00 64.05 61.30 1mm5 n THR 44 Cb 0.66 -1.56 -0.00 0.00 -2.10 0.00 0.00 70.33 67.33 1mm5 n THR 44 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1mm5 n ASP 45 N -3.56 -8.91 -4.51 3.42 -0.08 -1.26 -4.95 116.55 96.69 1mm5 n ASP 45 Ca -0.33 1.81 -0.29 0.00 -1.51 0.00 0.00 54.79 54.47 1mm5 n ASP 45 Cb 0.77 -5.16 0.24 0.00 2.34 0.00 0.00 41.12 39.31 1mm5 n ASP 45 CO 0.00 0.00 0.00 -0.13 0.12 0.00 0.00 177.20 177.19 1mm5 s ARG 46 N -0.65 -0.67 -0.09 -0.67 0.52 -1.26 -5.02 118.95 111.12 1mm5 s ARG 46 Ca -0.02 1.02 -0.08 0.00 -0.52 0.00 0.00 55.73 56.13 1mm5 s ARG 46 Cb 0.00 -1.57 -0.03 0.00 0.52 0.00 0.00 34.95 33.88 1mm5 s ARG 46 CO 0.05 -3.61 -0.15 0.98 0.02 0.00 0.00 175.30 172.59 1mm5 n TYR 47 N -4.86 0.17 -4.42 -0.53 4.19 -1.26 -4.98 117.16 105.46 1mm5 n TYR 47 Ca 0.05 0.07 -0.35 0.00 3.31 0.00 0.00 57.90 60.98 1mm5 n TYR 47 Cb 0.54 -0.35 -0.10 0.00 0.49 0.00 0.00 39.34 39.92 1mm5 n TYR 47 CO 0.00 0.00 0.00 1.21 0.91 0.00 0.00 176.86 178.98 1mm5 s ASN 48 N -4.88 5.07 -0.22 2.98 2.47 -1.26 -5.09 114.94 114.01 1mm5 s ASN 48 Ca -0.12 0.08 -0.04 0.00 0.42 0.00 0.00 52.86 53.19 1mm5 s ASN 48 Cb 0.02 -1.45 0.09 0.00 -1.45 0.00 0.00 41.25 38.45 1mm5 s ASN 48 CO 0.19 0.35 0.15 -0.70 -3.72 0.00 0.00 177.10 173.36 1mm5 s GLU 49 N -0.70 0.15 -0.39 0.43 2.56 -1.26 -5.08 118.70 114.40 1mm5 s GLU 49 Ca 0.11 -0.14 0.01 0.00 0.00 0.00 0.00 54.97 54.95 1mm5 s GLU 49 Cb -0.12 -1.40 0.14 0.00 2.00 0.00 0.00 34.13 34.76 1mm5 s GLU 49 CO 0.02 -0.79 0.23 1.03 -0.56 0.00 0.00 175.26 175.19 1mm5 s ARG 50 N 2.19 0.88 0.55 4.30 1.81 -1.26 -5.08 118.95 122.34 1mm5 s ARG 50 Ca 0.06 -1.67 -0.19 0.00 -1.72 0.00 0.00 55.73 52.21 1mm5 s ARG 50 Cb -0.16 -1.72 -0.05 0.00 -0.45 0.00 0.00 34.95 32.56 1mm5 s ARG 50 CO -0.19 -1.21 1.13 -1.25 -0.68 0.00 0.00 175.30 173.10 1mm5 s PRO 51 N 0.69 3.31 -0.10 3.54 0.04 -1.26 -4.96 135.00 136.27 1mm5 s PRO 51 Ca 0.19 1.59 -0.29 0.00 0.04 0.00 0.00 61.00 62.53 1mm5 s PRO 51 Cb -0.21 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.29 1mm5 s PRO 51 CO -0.01 -0.88 1.54 -1.58 0.04 0.00 0.00 177.00 176.11 1mm5 s TRP 52 N -1.82 2.23 -0.30 0.56 0.23 -1.26 -4.95 118.94 113.63 1mm5 s TRP 52 Ca 0.72 0.45 -0.17 0.00 -2.03 0.00 0.00 56.10 55.07 1mm5 s TRP 52 Cb -0.24 -3.81 0.18 0.00 0.03 0.00 0.00 33.47 29.64 1mm5 s TRP 52 CO 0.28 -3.16 1.16 0.20 0.96 0.00 0.00 176.95 176.38 1mm5 s GLY 53 N 3.05 0.07 0.10 0.98 0.00 -1.26 -3.74 107.32 106.51 1mm5 s GLY 53 Ca 0.68 3.39 -0.24 0.00 0.00 0.00 0.00 44.72 48.55 1mm5 s GLY 53 CO 0.25 3.33 1.12 0.61 0.00 0.00 0.00 173.10 178.41 1mm5 n GLY 54 N 4.75 0.44 0.00 0.20 0.00 -1.07 -4.51 105.19 105.01 1mm5 n GLY 54 Ca -0.08 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.84 1mm5 n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mm5 n GLY 55 N -0.79 -0.86 3.26 -0.02 0.00 -1.03 -2.19 105.19 103.56 1mm5 n GLY 55 Ca 0.01 -0.17 -0.15 0.00 0.00 0.00 0.00 46.02 45.70 1mm5 n GLY 55 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mm5 s PHE 56 N -4.00 1.36 -0.21 1.61 0.08 -0.89 -2.28 117.98 113.65 1mm5 s PHE 56 Ca 0.00 -1.46 -0.16 0.00 0.12 0.00 0.00 56.93 55.43 1mm5 s PHE 56 Cb 0.00 -0.56 0.06 0.00 -0.57 0.00 0.00 43.02 41.95 1mm5 s PHE 56 CO 0.00 -0.77 0.53 0.20 -0.10 0.00 0.00 175.22 175.08 1mm5 s GLY 57 N -3.24 -0.43 -0.10 4.36 0.00 -0.00 -0.42 107.32 107.49 1mm5 s GLY 57 Ca 0.39 1.69 -0.02 0.00 0.00 0.00 0.00 44.72 46.77 1mm5 s GLY 57 CO 0.18 1.62 -0.01 -2.27 0.00 0.00 0.00 173.10 172.62 1mm5 s LEU 58 N 0.84 3.48 -0.02 0.66 2.96 -0.93 -2.59 118.68 123.08 1mm5 s LEU 58 Ca -0.04 0.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.97 1mm5 s LEU 58 Cb -0.05 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.82 1mm5 s LEU 58 CO -0.07 0.32 -0.15 -0.55 -1.32 0.00 0.00 176.35 174.58 1mm5 s SER 59 N -0.53 1.77 0.26 3.68 0.15 -1.26 -1.32 113.70 116.45 1mm5 s SER 59 Ca 0.09 -0.27 0.09 0.00 0.70 0.00 0.00 55.95 56.55 1mm5 s SER 59 Cb -0.12 -0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 63.90 1mm5 s SER 59 CO 0.02 0.17 0.06 -0.13 1.20 0.00 0.00 173.24 174.57 1mm5 s ARG 60 N -0.27 2.51 -0.25 5.44 0.52 0.45 -4.64 118.95 122.71 1mm5 s ARG 60 Ca 0.04 -1.28 -0.11 0.00 -0.52 0.00 0.00 55.73 53.87 1mm5 s ARG 60 Cb -0.07 -2.31 -0.05 0.00 0.52 