#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 2.94 0.02 6.12 5.15 -1.26 -4.40 115.26 123.83 1mm5 n ASN 2 Ca 0.00 0.00 -0.08 0.00 -0.60 0.00 0.00 54.58 53.90 1mm5 n ASN 2 Cb 0.00 0.00 -0.06 0.00 -0.53 0.00 0.00 39.78 39.19 1mm5 n ASN 2 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1mm5 h ALA 3 N 0.00 -0.16 0.00 5.20 0.00 -2.07 -2.56 119.26 119.68 1mm5 h ALA 3 Ca 0.00 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.60 1mm5 h ALA 3 Cb 0.74 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 1mm5 h ALA 3 CO 0.00 -0.18 -0.54 -0.44 0.00 0.00 0.00 179.25 178.08 1mm5 h ASP 4 N -0.97 0.00 0.39 0.00 5.19 -2.02 -2.98 116.42 116.04 1mm5 h ASP 4 Ca -0.02 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 56.29 1mm5 h ASP 4 Cb 0.44 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.93 1mm5 h ASP 4 CO 0.03 0.54 -0.47 -0.33 -3.12 0.00 0.00 179.24 175.89 1mm5 h GLU 5 N 0.00 0.10 -0.58 3.56 4.39 -1.77 -3.03 114.58 117.25 1mm5 h GLU 5 Ca -0.01 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.61 1mm5 h GLU 5 Cb 1.04 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.66 1mm5 h GLU 5 CO 0.07 0.56 0.25 2.35 -1.16 0.00 0.00 179.01 181.08 1mm5 h TRP 6 N 0.08 0.87 -0.47 4.33 7.01 -1.29 -1.54 115.95 124.95 1mm5 h TRP 6 Ca 0.00 -0.06 -0.02 0.00 2.11 0.00 0.00 58.89 60.92 1mm5 h TRP 6 Cb 0.87 -0.26 -0.02 0.00 -2.10 0.00 0.00 29.16 27.64 1mm5 h TRP 6 CO 0.01 0.69 0.20 0.52 -2.79 0.00 0.00 178.44 177.06 1mm5 h MET 7 N 0.80 0.69 -0.13 2.65 2.86 -1.59 -2.45 114.93 117.77 1mm5 h MET 7 Ca 0.20 -0.12 -0.04 0.00 -2.06 0.00 0.00 59.70 57.67 1mm5 h MET 7 Cb 0.17 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 1mm5 h MET 7 CO -0.02 0.62 -0.13 1.15 1.06 0.00 0.00 176.91 179.59 1mm5 h THR 8 N 0.61 1.16 -0.06 2.22 2.02 -1.40 -2.11 112.91 115.35 1mm5 h THR 8 Ca 0.16 -0.72 -0.10 0.00 0.77 0.00 0.00 66.41 66.51 1mm5 h THR 8 Cb 0.18 1.21 -0.01 0.00 -1.74 0.00 0.00 68.15 67.79 1mm5 h THR 8 CO -0.01 0.22 -0.41 0.74 0.37 0.00 0.00 175.52 176.43 1mm5 h THR 9 N 0.19 1.31 -0.12 3.16 2.02 -0.83 -2.94 112.91 115.69 1mm5 h THR 9 Ca 0.04 -1.48 -0.18 0.00 0.77 0.00 0.00 66.41 65.55 1mm5 h THR 9 Cb 0.35 1.72 -0.00 0.00 -1.74 0.00 0.00 68.15 68.47 1mm5 h THR 9 CO 0.02 0.44 -0.68 0.15 0.37 0.00 0.00 175.52 175.82 1mm5 h PHE 10 N 0.12 0.67 -0.16 3.16 3.57 -0.98 -3.07 116.94 120.24 1mm5 h PHE 10 Ca 0.01 -0.28 0.01 0.00 3.53 0.00 0.00 57.97 61.25 1mm5 h PHE 10 Cb 0.78 -0.11 -0.01 0.00 2.79 0.00 0.00 35.95 39.40 1mm5 h PHE 10 CO 0.01 1.04 0.11 0.00 -2.23 0.00 0.00 178.31 177.23 1mm5 h ARG 11 N 0.36 0.15 -0.03 1.11 3.08 -1.30 -0.79 114.38 116.96 1mm5 h ARG 11 Ca -0.02 -0.01 -0.10 0.00 0.07 0.00 0.00 59.98 59.92 1mm5 h ARG 11 Cb 1.25 -0.03 -0.01 0.00 0.08 0.00 0.00 29.97 31.26 1mm5 h ARG 11 CO 0.12 0.10 -0.44 0.93 -1.07 0.00 0.00 179.97 179.62 1mm5 h GLU 12 N 0.16 0.07 -0.04 0.04 5.08 -1.51 -2.24 114.58 116.14 1mm5 