0.00 0.00 34.95 33.05 1mm5 s ARG 60 CO -0.00 0.38 0.17 -0.46 0.02 0.00 0.00 175.30 175.41 1mm5 s TRP 61 N -2.23 3.30 -0.03 -0.53 -0.11 -1.26 -2.39 118.94 115.69 1mm5 s TRP 61 Ca 0.32 0.21 -0.16 0.00 1.22 0.00 0.00 56.10 57.68 1mm5 s TRP 61 Cb -0.07 -2.29 -0.05 0.00 -1.50 0.00 0.00 33.47 29.56 1mm5 s TRP 61 CO 0.21 0.03 0.45 0.34 -4.62 0.00 0.00 176.95 173.36 1mm5 s ASP 62 N 1.17 6.80 0.61 5.86 -1.08 0.58 -4.94 116.67 125.67 1mm5 s ASP 62 Ca 0.07 0.96 0.29 0.00 -0.52 0.00 0.00 52.55 53.35 1mm5 s ASP 62 Cb -0.14 -2.28 1.51 0.00 -1.46 0.00 0.00 42.92 40.56 1mm5 s ASP 62 CO 0.05 0.22 1.90 -0.08 0.52 0.00 0.00 175.17 177.79 1mm5 h GLU 63 N 5.30 0.00 -1.11 4.34 4.81 -1.98 0.15 114.58 126.09 1mm5 h GLU 63 Ca -0.48 0.00 -0.38 0.00 -0.13 0.00 0.00 59.36 58.37 1mm5 h GLU 63 Cb 1.21 0.00 -0.20 0.00 0.63 0.00 0.00 28.75 30.38 1mm5 h GLU 63 CO 0.66 0.00 0.49 1.17 -0.73 0.00 0.00 179.01 180.60 1mm5 n LYS 64 N -3.46 1.94 -3.64 1.92 3.00 -1.26 -4.86 118.16 111.80 1mm5 n LYS 64 Ca 0.05 -2.08 -0.21 0.00 -0.00 0.00 0.00 58.31 56.06 1mm5 n LYS 64 Cb 0.57 -1.82 0.05 0.00 0.00 0.00 0.00 35.03 33.83 1mm5 n LYS 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1mm5 n GLY 65 N -0.45 -0.35 3.45 3.14 0.00 0.50 -5.00 105.19 106.48 1mm5 n GLY 65 Ca 0.41 0.13 -0.23 0.00 0.00 0.00 0.00 46.02 46.34 1mm5 n GLY 65 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mm5 s ASN 66 N -4.19 3.31 -0.43 1.61 0.02 -1.10 -4.69 114.94 109.47 1mm5 s ASN 66 Ca 0.10 -1.07 0.02 0.00 -1.02 0.00 0.00 52.86 50.90 1mm5 s ASN 66 Cb -0.05 -0.26 0.12 0.00 0.02 0.00 0.00 41.25 41.08 1mm5 s ASN 66 CO 0.79 -0.08 0.20 0.26 0.02 0.00 0.00 177.10 178.28 1mm5 s TRP 67 N -2.67 2.45 -0.02 2.20 0.52 -0.97 -0.31 118.94 120.13 1mm5 s TRP 67 Ca 0.29 -2.57 0.08 0.00 0.02 0.00 0.00 56.10 53.91 1mm5 s TRP 67 Cb -0.02 -2.22 -0.02 0.00 -1.15 0.00 0.00 33.47 30.06 1mm5 s TRP 67 CO 0.13 -0.81 -0.25 -1.58 0.02 0.00 0.00 176.95 174.46 1mm5 s HIS 68 N 0.46 2.25 0.01 -1.98 2.46 -1.01 -0.71 115.29 116.77 1mm5 s HIS 68 Ca 0.15 -0.42 -0.02 0.00 0.47 0.00 0.00 55.06 55.24 1mm5 s HIS 68 Cb -0.23 -1.45 0.01 0.00 -0.13 0.00 0.00 32.58 30.78 1mm5 s HIS 68 CO -0.05 -0.04 0.09 0.41 -2.47 0.00 0.00 174.74 172.69 1mm5 n GLY 69 N 2.46 1.04 3.96 1.59 0.00 -1.07 -0.41 105.19 112.76 1mm5 n GLY 69 Ca -0.16 -0.91 -0.22 0.00 0.00 0.00 0.00 46.02 44.73 1mm5 n GLY 69 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1mm5 s LEU 70 N 0.00 3.66 -0.08 0.99 2.34 -0.43 -0.42 118.68 124.73 1mm5 s LEU 70 Ca 0.02 0.17 -0.02 0.00 0.06 0.00 0.00 54.13 54.37 1mm5 s LEU 70 Cb -0.00 -3.06 0.03 0.00 -0.56 0.00 0.00 46.19 42.60 1mm5 s LEU 70 CO 0.00 -0.71 0.01 -0.47 -1.06 0.00 0.00 176.35 174.13 1mm5 s TYR 71 N -2.52 0.64 -0.19 3.48 6.14 0.53 -2.18 117.35 123.25 1mm5 s TYR 71 Ca 0.49 -0.20 -0.08 0.00 0.64 0.00 0.00 57.07 57.92 1mm5 s TYR 71 Cb -0.10 -0.79 -0.04 0.00 0.42 0.00 0.00 41.96 41.44 1mm5 s TYR 71 CO 0.37 -0.35 0.08 0.00 0.64 0.00 0.00 175.55 176.29 1mm5 s ALA 72 N 1.98 3.46 -0.15 3.97 0.00 0.44 -2.68 121.76 128.79 1mm5 s ALA 72 Ca 0.04 -0.77 -0.06 0.00 0.00 0.00 0.00 51.96 51.18 1mm5 s ALA 72 Cb -0.13 -2.00 0.07 0.00 0.00 0.00 0.00 23.12 21.06 1mm5 s ALA 72 CO -0.05 0.11 0.31 1.41 0.00 0.00 0.00 175.76 177.54 1mm5 s MET 73 N 0.48 0.22 -0.08 0.00 1.75 -0.99 -2.09 119.30 118.60 1mm5 s MET 73 Ca 0.04 0.80 0.03 0.00 -1.25 0.00 0.00 55.69 55.31 1mm5 s MET 73 Cb -0.12 0.05 0.01 0.00 2.84 0.00 0.00 34.83 37.61 1mm5 s MET 73 CO 0.00 -0.25 -0.17 0.00 -0.65 0.00 0.00 175.02 173.96 1mm5 s ALA 74 N 2.22 1.62 -0.34 4.11 0.00 -0.93 -0.43 121.76 128.02 1mm5 s ALA 74 Ca -0.02 -0.64 -0.08 0.00 0.00 0.00 0.00 51.96 51.23 1mm5 s ALA 74 Cb -0.11 -0.66 0.03 0.00 0.00 0.00 0.00 23.12 22.37 1mm5 s ALA 74 CO -0.10 0.19 0.12 0.12 0.00 0.00 0.00 175.76 176.09 1mm5 s PHE 75 N 0.53 3.23 -0.08 0.00 2.19 -1.07 -2.59 117.98 120.19 1mm5 s PHE 75 Ca -0.16 -1.22 -0.08 0.00 0.33 0.00 0.00 56.93 55.80 1mm5 s PHE 75 Cb -0.17 -2.31 -0.04 0.00 -1.31 0.00 0.00 43.02 39.19 1mm5 s PHE 75 CO 0.06 -0.68 0.20 0.15 1.83 0.00 0.00 175.22 176.78 1mm5 s LYS 76 N 1.46 3.53 0.29 10.12 1.02 -1.25 -2.53 119.74 132.39 1mm5 s LYS 76 Ca 0.00 -0.06 0.07 0.00 0.02 0.00 0.00 55.97 56.01 1mm5 s LYS 76 Cb -0.19 -3.17 -0.03 0.00 -0.52 