h GLU 12 Ca 0.06 -0.03 -0.22 0.00 -1.00 0.00 0.00 59.36 58.17 1mm5 h GLU 12 Cb 0.06 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.32 1mm5 h GLU 12 CO -0.01 0.50 -0.87 -0.97 -1.00 0.00 0.00 179.01 176.66 1mm5 h ASN 13 N 0.06 0.60 0.03 1.42 -1.24 -1.21 -2.70 115.58 112.54 1mm5 h ASN 13 Ca 0.00 -0.44 -0.00 0.00 0.71 0.00 0.00 56.30 56.57 1mm5 h ASN 13 Cb 0.80 -0.18 0.00 0.00 0.73 0.00 0.00 38.32 39.67 1mm5 h ASN 13 CO 0.06 1.22 -0.02 0.40 -1.29 0.00 0.00 177.43 177.81 1mm5 h ILE 14 N 0.29 1.26 -0.05 2.57 1.08 -1.29 -2.47 117.51 118.90 1mm5 h ILE 14 Ca -0.07 -0.95 -0.01 0.00 -0.39 0.00 0.00 64.86 63.44 1mm5 h ILE 14 Cb 1.49 1.89 -0.00 0.00 -3.07 0.00 0.00 36.82 37.13 1mm5 h ILE 14 CO 0.16 0.24 -0.01 0.00 -0.69 0.00 0.00 178.15 177.84 1mm5 h ALA 15 N 0.49 1.88 -0.20 1.87 0.00 -1.50 0.14 119.26 121.94 1mm5 h ALA 15 Ca -0.00 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.79 1mm5 h ALA 15 Cb 0.43 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1mm5 h ALA 15 CO 0.01 0.09 -0.15 0.37 0.00 0.00 0.00 179.25 179.57 1mm5 h GLN 16 N 0.07 0.44 -0.02 0.00 5.75 -1.39 -1.97 115.11 118.00 1mm5 h GLN 16 Ca 0.02 -0.22 -0.16 0.00 -0.15 0.00 0.00 58.65 58.14 1mm5 h GLN 16 Cb 0.08 -0.00 -0.02 0.00 1.07 0.00 0.00 27.48 28.61 1mm5 h GLN 16 CO 0.00 0.77 -0.73 0.00 -2.65 0.00 0.00 178.83 176.22 1mm5 h THR 17 N 0.12 1.47 -0.27 2.39 1.03 -0.98 0.13 112.91 116.80 1mm5 h THR 17 Ca 0.04 -2.38 -0.11 0.00 -0.01 0.00 0.00 66.41 63.95 1mm5 h THR 17 Cb 0.66 2.28 -0.01 0.00 -1.07 0.00 0.00 68.15 70.01 1mm5 h THR 17 CO 0.04 0.69 -0.29 -0.25 -0.01 0.00 0.00 175.52 175.69 1mm5 h TRP 18 N 0.08 0.63 0.00 0.00 2.91 -0.72 -3.36 115.95 115.49 1mm5 h TRP 18 Ca -0.02 -0.15 0.00 0.00 1.13 0.00 0.00 58.89 59.85 1mm5 h TRP 18 Cb 1.29 -0.15 0.00 0.00 -0.51 0.00 0.00 29.16 29.80 1mm5 h TRP 18 CO 0.01 0.79 -0.40 1.96 -1.03 0.00 0.00 178.44 179.77 1mm5 h GLN 19 N 0.47 0.00 -6.09 2.65 1.08 -1.31 -3.49 115.11 108.42 1mm5 h GLN 19 Ca 0.06 0.00 -0.55 0.00 -1.45 0.00 0.00 58.65 56.71 1mm5 h GLN 19 Cb 0.75 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 28.10 1mm5 h GLN 19 CO 0.06 0.00 -0.57 -0.65 -0.95 0.00 0.00 178.83 176.72 1mm5 s GLN 20 N -1.98 2.31 0.97 1.46 -0.21 0.43 -5.10 119.66 117.54 1mm5 s GLN 20 Ca -0.11 -1.57 -0.16 0.00 0.02 0.00 0.00 55.36 53.54 1mm5 s GLN 20 Cb 0.02 -2.13 0.24 0.00 1.00 0.00 0.00 33.01 32.14 1mm5 s GLN 20 CO 0.17 0.15 0.76 -0.35 -2.12 0.00 0.00 175.29 173.90 1mm5 n PRO 21 N -1.08 -3.08 -0.06 2.91 -0.04 -1.26 -3.48 135.00 128.92 1mm5 n PRO 21 Ca -0.04 -1.23 -0.02 0.00 -0.04 0.00 0.00 63.50 62.17 1mm5 n PRO 21 Cb 0.61 -1.27 -0.01 0.00 -0.04 0.00 0.00 33.50 32.79 1mm5 n PRO 21 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1mm5 h GLU 22 N 0.00 0.00 -3.91 0.54 5.08 -1.90 -3.43 114.58 110.97 1mm5 h GLU 22 Ca -0.30 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.89 1mm5 h GLU 22 Cb 0.95 