0.00 0.00 37.83 33.92 1mm5 s LYS 76 CO 0.04 0.74 0.25 0.34 -0.92 0.00 0.00 175.35 175.80 1mm5 s ASP 77 N -1.20 5.42 0.61 2.83 2.15 -1.24 -4.51 116.67 120.72 1mm5 s ASP 77 Ca 0.19 -0.37 0.40 0.00 0.43 0.00 0.00 52.55 53.20 1mm5 s ASP 77 Cb -0.13 -1.19 2.10 0.00 -0.30 0.00 0.00 42.92 43.40 1mm5 s ASP 77 CO 0.08 -0.20 2.23 -1.28 -0.17 0.00 0.00 175.17 175.83 1mm5 h SER 78 N 1.36 0.00 0.00 -0.34 0.87 -1.98 -3.37 113.55 110.09 1mm5 h SER 78 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1mm5 h SER 78 Cb 1.25 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.21 1mm5 h SER 78 CO 0.59 0.00 0.00 1.87 -0.53 0.00 0.00 176.83 178.76 1mm5 n TRP 79 N -2.99 -0.23 -0.02 2.24 -0.00 -1.26 -5.12 117.44 110.06 1mm5 n TRP 79 Ca -0.02 0.00 -0.01 0.00 -0.00 0.00 0.00 57.50 57.47 1mm5 n TRP 79 Cb 0.11 0.19 0.01 0.00 -0.00 0.00 0.00 31.31 31.63 1mm5 n TRP 79 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1mm5 n ASN 80 N -1.88 -1.70 -3.27 5.87 5.03 -1.26 -5.04 115.26 113.02 1mm5 n ASN 80 Ca 0.00 -0.04 -0.10 0.00 0.87 0.00 0.00 54.58 55.32 1mm5 n ASN 80 Cb 0.00 -0.05 0.04 0.00 -1.02 0.00 0.00 39.78 38.75 1mm5 n ASN 80 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 1mm5 n LYS 81 N -1.71 0.58 -4.40 3.52 5.02 -1.26 -4.35 118.16 115.56 1mm5 n LYS 81 Ca 0.01 -1.35 -0.33 0.00 -2.02 0.00 0.00 58.31 54.61 1mm5 n LYS 81 Cb 0.03 -0.20 -0.10 0.00 -0.02 0.00 0.00 35.03 34.74 1mm5 n LYS 81 CO 0.00 0.00 0.00 1.67 -0.52 0.00 0.00 177.40 178.55 1mm5 s TRP 82 N -0.93 3.05 -0.30 2.13 1.48 -1.26 -3.66 118.94 119.45 1mm5 s TRP 82 Ca 0.29 0.09 -0.02 0.00 -1.06 0.00 0.00 56.10 55.40 1mm5 s TRP 82 Cb -0.02 -1.71 0.05 0.00 -1.16 0.00 0.00 33.47 30.63 1mm5 s TRP 82 CO 0.19 0.43 0.01 -1.21 -4.06 0.00 0.00 176.95 172.31 1mm5 s GLU 83 N -1.20 2.42 0.69 3.25 8.01 -1.05 -4.91 118.70 125.92 1mm5 s GLU 83 Ca 0.16 -1.28 -0.11 0.00 0.01 0.00 0.00 54.97 53.75 1mm5 s GLU 83 Cb -0.11 -3.20 0.01 0.00 -4.31 0.00 0.00 34.13 26.51 1mm5 s GLU 83 CO 0.06 -0.63 1.06 -1.25 0.01 0.00 0.00 175.26 174.50 1mm5 s PRO 84 N 1.25 2.94 -0.08 0.39 0.04 -1.26 -2.61 135.00 135.67 1mm5 s PRO 84 Ca -0.05 0.95 -0.06 0.00 0.04 0.00 0.00 61.00 61.88 1mm5 s PRO 84 Cb -0.20 -1.99 0.03 0.00 0.04 0.00 0.00 34.50 32.38 1mm5 s PRO 84 CO -0.01 -1.09 0.21 0.42 0.04 0.00 0.00 177.00 176.56 1mm5 s ILE 85 N -3.05 -0.02 -0.08 0.56 1.01 0.43 -2.32 121.20 117.73 1mm5 s ILE 85 Ca 0.58 0.08 -0.02 0.00 0.00 0.00 0.00 60.65 61.28 1mm5 s ILE 85 Cb -0.14 -0.31 0.04 0.00 0.01 0.00 0.00 42.46 42.06 1mm5 s ILE 85 CO 0.55 0.03 0.04 0.00 0.00 0.00 0.00 174.94 175.56 1mm5 s ALA 86 N 0.65 0.47 0.20 9.38 0.00 -1.07 -2.33 121.76 129.06 1mm5 s ALA 86 Ca -0.04 -0.05 -0.05 0.00 0.00 0.00 0.00 51.96 51.81 1mm5 s ALA 86 Cb -0.06 -0.76 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 1mm5 s ALA 86 CO -0.04 -0.63 0.24 0.20 0.00 0.00 0.00 175.76 175.53 1mm5 s GLY 87 N 2.08 1.04 -0.30 0.00 0.00 -1.09 -2.07 107.32 106.97 1mm5 s GLY 87 Ca 0.04 -1.36 -0.15 0.00 0.00 0.00 0.00 44.72 43.25 1mm5 s GLY 87 CO -0.05 -1.12 0.39 -0.19 0.00 0.00 0.00 173.10 172.13 1mm5 s TYR 88 N -4.09 3.23 -0.36 1.90 2.02 0.17 -0.34 117.35 119.87 1mm5 s TYR 88 Ca 0.31 0.26 -0.13 0.00 -0.37 0.00 0.00 57.07 57.13 1mm5 s TYR 88 Cb 0.04 -2.64 -0.00 0.00 -0.40 0.00 0.00 41.96 38.96 1mm5 s TYR 88 CO 0.09 -0.32 0.26 0.20 -1.57 0.00 0.00 175.55 174.20 1mm5 s GLY 89 N 1.68 1.98 -0.35 0.71 0.00 0.44 -2.35 107.32 109.42 1mm5 s GLY 89 Ca 0.14 -1.51 -0.11 0.00 0.00 0.00 0.00 44.72 43.25 1mm5 s GLY 89 CO 0.11 0.82 0.19 0.86 0.00 0.00 0.00 173.10 175.08 1mm5 s TRP 90 N 1.70 3.22 -0.10 1.90 -0.00 -0.84 -2.59 118.94 122.23 1mm5 s TRP 90 Ca 0.06 -0.83 0.04 0.00 -0.00 0.00 0.00 56.10 55.37 1mm5 s TRP 90 Cb -0.18 -2.42 -0.00 0.00 -0.00 0.00 0.00 33.47 30.87 1mm5 s TRP 90 CO 0.10 -0.58 -0.22 -2.00 -0.00 0.00 0.00 176.95 174.24 1mm5 s GLU 91 N 1.58 3.03 -0.41 5.86 2.12 0.11 -1.39 118.70 129.60 1mm5 s GLU 91 Ca 0.03 -0.85 -0.08 0.00 0.36 0.00 0.00 54.97 54.43 1mm5 s GLU 91 Cb -0.18 -2.33 0.08 0.00 0.26 0.00 0.00 34.13 31.95 1mm5 s GLU 91 CO 0.07 0.21 0.23 -1.12 -0.54 0.00 0.00 175.26 174.11 1mm5 s SER 92 N 0.27 5.52 0.23 -1.70 0.01 -0.11 -2.29 113.70 115.63 1mm5 s SER 92 Ca -0.16 -1.54 -0.30 0.00 1.31 0.00 0.00 55.95 55.27 1mm5 