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 29.99 1mm5 h GLU 22 CO 0.19 0.00 -0.67 -1.01 -1.00 0.00 0.00 179.01 176.52 1mm5 s HIS 23 N -1.86 0.22 -0.29 4.33 3.76 -1.26 -4.86 115.29 115.33 1mm5 s HIS 23 Ca -0.07 -0.46 -0.08 0.00 -0.15 0.00 0.00 55.06 54.29 1mm5 s HIS 23 Cb 0.01 -0.17 -0.00 0.00 1.11 0.00 0.00 32.58 33.53 1mm5 s HIS 23 CO 0.11 -0.20 0.11 -0.47 -0.85 0.00 0.00 174.74 173.43 1mm5 s TYR 24 N -1.44 3.15 -0.26 1.40 6.14 -1.05 -4.41 117.35 120.88 1mm5 s TYR 24 Ca -0.16 -0.71 -0.08 0.00 0.64 0.00 0.00 57.07 56.76 1mm5 s TYR 24 Cb -0.10 -2.29 -0.03 0.00 0.42 0.00 0.00 41.96 39.97 1mm5 s TYR 24 CO -0.01 -0.49 0.08 -0.51 0.64 0.00 0.00 175.55 175.27 1mm5 s ASP 25 N 1.57 5.22 0.09 4.32 1.11 -0.77 -1.80 116.67 126.40 1mm5 s ASP 25 Ca 0.04 -0.24 -0.14 0.00 0.18 0.00 0.00 52.55 52.39 1mm5 s ASP 25 Cb -0.17 -1.94 -0.06 0.00 1.07 0.00 0.00 42.92 41.82 1mm5 s ASP 25 CO 0.04 -0.06 0.48 -0.22 1.18 0.00 0.00 175.17 176.59 1mm5 s LEU 26 N 1.62 4.40 -0.04 1.23 2.96 0.45 -0.45 118.68 128.84 1mm5 s LEU 26 Ca 0.06 1.00 -0.01 0.00 -0.22 0.00 0.00 54.13 54.96 1mm5 s LEU 26 Cb -0.15 -2.99 0.03 0.00 0.50 0.00 0.00 46.19 43.58 1mm5 s LEU 26 CO 0.04 0.19 0.04 -0.47 -1.32 0.00 0.00 176.35 174.83 1mm5 s TYR 27 N -1.31 0.22 0.02 5.38 5.04 0.44 -2.58 117.35 124.54 1mm5 s TYR 27 Ca 0.32 0.12 -0.23 0.00 -2.44 0.00 0.00 57.07 54.85 1mm5 s TYR 27 Cb -0.16 -0.51 0.05 0.00 0.35 0.00 0.00 41.96 41.69 1mm5 s TYR 27 CO 0.17 -0.20 0.51 0.96 -1.34 0.00 0.00 175.55 175.66 1mm5 s ILE 28 N 1.86 0.03 0.76 3.14 -0.00 -1.07 -0.73 121.20 125.18 1mm5 s ILE 28 Ca 0.01 -0.25 -0.12 0.00 -0.00 0.00 0.00 60.65 60.30 1mm5 s ILE 28 Cb -0.12 -0.92 0.05 0.00 -0.00 0.00 0.00 42.46 41.47 1mm5 s ILE 28 CO -0.03 -0.14 1.11 -2.16 -0.00 0.00 0.00 174.94 173.73 1mm5 s PRO 29 N -1.99 2.21 0.00 0.37 0.04 -1.26 -1.75 135.00 132.61 1mm5 s PRO 29 Ca -0.08 1.33 0.00 0.00 0.04 0.00 0.00 61.00 62.29 1mm5 s PRO 29 Cb -0.01 -1.88 0.00 0.00 0.04 0.00 0.00 34.50 32.65 1mm5 s PRO 29 CO 0.02 -1.70 0.00 0.00 0.04 0.00 0.00 177.00 175.36 1mm5 n ALA 30 N -3.27 2.39 -3.00 8.56 0.00 -1.20 -4.71 120.51 119.29 1mm5 n ALA 30 Ca 0.10 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.44 1mm5 n ALA 30 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.93 1mm5 n ALA 30 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1mm5 s ILE 31 N -0.39 0.07 -0.11 0.00 -5.25 -1.25 -5.08 121.20 109.19 1mm5 s ILE 31 Ca 0.00 -0.58 -0.03 0.00 -0.99 0.00 0.00 60.65 59.05 1mm5 s ILE 31 Cb 0.00 -1.16 0.05 0.00 2.95 0.00 0.00 42.46 44.30 1mm5 s ILE 31 CO 0.00 -0.32 0.14 0.42 -1.79 0.00 0.00 174.94 173.39 1mm5 s THR 32 N -3.77 -0.22 0.05 8.37 -4.23 -1.26 -2.54 115.64 112.05 1mm5 s THR 32 Ca 0.03 0.23 -0.05 0.00 -1.18 0.00 0.00 61.69 60.71 1mm5 s THR 32 Cb 0.02 -0.36 -0.02 0.00 1.34 0.00 0.00 72.50 73.48 1mm5 s THR 32 CO -0.12 0.04 0.09 0.26 -0.54 0.00 0.00 174.62 174.35 1mm5 s TRP 33 