s SER 92 Cb -0.17 -1.94 -0.09 0.00 0.21 0.00 0.00 66.02 64.03 1mm5 s SER 92 CO 0.08 -0.51 1.16 -0.89 0.41 0.00 0.00 173.24 173.49 1mm5 s THR 93 N 1.37 3.48 -0.09 1.44 2.01 -1.26 -2.60 115.64 120.00 1mm5 s THR 93 Ca 0.03 1.36 -0.07 0.00 0.31 0.00 0.00 61.69 63.32 1mm5 s THR 93 Cb -0.23 -3.87 0.03 0.00 0.01 0.00 0.00 72.50 68.44 1mm5 s THR 93 CO 0.01 0.27 0.22 0.86 -0.69 0.00 0.00 174.62 175.29 1mm5 s TRP 94 N -0.60 -0.25 -0.05 4.92 -0.00 -0.77 -4.96 118.94 117.24 1mm5 s TRP 94 Ca 0.49 0.62 0.03 0.00 -0.00 0.00 0.00 56.10 57.24 1mm5 s TRP 94 Cb -0.33 0.07 0.00 0.00 -0.00 0.00 0.00 33.47 33.21 1mm5 s TRP 94 CO 0.40 -0.14 -0.13 -0.98 -0.00 0.00 0.00 176.95 176.10 1mm5 s ARG 95 N 0.39 1.50 0.00 5.86 3.03 -1.26 -2.59 118.95 125.88 1mm5 s ARG 95 Ca -0.02 -0.45 0.00 0.00 2.03 0.00 0.00 55.73 57.29 1mm5 s ARG 95 Cb -0.04 -1.30 0.00 0.00 -1.03 0.00 0.00 34.95 32.58 1mm5 s ARG 95 CO -0.02 0.13 0.00 -2.30 -1.13 0.00 0.00 175.30 171.98 1mm5 n PRO 96 N 3.42 0.66 0.02 3.89 -0.02 -1.26 -4.88 135.00 136.82 1mm5 n PRO 96 Ca -0.20 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.20 1mm5 n PRO 96 Cb 0.53 0.00 -0.13 0.00 -0.02 0.00 0.00 33.50 33.88 1mm5 n PRO 96 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 1mm5 h LEU 97 N 0.00 0.02 -2.01 2.45 5.85 -2.03 -3.31 115.31 116.27 1mm5 h LEU 97 Ca 0.00 -0.02 0.03 0.00 0.84 0.00 0.00 57.88 58.73 1mm5 h LEU 97 Cb 0.00 -0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.02 1mm5 h LEU 97 CO 0.00 1.02 0.08 0.00 -0.34 0.00 0.00 178.44 179.20 1mm5 h ALA 98 N 0.98 2.09 -4.06 1.25 0.00 -2.04 -3.48 119.26 114.00 1mm5 h ALA 98 Ca -0.16 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1mm5 h ALA 98 Cb 1.91 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.71 1mm5 h ALA 98 CO 0.10 -0.14 -0.87 -3.47 0.00 0.00 0.00 179.25 174.87 1mm5 n ASP 99 N -4.48 -8.34 -2.71 0.00 4.64 -1.25 -5.10 116.55 99.32 1mm5 n ASP 99 Ca -0.00 1.28 -0.01 0.00 -1.38 0.00 0.00 54.79 54.68 1mm5 n ASP 99 Cb 0.20 -4.69 0.01 0.00 -1.04 0.00 0.00 41.12 35.60 1mm5 n ASP 99 CO 0.00 0.00 0.00 -1.84 -0.82 0.00 0.00 177.20 174.54 1mm5 n GLU 100 N 1.72 0.36 0.22 -0.67 0.00 -1.26 -5.02 120.64 116.00 1mm5 n GLU 100 Ca 0.00 -0.89 0.10 0.00 0.00 0.00 0.00 57.16 56.37 1mm5 n GLU 100 Cb 0.00 1.25 0.47 0.00 0.00 0.00 0.00 31.44 33.16 1mm5 n GLU 100 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 1mm5 h ASN 101 N 1.38 0.00 -1.30 -1.84 2.35 -1.98 -3.43 115.58 110.75 1mm5 h ASN 101 Ca -0.18 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 54.97 1mm5 h ASN 101 Cb 0.83 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.18 1mm5 h ASN 101 CO 0.24 0.22 1.50 0.49 -1.65 0.00 0.00 177.43 178.23 1mm5 n PHE 102 N -3.41 1.58 -3.50 1.19 3.72 -1.26 -3.89 117.46 111.89 1mm5 n PHE 102 Ca 0.00 0.16 -0.38 0.00 -0.05 0.00 0.00 57.45 57.18 1mm5 n PHE 102 Cb 0.42 -2.58 -0.10 0.00 -0.94 0.00 0.00 39.48 36.28 1mm5 n PHE 102 CO 0.00 0.00 0.00 -1.01 -0.05 0.00 0.00 176.76 175.70 1mm5 s HIS 103 N 8.47 3.24 -0.02 1.38 3.76 -1.07 -4.83 115.29 126.23 1mm5 s HIS 103 Ca 1.08 0.26 0.00 0.00 -0.15 0.00 0.00 55.06 56.25 1mm5 s HIS 103 Cb -0.66 -2.46 0.02 0.00 1.11 0.00 0.00 32.58 30.59 1mm5 s HIS 103 CO 0.42 -0.18 0.00 -1.17 -0.85 0.00 0.00 174.74 172.97 1mm5 s LEU 104 N 1.86 1.44 0.00 0.89 0.20 -1.07 -2.14 118.68 119.86 1mm5 s LEU 104 Ca 0.11 -0.01 0.00 0.00 0.69 0.00 0.00 54.13 54.92 1mm5 s LEU 104 Cb -0.16 -0.13 0.00 0.00 -0.43 0.00 0.00 46.19 45.47 1mm5 s LEU 104 CO 0.10 -0.07 0.00 0.61 -0.29 0.00 0.00 176.35 176.71 1mm5 n GLY 105 N 3.76 1.86 3.73 7.98 0.00 -0.65 -1.84 105.19 120.03 1mm5 n GLY 105 Ca -0.22 -0.57 -0.26 0.00 0.00 0.00 0.00 46.02 44.97 1mm5 n GLY 105 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1mm5 s LEU 106 N 0.00 3.54 -0.12 0.99 0.20 -1.07 -2.59 118.68 119.63 1mm5 s LEU 106 Ca 0.00 -0.28 -0.06 0.00 0.69 0.00 0.00 54.13 54.47 1mm5 s LEU 106 Cb 0.00 -2.16 0.05 0.00 -0.43 0.00 0.00 46.19 43.64 1mm5 s LEU 106 CO 0.00 0.07 0.28 -0.83 -0.29 0.00 0.00 176.35 175.58 1mm5 s GLY 107 N -3.07 -0.18 -0.08 7.98 0.00 0.26 -0.94 107.32 111.29 1mm5 s GLY 107 Ca 0.29 1.10 0.02 0.00 0.00 0.00 0.00 44.72 46.13 1mm5 s GLY 107 CO 0.21 1.30 -0.12 -1.36 0.00 0.00 0.00 173.10 173.13 1mm5 s PHE 108 N 1.21 1.56 -0.38 1.90 0.08 -0.49 -0.42 117.98 121.45 1mm5 s PHE 108 Ca -0.09 -0.63 -0.10 0.00 0.12 0.00 0.00 56.93 56.24 1mm5 s PHE 108 Cb -0.09 -1.15 0.04 0.00 -0.57 0.00 0.00 43.02 41.24 1mm5 s PHE 108 CO -0.09 -0.34 0.20 0.95 -0.10 0.00 0.00 175.22 175.84 1mm5 s THR 109 N 0.83 4.35 -0.07 0.64 -4.23 -1.06 -1.99 115.64 114.10 1mm5 s THR 109 Ca -0.11 -1.03 -0.00 0.00 -1.18 0.00 0.00 61.69 59.36 1mm5 s THR 109 Cb -0.15 -3.49 0.02 0.00 1.34 0.00 0.00 72.50 70.23 1mm5 s THR 109 CO 0.02 -0.29 -0.03 0.00 -0.54 0.00 0.00 174.62 173.78 1mm5 s ALA 110 N 1.50 0.85 0.00 3.99 0.00 -0.99 -1.92 121.76 125.18 1mm5 s ALA 110 Ca 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.77 1mm5 s ALA 110 Cb -0.20 -0.68 0.00 0.00 0.00 0.00 0.00 23.12 22.24 1mm5 s ALA 110 CO 0.05 -0.29 0.00 0.41 0.00 0.00 0.00 175.76 175.93 1mm5 n GLY 111 N 4.71 1.18 3.54 0.00 0.00 -0.98 -0.66 105.19 112.98 1mm5 n GLY 111 Ca -0.14 -0.64 -0.29 0.00 0.00 0.00 0.00 46.02 44.95 1mm5 n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mm5 s VAL 112 N -2.22 3.13 0.00 1.61 -7.23 -0.88 -0.59 120.40 114.22 1mm5 s VAL 112 Ca 0.00 -1.43 0.07 0.00 -1.81 0.00 0.00 61.98 58.81 1mm5 s VAL 112 Cb 0.00 -2.47 -0.02 0.00 0.56 0.00 0.00 36.38 34.45 1mm5 s VAL 112 CO 0.00 0.07 -0.21 0.42 -0.31 0.00 0.00 175.10 175.07 1mm5 s THR 113 N -1.26 1.67 -0.31 5.32 -4.23 -1.06 -2.59 115.64 113.17 1mm5 s THR 113 Ca 0.21 -0.99 -0.27 0.00 -1.18 0.00 0.00 61.69 59.46 1mm5 s THR 113 Cb -0.11 -1.40 0.01 0.00 1.34 0.00 0.00 72.50 72.34 1mm5 s THR 113 CO 0.13 0.39 0.95 0.00 -0.54 0.00 0.00 174.62 175.54 1mm5 s ALA 114 N -0.59 3.53 0.11 3.99 0.00 -0.98 -2.45 121.76 125.37 1mm5 s ALA 114 Ca 0.08 -0.20 -0.00 0.00 0.00 0.00 0.00 51.96 51.84 1mm5 s ALA 114 Cb -0.08 -3.50 -0.04 0.00 0.00 0.00 0.00 23.12 19.49 1mm5 s ALA 114 CO 0.00 -1.33 0.01 1.03 0.00 0.00 0.00 175.76 175.47 1mm5 s ARG 115 N 3.31 0.87 -1.11 0.00 1.81 -1.26 -4.49 118.95 118.08 1mm5 s ARG 115 Ca 0.40 -1.39 -0.09 0.00 -1.72 0.00 0.00 55.73 52.92 1mm5 s ARG 115 Cb -0.13 0.07 0.28 0.00 -0.45 0.00 0.00 34.95 34.71 1mm5 s ARG 115 CO 0.13 -0.16 1.11 -0.51 -0.68 0.00 0.00 175.30 175.19 1mm5 s ASP 116 N -3.04 7.31 0.05 0.23 1.11 -1.26 -4.87 116.67 116.20 1mm5 s ASP 116 Ca 0.18 -3.59 -0.12 0.00 0.18 0.00 0.00 52.55 49.20 1mm5 s ASP 116 Cb 0.07 -2.21 0.01 0.00 1.07 0.00 0.00 42.92 41.87 1mm5 s ASP 116 CO -0.02 -0.29 0.26 0.20 1.18 0.00 0.00 175.17 176.51 1mm5 s ASN 117 N 1.31 -0.06 0.00 0.27 0.01 -1.26 -4.98 114.94 110.24 1mm5 s ASN 117 Ca 0.31 -0.29 0.00 0.00 -0.71 0.00 0.00 52.86 52.17 1mm5 s ASN 117 Cb -0.10 0.34 0.00 0.00 0.41 0.00 0.00 41.25 41.90 1mm5 s ASN 117 CO -0.08 -0.61 0.00 1.87 -1.51 0.00 0.00 177.10 176.77 1mm5 n TRP 118 N 0.54 0.00 0.05 2.20 -0.00 -1.26 -3.91 117.44 115.06 1mm5 n TRP 118 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.32 1mm5 n TRP 118 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 31.31 31.91 1mm5 n TRP 118 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1mm5 n ASN 119 N 1.49 -0.92 -1.15 5.87 4.05 -1.26 -5.00 115.26 118.33 1mm5 n ASN 119 Ca 0.00 0.53 -0.05 0.00 0.45 0.00 0.00 54.58 55.51 1mm5 n ASN 119 Cb 0.00 1.20 -0.03 0.00 1.23 0.00 0.00 39.78 42.18 1mm5 n ASN 119 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1mm5 n TYR 120 N -2.94 -0.28 -3.73 1.20 0.18 -1.25 -5.05 117.16 105.29 1mm5 n TYR 120 Ca 0.00 -0.55 -0.33 0.00 1.88 0.00 0.00 57.90 58.90 1mm5 n TYR 120 Cb 0.00 0.60 -0.05 0.00 -0.38 0.00 0.00 39.34 39.51 1mm5 n TYR 120 CO 0.00 0.00 0.00 0.96 -2.08 0.00 0.00 176.86 175.74 1mm5 s ILE 121 N 0.02 5.24 0.79 -3.48 -5.25 -1.26 -5.10 121.20 112.17 1mm5 s ILE 121 Ca 0.01 0.11 -0.11 0.00 -0.99 0.00 0.00 60.65 59.67 1mm5 s ILE 121 Cb 0.06 -3.60 0.07 0.00 2.95 0.00 0.00 42.46 41.94 1mm5 s ILE 121 CO -0.02 0.24 1.09 -2.16 -1.79 0.00 0.00 174.94 172.30 1mm5 s PRO 122 N -2.10 2.11 -0.51 0.37 0.04 -1.26 -4.74 135.00 128.91 1mm5 s PRO 122 Ca 0.33 0.84 0.04 0.00 0.04 0.00 0.00 61.00 62.24 1mm5 s PRO 122 Cb -0.13 -1.91 0.13 0.00 0.04 0.00 0.00 34.50 32.64 1mm5 s PRO 122 CO 0.20 -1.65 0.27 -1.17 0.04 0.00 0.00 177.00 174.68 1mm5 s LEU 123 N -5.85 3.93 0.32 -3.56 0.20 -1.03 -4.93 118.68 107.76 1mm5 s LEU 123 Ca 0.61 -2.96 -0.27 0.00 0.69 0.00 0.00 54.13 52.19 1mm5 s LEU 