N 2.25 0.26 -0.15 3.99 0.52 -1.26 -5.07 118.94 119.49 1mm5 s TRP 33 Ca 0.04 -0.64 -0.24 0.00 0.02 0.00 0.00 56.10 55.27 1mm5 s TRP 33 Cb -0.13 -0.18 -0.02 0.00 -1.15 0.00 0.00 33.47 31.99 1mm5 s TRP 33 CO -0.07 -0.41 0.77 -1.58 0.02 0.00 0.00 176.95 175.69 1mm5 s HIS 34 N -3.15 3.45 -0.71 -1.98 2.46 -1.26 -4.48 115.29 109.61 1mm5 s HIS 34 Ca -0.00 1.21 -0.13 0.00 0.47 0.00 0.00 55.06 56.61 1mm5 s HIS 34 Cb 0.02 -2.94 0.19 0.00 -0.13 0.00 0.00 32.58 29.72 1mm5 s HIS 34 CO -0.07 -0.16 0.64 0.00 -2.47 0.00 0.00 174.74 172.68 1mm5 s ALA 35 N 1.83 3.88 0.12 1.58 0.00 -1.26 -4.77 121.76 123.14 1mm5 s ALA 35 Ca 0.37 -3.09 0.00 0.00 0.00 0.00 0.00 51.96 49.24 1mm5 s ALA 35 Cb -0.17 -3.31 0.00 0.00 0.00 0.00 0.00 23.12 19.64 1mm5 s ALA 35 CO 0.13 -2.17 0.00 -2.13 0.00 0.00 0.00 175.76 171.59 1mm5 n ARG 36 N 4.26 0.00 0.02 0.00 0.63 -1.26 -5.11 116.66 115.20 1mm5 n ARG 36 Ca 0.05 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.98 1mm5 n ARG 36 Cb 0.44 -0.15 0.00 0.00 0.45 0.00 0.00 32.46 33.20 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 -3.09 -2.42 -3.74 -0.14 7.35 -1.26 -5.12 117.46 109.04 1mm5 n PHE 37 Ca 0.00 0.15 -0.35 0.00 -0.76 0.00 0.00 57.45 56.49 1mm5 n PHE 37 Cb 0.00 0.76 -0.08 0.00 0.35 0.00 0.00 39.48 40.51 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 -1.10 3.68 -1.01 3.13 0.00 -1.26 -5.00 121.76 120.21 1mm5 s ALA 38 Ca 0.00 -0.69 -0.25 0.00 0.00 0.00 0.00 51.96 51.02 1mm5 s ALA 38 Cb 0.00 -2.16 -0.15 0.00 0.00 0.00 0.00 23.12 20.81 1mm5 s ALA 38 CO 0.00 0.17 2.12 0.71 0.00 0.00 0.00 175.76 178.76 1mm5 s TYR 39 N 0.34 1.44 -0.01 0.00 2.02 -1.26 -4.90 117.35 114.98 1mm5 s TYR 39 Ca 0.08 1.59 0.01 0.00 -0.37 0.00 0.00 57.07 58.38 1mm5 s TYR 39 Cb -0.11 -3.60 -0.04 0.00 -0.40 0.00 0.00 41.96 37.81 1mm5 s TYR 39 CO -0.02 -1.16 0.03 0.16 -1.57 0.00 0.00 175.55 172.99 1mm5 s ASP 40 N 8.58 5.30 0.07 2.29 -4.77 -1.26 -5.03 116.67 121.86 1mm5 s ASP 40 Ca 0.80 0.05 -0.17 0.00 -3.30 0.00 0.00 52.55 49.93 1mm5 s ASP 40 Cb -0.06 -1.44 -0.12 0.00 -1.09 0.00 0.00 42.92 40.20 1mm5 s ASP 40 CO 0.12 0.29 1.35 0.11 0.70 0.00 0.00 175.17 177.73 1mm5 h LYS 41 N 4.33 0.59 0.00 2.11 1.79 -2.01 -3.46 116.57 119.92 1mm5 h LYS 41 Ca -0.49 -0.36 0.00 0.00 -2.18 0.00 0.00 60.65 57.62 1mm5 h LYS 41 Cb 1.18 0.04 0.00 0.00 -1.58 0.00 0.00 32.23 31.87 1mm5 h LYS 41 CO 0.59 0.97 0.00 -1.91 -1.08 0.00 0.00 179.45 178.01 1mm5 n GLU 42 N -4.30 0.00 -0.07 3.15 0.00 -1.26 -3.83 120.64 114.33 1mm5 n GLU 42 Ca -0.06 0.00 -0.11 0.00 0.00 0.00 0.00 57.16 56.99 1mm5 n GLU 42 Cb 0.49 0.00 -0.06 0.00 0.00 0.00 0.00 31.44 31.88 1mm5 n GLU 42 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1mm5 n LYS 43 N 0.00 0.32 -2.66 5.31 5.02 -1.26 -5.10 118.16 119.79 1mm5 n LYS 43 Ca 0.00 0.09 -0.02 0.00 -2.02 0.00 0.00 58.31 56.37 1mm5 n LYS 43 Cb 0.00 -1.18 -0.02 0.00 -0.02 0.00 0.00 35.03 33.81 1mm5 n LYS 43 