123 Cb -0.16 -1.49 -0.13 0.00 -0.43 0.00 0.00 46.19 43.98 1mm5 s LEU 123 CO 0.55 -0.23 0.98 -2.65 -0.29 0.00 0.00 176.35 174.71 1mm5 n PRO 124 N 3.15 1.31 -4.03 0.98 -0.02 -1.26 -2.55 135.00 132.58 1mm5 n PRO 124 Ca 0.07 0.46 -0.12 0.00 -2.02 0.00 0.00 63.50 61.89 1mm5 n PRO 124 Cb 0.33 -1.86 -0.12 0.00 -0.02 0.00 0.00 33.50 31.83 1mm5 n PRO 124 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1mm5 s VAL 125 N -1.12 0.34 -0.16 -1.45 -7.23 0.24 -4.92 120.40 106.10 1mm5 s VAL 125 Ca 0.59 -0.82 -0.04 0.00 -1.81 0.00 0.00 61.98 59.90 1mm5 s VAL 125 Cb -0.67 -0.41 0.08 0.00 0.56 0.00 0.00 36.38 35.93 1mm5 s VAL 125 CO 0.59 -0.32 0.25 -0.76 -0.31 0.00 0.00 175.10 174.55 1mm5 s LEU 126 N -1.22 -0.24 -0.11 1.32 1.02 -1.26 -2.33 118.68 115.87 1mm5 s LEU 126 Ca -0.10 0.24 -0.02 0.00 0.02 0.00 0.00 54.13 54.27 1mm5 s LEU 126 Cb -0.08 0.58 0.04 0.00 0.02 0.00 0.00 46.19 46.75 1mm5 s LEU 126 CO -0.00 -0.28 0.02 -0.76 0.02 0.00 0.00 176.35 175.35 1mm5 s LEU 127 N 2.38 0.69 0.45 1.79 1.43 -0.81 -5.02 118.68 119.59 1mm5 s LEU 127 Ca 0.04 -0.28 -0.22 0.00 -1.03 0.00 0.00 54.13 52.65 1mm5 s LEU 127 Cb -0.14 -0.45 -0.09 0.00 0.03 0.00 0.00 46.19 45.55 1mm5 s LEU 127 CO -0.10 -0.23 1.04 -2.16 0.23 0.00 0.00 176.35 175.13 1mm5 s PRO 128 N 1.97 3.94 0.28 1.29 0.04 -1.26 -2.57 135.00 138.68 1mm5 s PRO 128 Ca 0.03 1.41 -0.20 0.00 0.04 0.00 0.00 61.00 62.28 1mm5 s PRO 128 Cb -0.14 -2.26 0.04 0.00 0.04 0.00 0.00 34.50 32.18 1mm5 s PRO 128 CO -0.06 -0.32 0.79 -0.48 0.04 0.00 0.00 177.00 176.97 1mm5 s LEU 129 N -3.17 -0.17 0.00 -3.56 2.34 0.44 -2.58 118.68 111.98 1mm5 s LEU 129 Ca 0.64 -0.72 0.06 0.00 0.06 0.00 0.00 54.13 54.17 1mm5 s LEU 129 Cb -0.18 2.65 -0.02 0.00 -0.56 0.00 0.00 46.19 48.08 1mm5 s LEU 129 CO 0.23 -1.35 -0.20 0.00 -1.06 0.00 0.00 176.35 173.97 1mm5 s ALA 130 N -3.34 1.65 -0.24 1.48 0.00 -0.73 -0.57 121.76 120.00 1mm5 s ALA 130 Ca 0.13 -0.91 -0.16 0.00 0.00 0.00 0.00 51.96 51.02 1mm5 s ALA 130 Cb -0.05 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 1mm5 s ALA 130 CO 0.07 0.39 0.40 -1.12 0.00 0.00 0.00 175.76 175.51 1mm5 s SER 131 N -0.70 6.36 -0.08 0.00 0.01 -1.07 -2.57 113.70 115.65 1mm5 s SER 131 Ca 0.07 0.42 -0.05 0.00 1.31 0.00 0.00 55.95 57.71 1mm5 s SER 131 Cb -0.08 -2.23 0.04 0.00 0.21 0.00 0.00 66.02 63.96 1mm5 s SER 131 CO 0.00 -0.15 0.19 -0.69 0.41 0.00 0.00 173.24 173.00 1mm5 s VAL 132 N 1.77 -0.03 0.00 3.43 1.01 -0.41 -1.63 120.40 124.54 1mm5 s VAL 132 Ca 0.18 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.27 1mm5 s VAL 132 Cb -0.15 -0.29 0.00 0.00 0.00 0.00 0.00 36.38 35.94 1mm5 s VAL 132 CO 0.09 0.05 0.00 0.61 0.00 0.00 0.00 175.10 175.85 1mm5 n GLY 133 N 3.86 0.82 3.24 4.51 0.00 -0.91 -0.42 105.19 116.30 1mm5 n GLY 133 Ca -0.22 -0.62 0.03 0.00 0.00 0.00 0.00 46.02 45.21 1mm5 n GLY 133 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mm5 s TYR 134 N -2.11 -1.43 0.00 1.61 5.04 0.50 -2.60 117.35 118.37 1mm5 s TYR 134 Ca 0.00 1.68 0.00 0.00 -2.44 0.00 0.00 57.07 56.31 1mm5 s TYR 134 Cb 0.00 0.56 0.00 0.00 0.35 0.00 0.00 41.96 42.87 1mm5 s TYR 134 CO 0.00 -0.77 0.00 0.41 -1.34 0.00 0.00 175.55 173.85 1mm5 n GLY 135 N 5.42 1.92 0.16 8.97 0.00 -1.25 -2.62 105.19 117.79 1mm5 n GLY 135 Ca -0.04 0.06 0.12 0.00 0.00 0.00 0.00 46.02 46.16 1mm5 n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mm5 h PRO 136 N 0.00 0.00 -5.53 1.61 0.13 -1.97 -3.45 132.00 122.80 1mm5 h PRO 136 Ca 0.00 0.00 -0.63 0.00 -0.87 0.00 0.00 66.00 64.50 1mm5 h PRO 136 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 1mm5 h PRO 136 CO 0.00 0.00 0.18 0.54 -0.23 0.00 0.00 178.00 178.49 1mm5 s VAL 137 N -3.27 4.87 -0.16 1.56 0.11 -1.08 -3.73 120.40 118.70 1mm5 s VAL 137 Ca 0.04 0.64 0.00 0.00 -2.93 0.00 0.00 61.98 59.73 1mm5 s VAL 137 Cb 0.08 -4.09 0.03 0.00 -1.53 0.00 0.00 36.38 30.87 1mm5 s VAL 137 CO 0.72 -0.32 -0.12 -0.89 -3.33 0.00 0.00 175.10 171.16 1mm5 s THR 138 N 2.76 1.52 -0.05 5.04 2.01 -1.07 -0.37 115.64 125.47 1mm5 s THR 138 Ca 0.25 -0.70 0.03 0.00 0.31 0.00 0.00 61.69 61.59 1mm5 s THR 138 Cb -0.14 -1.49 0.00 0.00 0.01 0.00 0.00 72.50 70.88 1mm5 s THR 138 CO 0.15 0.36 -0.14 0.72 -0.69 0.00 0.00 174.62 175.02 1mm5 s PHE 139 N 1.49 1.48 0.02 4.92 -0.71 0.44 -0.43 117.98 125.20 