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1mm5 n THR 44 N -3.13-12.24 -3.05 -0.18 -1.04 -1.25 -4.95 114.28 88.43 1mm5 n THR 44 Ca -0.25 2.14 -0.40 0.00 -2.04 0.00 0.00 64.05 63.50 1mm5 n THR 44 Cb 0.73 -6.79 -0.05 0.00 -1.82 0.00 0.00 70.33 62.40 1mm5 n THR 44 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1mm5 s ASP 45 N -1.30 7.08 -0.18 8.00 3.68 -1.26 -4.98 116.67 127.70 1mm5 s ASP 45 Ca -0.09 1.29 -0.17 0.00 2.13 0.00 0.00 52.55 55.71 1mm5 s ASP 45 Cb 0.01 -2.43 -0.14 0.00 -1.45 0.00 0.00 42.92 38.91 1mm5 s ASP 45 CO 0.78 -0.02 0.10 0.03 0.13 0.00 0.00 175.17 176.20 1mm5 h ARG 46 N 6.08 0.00 -5.72 4.34 3.08 -2.07 -3.45 114.38 116.64 1mm5 h ARG 46 Ca -0.43 0.00 -0.60 0.00 0.07 0.00 0.00 59.98 59.02 1mm5 h ARG 46 Cb 1.20 0.00 -0.10 0.00 0.08 0.00 0.00 29.97 31.15 1mm5 h ARG 46 CO 0.72 0.67 0.37 0.71 -1.07 0.00 0.00 179.97 181.38 1mm5 s TYR 47 N -2.30 3.26 0.01 3.04 1.51 -1.26 -5.05 117.35 116.55 1mm5 s TYR 47 Ca -0.24 0.93 -0.03 0.00 -1.01 0.00 0.00 57.07 56.72 1mm5 s TYR 47 Cb 0.04 -3.07 -0.04 0.00 -0.11 0.00 0.00 41.96 38.78 1mm5 s TYR 47 CO 0.47 -0.45 0.21 1.21 -1.11 0.00 0.00 175.55 175.87 1mm5 s ASN 48 N 1.48 6.40 -0.08 2.29 3.84 -1.26 -5.10 114.94 122.51 1mm5 s ASN 48 Ca 0.32 0.39 0.01 0.00 0.21 0.00 0.00 52.86 53.79 1mm5 s ASN 48 Cb -0.15 -2.02 0.02 0.00 -0.55 0.00 0.00 41.25 38.55 1mm5 s ASN 48 CO 0.10 0.24 -0.10 -0.70 -2.79 0.00 0.00 177.10 173.85 1mm5 s GLU 49 N -1.99 1.56 -0.62 0.43 2.12 -1.26 -5.09 118.70 113.85 1mm5 s GLU 49 Ca 0.29 -0.33 0.01 0.00 0.36 0.00 0.00 54.97 55.29 1mm5 s GLU 49 Cb -0.13 -1.41 0.16 0.00 0.26 0.00 0.00 34.13 33.01 1mm5 s GLU 49 CO 0.19 -0.08 0.41 1.03 -0.54 0.00 0.00 175.26 176.27 1mm5 s ARG 50 N 1.04 2.39 0.99 4.30 1.81 -1.26 -5.10 118.95 123.12 1mm5 s ARG 50 Ca -0.08 -2.72 -0.12 0.00 -1.72 0.00 0.00 55.73 51.09 1mm5 s ARG 50 Cb -0.15 -3.56 0.18 0.00 -0.45 0.00 0.00 34.95 30.97 1mm5 s ARG 50 CO -0.01 -1.17 1.09 -1.25 -0.68 0.00 0.00 175.30 173.29 1mm5 s PRO 51 N -0.42 0.53 -0.02 3.54 0.04 -1.26 -5.05 135.00 132.36 1mm5 s PRO 51 Ca 0.19 0.59 -0.01 0.00 0.04 0.00 0.00 61.00 61.81 1mm5 s PRO 51 Cb -0.20 -1.74 -0.04 0.00 0.04 0.00 0.00 34.50 32.56 1mm5 s PRO 51 CO -0.04 -2.68 0.07 -1.58 0.04 0.00 0.00 177.00 172.81 1mm5 s TRP 52 N -2.94 3.28 0.00 0.56 0.52 -1.26 -5.08 118.94 114.02 1mm5 s TRP 52 Ca 0.65 0.22 0.00 0.00 0.02 0.00 0.00 56.10 56.99 1mm5 s TRP 52 Cb -0.19 -1.76 0.00 0.00 -1.15 0.00 0.00 33.47 30.38 1mm5 s TRP 52 CO 0.58 0.55 0.00 0.41 0.02 0.00 0.00 176.95 178.51 1mm5 n GLY 53 N 1.37 2.78 3.07 0.98 0.00 -1.26 -3.32 105.19 108.81 1mm5 n GLY 53 Ca -0.14 -0.77 -0.10 0.00 0.00 0.00 0.00 46.02 45.00 1mm5 n GLY 53 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mm5 s GLY 54 N 0.00 0.12 -0.08 -0.02 0.00 -1.08 -5.00 107.32 101.27 1mm5 s GLY 54 Ca 0.00 -0.33 0.02 0.00 0.00 0.00 0.00 44.72 44.41 1mm5 s GLY 54 CO 0.00 -0.44 -0.13 -0.32 0.00 0.00 0.00 173.10 172.21 1mm5 s GLY 55 N -1.48 1.56 -0.20 0.20 0.00 0.09 -2.54 107.32 104.94 1mm5 s GLY 55 Ca -0.14 -0.93 -0.06 0.00 0.00 0.00 0.00 44.72 43.58 1mm5 s GLY 55 CO 0.00 -0.52 0.42 -1.36 0.00 0.00 0.00 173.10 171.64 1mm5 s PHE 56 N -0.30 -0.81 0.44 1.90 0.40 0.48 -0.42 117.98 119.67 1mm5 s PHE 56 Ca 0.03 1.47 0.03 0.00 -0.60 0.00 0.00 56.93 57.85 1mm5 s PHE 56 Cb -0.13 0.28 -0.02 0.00 0.51 0.00 0.00 43.02 43.66 1mm5 s PHE 56 CO 0.03 -0.50 0.08 0.20 0.70 0.00 0.00 175.22 175.73 1mm5 s GLY 57 N 2.61 2.76 -0.01 4.36 0.00 0.41 -0.41 107.32 117.03 1mm5 s GLY 57 Ca -0.00 -0.95 0.06 0.00 0.00 0.00 0.00 44.72 43.83 1mm5 s GLY 57 CO -0.13 -1.96 -0.20 -2.27 0.00 0.00 0.00 173.10 168.54 1mm5 s LEU 58 N -3.70 2.43 0.31 0.66 0.20 -1.07 -1.85 118.68 115.65 1mm5 s LEU 58 Ca 0.18 -0.38 -0.07 0.00 0.69 0.00 0.00 54.13 54.55 1mm5 s LEU 58 Cb 0.02 -1.45 -0.06 0.00 -0.43 0.00 0.00 46.19 44.27 1mm5 s LEU 58 CO 0.11 0.31 0.61 -0.55 -0.29 0.00 0.00 176.35 176.54 1mm5 s SER 59 N -0.90 6.50 -0.30 3.68 0.15 -1.26 -2.54 113.70 119.03 1mm5 s SER 59 Ca 0.12 0.87 -0.10 0.00 0.70 0.00 0.00 55.95 57.54 1mm5 s SER 59 Cb -0.10 -2.21 0.19 0.00 -1.71 0.00 0.00 66.02 62.18 1mm5 s SER 59 CO 0.01 -0.23 1.02 -0.60 1.20 0.00 0.00 173.24 174.64 1mm5 s ARG 60 N -3.49 0.17 0.32 5.44 3.52 0.47 -4.87 118.95 120.50 1mm5 s ARG 60 Ca 0.47 0.17 0.06 0.00 -0.13 0.00 0.00 55.73 56.29 1mm5 s ARG 60 Cb -0.11 0.08 -0.01 0.00 -1.56 0.00 0.00 34.95 33.35 1mm5 s ARG 60 CO 0.28 -0.31 0.45 1.67 -0.81 0.00 0.00 175.30 176.58 1mm5 s TRP 61 N 2.95 3.19 0.14 5.12 -2.14 -1.26 -0.80 118.94 126.15 1mm5 s TRP 61 Ca 0.26 -0.16 0.07 0.00 2.66 0.00 0.00 56.10 58.93 1mm5 s TRP 61 Cb -0.02 -1.91 -0.04 0.00 -3.10 0.00 0.00 33.47 28.40 1mm5 s TRP 61 CO -0.23 0.08 -0.02 0.34 -2.66 0.00 0.00 176.95 174.47 1mm5 s ASP 62 N -4.13 4.78 0.66 -2.66 3.68 0.46 -4.92 116.67 114.53 1mm5 s ASP 62 Ca 0.43 -0.33 0.35 0.00 2.13 0.00 0.00 52.55 55.12 1mm5 s ASP 62 Cb -0.09 -1.04 1.91 0.00 -1.45 0.00 0.00 42.92 42.24 1mm5 s ASP 62 CO 0.31 0.13 2.09 -0.33 0.13 0.00 0.00 175.17 177.50 1mm5 h GLU 63 N 3.04 0.00 -1.24 4.34 4.39 -2.00 -1.26 114.58 121.85 1mm5 h GLU 63 Ca -0.48 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 58.91 1mm5 h GLU 63 Cb 1.19 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 29.68 1mm5 h GLU 63 CO 0.57 0.00 0.40 1.63 -1.16 0.00 0.00 179.01 180.45 1mm5 n LYS 64 N -3.07 1.76 -3.56 2.33 4.76 -1.26 -4.85 118.16 114.28 1mm5 n LYS 64 Ca -0.02 -1.63 -0.21 0.00 -2.87 0.00 0.00 58.31 53.58 1mm5 n LYS 64 Cb 0.28 -1.64 0.05 0.00 -1.84 0.00 0.00 35.03 31.88 1mm5 n LYS 64 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1mm5 n GLY 65 N -0.05 -0.59 3.32 0.72 0.00 -0.50 -5.01 105.19 103.09 1mm5 n GLY 65 Ca 0.32 0.26 -0.28 0.00 0.00 0.00 0.00 46.02 46.32 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 -4.03 2.96 -0.24 1.61 -0.87 -1.09 -4.80 114.94 