1mm5 s PHE 139 Ca 0.03 -0.47 0.06 0.00 -1.04 0.00 0.00 56.93 55.51 1mm5 s PHE 139 Cb -0.14 -1.04 -0.02 0.00 -1.21 0.00 0.00 43.02 40.61 1mm5 s PHE 139 CO -0.10 -0.21 -0.18 1.14 -1.34 0.00 0.00 175.22 174.54 1mm5 s GLN 140 N 0.33 1.31 -0.09 1.99 -2.07 -1.00 -1.28 119.66 118.84 1mm5 s GLN 140 Ca -0.09 -0.79 0.01 0.00 -1.82 0.00 0.00 55.36 52.67 1mm5 s GLN 140 Cb -0.13 -1.34 -0.02 0.00 -1.09 0.00 0.00 33.01 30.43 1mm5 s GLN 140 CO 0.03 0.35 -0.11 -1.64 -1.32 0.00 0.00 175.29 172.60 1mm5 s MET 141 N -0.89 3.00 -0.02 9.60 -1.94 -1.06 -2.07 119.30 125.91 1mm5 s MET 141 Ca 0.06 -0.64 0.08 0.00 -1.71 0.00 0.00 55.69 53.48 1mm5 s MET 141 Cb -0.08 -2.58 -0.02 0.00 2.01 0.00 0.00 34.83 34.17 1mm5 s MET 141 CO 0.01 0.45 -0.25 -0.08 -0.01 0.00 0.00 175.02 175.14 1mm5 s THR 142 N -0.25 1.99 -0.07 2.05 -1.32 -0.71 -1.78 115.64 115.55 1mm5 s THR 142 Ca 0.02 -1.07 0.03 0.00 -1.21 0.00 0.00 61.69 59.46 1mm5 s THR 142 Cb -0.13 -1.65 -0.02 0.00 -1.51 0.00 0.00 72.50 69.19 1mm5 s THR 142 CO 0.03 0.56 -0.16 -0.72 -2.21 0.00 0.00 174.62 172.12 1mm5 s TYR 143 N -0.54 2.67 -0.68 9.09 1.13 -1.07 -1.38 117.35 126.58 1mm5 s TYR 143 Ca 0.08 -0.36 -0.12 0.00 -1.41 0.00 0.00 57.07 55.26 1mm5 s TYR 143 Cb -0.10 -1.67 0.17 0.00 -1.10 0.00 0.00 41.96 39.27 1mm5 s TYR 143 CO -0.00 0.03 0.59 -1.50 -2.51 0.00 0.00 175.55 172.16 1mm5 s ILE 144 N -0.40 5.00 0.73 -3.49 2.07 -1.07 -4.41 121.20 119.64 1mm5 s ILE 144 Ca 0.04 -2.23 -0.12 0.00 -1.41 0.00 0.00 60.65 56.93 1mm5 s ILE 144 Cb -0.12 -4.17 0.04 0.00 0.13 0.00 0.00 42.46 38.34 1mm5 s ILE 144 CO 0.02 -0.93 1.10 -2.16 -1.91 0.00 0.00 174.94 171.06 1mm5 s PRO 145 N 0.63 2.43 0.00 3.50 0.04 -1.26 -3.38 135.00 136.97 1mm5 s PRO 145 Ca 0.13 1.25 0.00 0.00 0.04 0.00 0.00 61.00 62.41 1mm5 s PRO 145 Cb -0.19 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.44 1mm5 s PRO 145 CO -0.04 -1.52 0.00 0.41 0.04 0.00 0.00 177.00 175.89 1mm5 n GLY 146 N -0.97 -0.00 1.04 0.56 0.00 -1.26 -4.95 105.19 99.62 1mm5 n GLY 146 Ca 0.10 -0.05 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1mm5 n GLY 146 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mm5 n THR 147 N -1.41 0.00 -2.06 2.61 -2.24 -1.26 -5.11 114.28 104.82 1mm5 n THR 147 Ca 0.00 0.00 -0.29 0.00 -2.27 0.00 0.00 64.05 61.49 1mm5 n THR 147 Cb 0.00 -0.65 0.17 0.00 -2.10 0.00 0.00 70.33 67.75 1mm5 n THR 147 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 1mm5 s TYR 148 N -1.79 1.58 -0.13 4.78 5.04 -1.26 -5.02 117.35 120.55 1mm5 s TYR 148 Ca 0.00 0.20 0.12 0.00 -2.44 0.00 0.00 57.07 54.95 1mm5 s TYR 148 Cb 0.00 -3.91 -0.24 0.00 0.35 0.00 0.00 41.96 38.16 1mm5 s TYR 148 CO 0.00 -2.48 0.33 0.09 -1.34 0.00 0.00 175.55 172.15 1mm5 n ASN 149 N -3.59 0.70 -2.11 4.32 3.02 -1.26 -4.19 115.26 112.14 1mm5 n ASN 149 Ca 0.15 0.19 -0.15 0.00 -0.03 0.00 0.00 54.58 54.74 1mm5 n ASN 149 Cb 0.60 0.28 0.24 0.00 -0.61 0.00 0.00 39.78 40.29 1mm5 n ASN 149 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1mm5 n ASN 150 N -2.97 4.28 -0.67 6.41 5.15 -1.26 -5.04 115.26 121.15 1mm5 n ASN 150 Ca -0.27 -3.39 0.09 0.00 -0.60 0.00 0.00 54.58 50.41 1mm5 n ASN 150 Cb 1.09 -0.79 -0.03 0.00 -0.53 0.00 0.00 39.78 39.52 1mm5 n ASN 150 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1mm5 n GLY 151 N -0.63 -2.16 0.22 8.20 0.00 -1.26 -4.87 105.19 104.68 1mm5 n GLY 151 Ca 0.50 -1.32 -0.12 0.00 0.00 0.00 0.00 46.02 45.08 1mm5 n GLY 151 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mm5 n ASN 152 N -3.21 2.32 -4.16 1.61 4.13 -1.22 -4.75 115.26 109.98 1mm5 n ASN 152 Ca -0.01 0.01 -0.20 0.00 1.68 0.00 0.00 54.58 56.05 1mm5 n ASN 152 Cb 0.31 -0.29 -0.13 0.00 -1.54 0.00 0.00 39.78 38.13 1mm5 n ASN 152 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 1mm5 s VAL 153 N -2.28 1.16 0.06 2.41 1.01 -1.26 -5.05 120.40 116.45 1mm5 s VAL 153 Ca -0.19 -1.05 0.07 0.00 0.00 0.00 0.00 61.98 60.81 1mm5 s VAL 153 Cb 0.06 -1.05 -0.03 0.00 0.00 0.00 0.00 36.38 35.35 1mm5 s VAL 153 CO 0.30 -0.01 -0.17 -0.72 0.00 0.00 0.00 175.10 174.50 1mm5 s TYR 154 N -0.89 2.57 -0.08 5.22 1.13 -1.26 -2.58 117.35 121.45 1mm5 s TYR 154 Ca 0.02 -0.25 0.00 0.00 -1.41 0.00 0.00 57.07 55.43 1mm5 s TYR 154 Cb -0.08 -1.44 0.02 0.00 -1.10 0.00 0.00 41.96 39.36 1mm5 s TYR 154 CO 0.01 