108.49 1mm5 s ASN 66 Ca 0.17 -0.61 0.01 0.00 -1.57 0.00 0.00 52.86 50.86 1mm5 s ASN 66 Cb -0.04 -0.24 0.04 0.00 -0.02 0.00 0.00 41.25 40.99 1mm5 s ASN 66 CO 0.79 0.20 -0.12 0.26 -2.57 0.00 0.00 177.10 175.67 1mm5 s TRP 67 N -0.87 3.11 0.09 2.20 0.52 -1.06 -0.41 118.94 122.52 1mm5 s TRP 67 Ca 0.11 -1.99 0.03 0.00 0.02 0.00 0.00 56.10 54.27 1mm5 s TRP 67 Cb -0.10 -1.96 -0.04 0.00 -1.15 0.00 0.00 33.47 30.22 1mm5 s TRP 67 CO 0.03 -0.83 -0.09 -1.58 0.02 0.00 0.00 176.95 174.50 1mm5 s HIS 68 N 1.20 0.98 -0.10 -1.98 2.46 0.02 -2.12 115.29 115.75 1mm5 s HIS 68 Ca -0.04 -0.70 -0.33 0.00 0.47 0.00 0.00 55.06 54.46 1mm5 s HIS 68 Cb -0.18 -0.54 0.15 0.00 -0.13 0.00 0.00 32.58 31.87 1mm5 s HIS 68 CO -0.07 -0.04 1.41 0.20 -2.47 0.00 0.00 174.74 173.77 1mm5 s GLY 69 N -2.52 -0.46 0.35 1.59 0.00 -1.07 -0.40 107.32 104.81 1mm5 s GLY 69 Ca 0.06 1.01 0.07 0.00 0.00 0.00 0.00 44.72 45.86 1mm5 s GLY 69 CO -0.01 0.21 0.37 1.08 0.00 0.00 0.00 173.10 174.75 1mm5 s LEU 70 N -2.90 3.68 -0.13 0.66 1.02 -1.05 -0.84 118.68 119.12 1mm5 s LEU 70 Ca 0.14 -0.43 -0.00 0.00 0.02 0.00 0.00 54.13 53.86 1mm5 s LEU 70 Cb 0.07 -2.38 0.03 0.00 0.02 0.00 0.00 46.19 43.93 1mm5 s LEU 70 CO -0.06 -0.44 -0.07 -0.31 0.02 0.00 0.00 176.35 175.49 1mm5 s TYR 71 N -2.29 1.54 -0.35 0.29 1.51 -1.07 -2.60 117.35 114.39 1mm5 s TYR 71 Ca 0.44 -0.83 -0.07 0.00 -1.01 0.00 0.00 57.07 55.60 1mm5 s TYR 71 Cb -0.07 -1.26 0.04 0.00 -0.11 0.00 0.00 41.96 40.57 1mm5 s TYR 71 CO 0.28 -0.54 0.13 0.00 -1.11 0.00 0.00 175.55 174.31 1mm5 s ALA 72 N 1.69 3.09 0.04 3.71 0.00 0.45 -2.60 121.76 128.13 1mm5 s ALA 72 Ca 0.04 -1.76 0.08 0.00 0.00 0.00 0.00 51.96 50.32 1mm5 s ALA 72 Cb -0.13 -2.33 -0.03 0.00 0.00 0.00 0.00 23.12 20.62 1mm5 s ALA 72 CO -0.08 -1.36 -0.22 1.41 0.00 0.00 0.00 175.76 175.51 1mm5 s MET 73 N 1.43 1.97 -0.05 0.00 1.75 -1.07 -0.39 119.30 122.93 1mm5 s MET 73 Ca -0.01 -1.03 0.01 0.00 -1.25 0.00 0.00 55.69 53.42 1mm5 s MET 73 Cb -0.20 -2.09 0.02 0.00 2.84 0.00 0.00 34.83 35.40 1mm5 s MET 73 CO 0.03 0.53 -0.06 0.00 -0.65 0.00 0.00 175.02 174.87 1mm5 s ALA 74 N -0.84 0.81 -0.24 4.11 0.00 -1.05 -1.37 121.76 123.17 1mm5 s ALA 74 Ca 0.13 -0.14 0.02 0.00 0.00 0.00 0.00 51.96 51.97 1mm5 s ALA 74 Cb -0.10 -0.45 0.05 0.00 0.00 0.00 0.00 23.12 22.62 1mm5 s ALA 74 CO 0.03 0.03 -0.12 0.12 0.00 0.00 0.00 175.76 175.82 1mm5 s PHE 75 N 0.83 3.13 -0.39 0.00 2.19 -1.07 -2.62 117.98 120.05 1mm5 s PHE 75 Ca -0.12 -2.05 -0.14 0.00 0.33 0.00 0.00 56.93 54.95 1mm5 s PHE 75 Cb -0.15 -1.96 0.01 0.00 -1.31 0.00 0.00 43.02 39.62 1mm5 s PHE 75 CO 0.01 -0.84 0.29 0.15 1.83 0.00 0.00 175.22 176.66 1mm5 s LYS 76 N 1.18 3.13 0.89 10.12 1.02 -1.21 -1.39 119.74 133.48 1mm5 s LYS 76 Ca -0.04 -0.90 -0.15 0.00 0.02 0.00 0.00 55.97 54.90 1mm5 s LYS 76 Cb -0.18 -3.93 0.22 0.00 -0.52 0.00 0.00 37.83 33.42 1mm5 s LYS 76 CO -0.07 -0.67 0.79 -3.47 -0.92 0.00 0.00 175.35 171.02 1mm5 n ASP 