0.30 -0.06 -0.06 -2.51 0.00 0.00 175.55 173.23 1mm5 s PHE 155 N -0.99 1.10 0.34 -3.49 0.40 -0.48 -4.54 117.98 110.32 1mm5 s PHE 155 Ca 0.16 -0.43 -0.05 0.00 -0.60 0.00 0.00 56.93 56.01 1mm5 s PHE 155 Cb -0.11 -0.95 -0.05 0.00 0.51 0.00 0.00 43.02 42.43 1mm5 s PHE 155 CO 0.07 -0.34 0.62 0.00 0.70 0.00 0.00 175.22 176.27 1mm5 s ALA 156 N 1.33 3.57 -0.11 5.36 0.00 -0.88 -1.74 121.76 129.28 1mm5 s ALA 156 Ca -0.03 -0.56 -0.07 0.00 0.00 0.00 0.00 51.96 51.29 1mm5 s ALA 156 Cb -0.14 -2.37 0.04 0.00 0.00 0.00 0.00 23.12 20.66 1mm5 s ALA 156 CO -0.03 0.08 0.27 -1.58 0.00 0.00 0.00 175.76 174.50 1mm5 s TRP 157 N -2.26 -0.34 -0.10 0.00 0.52 -0.88 -3.58 118.94 112.30 1mm5 s TRP 157 Ca 0.45 0.81 -0.08 0.00 0.02 0.00 0.00 56.10 57.30 1mm5 s TRP 157 Cb -0.10 0.09 -0.04 0.00 -1.15 0.00 0.00 33.47 32.27 1mm5 s TRP 157 CO 0.33 -0.20 0.18 -1.64 0.02 0.00 0.00 176.95 175.64 1mm5 s MET 158 N 0.78 3.50 -0.04 4.98 -1.94 -0.18 -2.36 119.30 124.04 1mm5 s MET 158 Ca -0.05 -0.08 0.00 0.00 -1.71 0.00 0.00 55.69 53.86 1mm5 s MET 158 Cb -0.06 -3.18 0.03 0.00 2.01 0.00 0.00 34.83 33.62 1mm5 s MET 158 CO -0.05 0.76 -0.01 0.50 -0.01 0.00 0.00 175.02 176.20 1mm5 s ARG 159 N -1.11 0.52 -0.21 2.03 3.52 0.43 -2.37 118.95 121.76 1mm5 s ARG 159 Ca 0.17 0.02 -0.06 0.00 -0.13 0.00 0.00 55.73 55.73 1mm5 s ARG 159 Cb -0.13 -0.67 -0.03 0.00 -1.56 0.00 0.00 34.95 32.57 1mm5 s ARG 159 CO 0.06 -0.14 0.02 0.12 -0.81 0.00 0.00 175.30 174.56 1mm5 s PHE 160 N 1.10 3.07 -0.11 5.12 2.19 -1.07 -2.59 117.98 125.69 1mm5 s PHE 160 Ca -0.08 -0.43 -0.20 0.00 0.33 0.00 0.00 56.93 56.55 1mm5 s PHE 160 Cb -0.14 -2.13 -0.04 0.00 -1.31 0.00 0.00 43.02 39.40 1mm5 s PHE 160 CO -0.01 -0.26 0.55 1.14 1.83 0.00 0.00 175.22 178.47 1mm5 s GLN 161 N 1.16 4.35 -0.01 10.12 -2.07 -1.24 -2.17 119.66 129.80 1mm5 s GLN 161 Ca 0.03 0.58 0.00 0.00 -1.82 0.00 0.00 55.36 54.16 1mm5 s GLN 161 Cb -0.14 -3.45 0.02 0.00 -1.09 0.00 0.00 33.01 28.34 1mm5 s GLN 161 CO 0.02 0.09 0.00 -0.06 -1.32 0.00 0.00 175.29 174.02 1mm5 s PHE 162 N 0.80 0.14 -0.01 9.60 0.08 -0.29 -4.97 117.98 123.34 1mm5 s PHE 162 Ca 0.29 0.03 0.03 0.00 0.12 0.00 0.00 56.93 57.41 1mm5 s PHE 162 Cb -0.16 -0.21 -0.01 0.00 -0.57 0.00 0.00 43.02 42.07 1mm5 s PHE 162 CO 0.12 -0.06 -0.11 -0.51 -0.10 0.00 0.00 175.22 174.56 1mm5 s LEU 163 N 0.57 2.01 0.72 -0.37 1.02 -1.26 -1.68 118.68 119.69 1mm5 s LEU 163 Ca -0.05 -0.20 -0.11 0.00 0.02 0.00 0.00 54.13 53.79 1mm5 s LEU 163 Cb -0.08 -0.57 0.02 0.00 0.02 0.00 0.00 46.19 45.59 1mm5 s LEU 163 CO -0.01 0.13 1.08 -0.70 0.02 0.00 0.00 176.35 176.87 1mm5 s GLU 164 N -0.24 2.75 0.25 1.70 2.12 -1.26 -5.08 118.70 118.94 1mm5 s GLU 164 Ca 0.04 0.65 -0.20 0.00 0.36 0.00 0.00 54.97 55.81 1mm5 s GLU 164 Cb -0.04 -1.99 0.07 0.00 0.26 0.00 0.00 34.13 32.42 1mm5 s GLU 164 CO -0.00 -1.15 0.97 -3.38 -0.54 0.00 0.00 175.26 171.15 1mm5 s HIS 165 N -3.22 0.10 -0.07 5.30 -3.43 -1.26 -5.15 115.29 107.56 1mm5 s HIS 165 Ca 0.58 -0.59 0.02 0.00 -0.80 0.00 0.00 55.06 54.27 1mm5 s HIS 165 Cb -0.13 0.75 0.02 0.00 -1.43 0.00 0.00 32.58 31.79 1mm5 s HIS 165 CO 0.53 -1.13 -0.10 -1.01 -2.00 0.00 0.00 174.74 171.04 1mm5 s HIS 166 N -2.14 1.36 0.59 0.38 3.76 -1.26 -5.07 115.29 112.92 1mm5 s HIS 166 Ca 0.21 -0.53 0.00 0.00 -0.15 0.00 0.00 55.06 54.59 1mm5 s HIS 166 Cb -0.03 -1.04 0.00 0.00 1.11 0.00 0.00 32.58 32.61 1mm5 s HIS 166 CO 0.07 -0.31 0.00 1.58 -0.85 0.00 0.00 174.74 175.23 1mm5 n HIS 167 N 4.08 -3.96 -3.28 1.40 -0.00 -1.26 -4.89 115.22 107.31 1mm5 n HIS 167 Ca -0.21 2.17 -0.15 0.00 0.46 0.00 0.00 57.72 59.99 1mm5 n HIS 167 Cb 0.51 -3.47 0.08 0.00 -0.12 0.00 0.00 29.99 26.99 1mm5 n HIS 167 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1mm5 n HIS 168 N -3.45 -2.18 -1.72 1.57 -0.00 -1.26 -4.84 115.22 103.34 1mm5 n HIS 168 Ca -0.05 0.86 -0.35 0.00 -0.00 0.00 0.00 57.72 58.19 1mm5 n HIS 168 Cb 0.57 -4.58 -0.03 0.00 -0.00 0.00 0.00 29.99 25.94 1mm5 n HIS 168 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1mm5 s HIS 169 N -3.35 1.28 -2.00 1.57 0.09 -1.26 -5.13 115.29 106.48 1mm5 s HIS 169 Ca 0.17 1.34 0.27 0.00 -0.00 0.00 0.00 55.06 56.84 1mm5 s HIS 169 Cb -0.02 -3.74 1.63 0.00 -0.00 0.00 0.00 32.58 30.45 1mm5 s HIS 169 CO 0.70 -2.36 1.97 1.58 -0.00 0.00 0.00 174.74 176.62