77 N 5.16 -1.79 0.14 2.83 2.03 -1.25 -4.40 116.55 119.28 1mm5 n ASP 77 Ca -0.11 -0.98 0.11 0.00 0.52 0.00 0.00 54.79 54.32 1mm5 n ASP 77 Cb 0.48 -0.72 0.05 0.00 -0.72 0.00 0.00 41.12 40.21 1mm5 n ASP 77 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1mm5 h SER 78 N -2.24 0.00 -0.00 1.67 0.02 -1.98 -3.39 113.55 107.63 1mm5 h SER 78 Ca -0.30 0.00 -0.14 0.00 -0.84 0.00 0.00 61.79 60.52 1mm5 h SER 78 Cb 0.91 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.28 1mm5 h SER 78 CO 0.19 0.03 -0.40 0.79 -1.14 0.00 0.00 176.83 176.30 1mm5 n TRP 79 N -2.84 -0.01 -3.37 3.45 8.01 -1.26 -5.13 117.44 116.29 1mm5 n TRP 79 Ca 0.01 -0.51 0.00 0.00 -1.31 0.00 0.00 57.50 55.69 1mm5 n TRP 79 Cb 0.56 0.41 0.00 0.00 -2.01 0.00 0.00 31.31 30.27 1mm5 n TRP 79 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.69 174.97 1mm5 n ASN 80 N 0.06 1.02 -4.97 -0.99 4.05 -1.26 -5.17 115.26 108.00 1mm5 n ASN 80 Ca -0.23 -0.37 -0.20 0.00 0.45 0.00 0.00 54.58 54.24 1mm5 n ASN 80 Cb 0.77 0.00 0.06 0.00 1.23 0.00 0.00 39.78 41.84 1mm5 n ASN 80 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 177.26 173.67 1mm5 s LYS 81 N -0.10 2.29 0.42 1.20 1.02 -1.26 -4.54 119.74 118.78 1mm5 s LYS 81 Ca 0.00 -1.47 -0.18 0.00 0.02 0.00 0.00 55.97 54.34 1mm5 s LYS 81 Cb 0.00 -2.61 -0.09 0.00 -0.52 0.00 0.00 37.83 34.60 1mm5 s LYS 81 CO 0.00 -0.86 0.88 1.67 -0.92 0.00 0.00 175.35 176.13 1mm5 s TRP 82 N -2.70 3.37 -0.41 3.18 -2.14 -1.26 -3.92 118.94 115.06 1mm5 s TRP 82 Ca 0.61 1.43 -0.01 0.00 2.66 0.00 0.00 56.10 60.79 1mm5 s TRP 82 Cb -0.06 -2.72 0.11 0.00 -3.10 0.00 0.00 33.47 27.70 1mm5 s TRP 82 CO 0.39 -0.10 0.19 -1.21 -2.66 0.00 0.00 176.95 173.55 1mm5 s GLU 83 N -3.35 1.92 0.49 3.25 2.02 -0.49 -4.87 118.70 117.66 1mm5 s GLU 83 Ca 0.58 -1.91 -0.20 0.00 0.02 0.00 0.00 54.97 53.46 1mm5 s GLU 83 Cb -0.10 -3.50 -0.08 0.00 0.10 0.00 0.00 34.13 30.55 1mm5 s GLU 83 CO 0.19 -1.05 1.03 -1.25 0.02 0.00 0.00 175.26 174.20 1mm5 s PRO 84 N 0.95 3.80 -0.05 0.39 0.04 -1.26 -2.60 135.00 136.26 1mm5 s PRO 84 Ca 0.10 1.33 -0.05 0.00 0.04 0.00 0.00 61.00 62.42 1mm5 s PRO 84 Cb -0.22 -2.10 0.02 0.00 0.04 0.00 0.00 34.50 32.24 1mm5 s PRO 84 CO -0.05 -0.43 0.14 0.42 0.04 0.00 0.00 177.00 177.13 1mm5 s ILE 85 N -2.04 -0.00 -0.08 0.56 1.01 -0.47 -2.61 121.20 117.57 1mm5 s ILE 85 Ca 0.67 0.01 -0.02 0.00 0.00 0.00 0.00 60.65 61.31 1mm5 s ILE 85 Cb -0.16 -0.21 0.04 0.00 0.01 0.00 0.00 42.46 42.14 1mm5 s ILE 85 CO 0.21 0.01 0.05 0.00 0.00 0.00 0.00 174.94 175.20 1mm5 s ALA 86 N 0.16 0.45 0.02 9.38 0.00 -1.07 -2.60 121.76 128.10 1mm5 s ALA 86 Ca -0.01 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1mm5 s ALA 86 Cb -0.02 -0.76 -0.00 0.00 0.00 0.00 0.00 23.12 22.34 1mm5 s ALA 86 CO -0.00 -0.63 0.01 0.41 0.00 0.00 0.00 175.76 175.54 1mm5 n GLY 87 N 5.23 4.07 2.95 0.00 0.00 -1.07 -1.80 105.19 114.57 1mm5 n GLY 87 Ca -0.05 -1.92 -0.14 0.00 0.00 0.00 0.00 46.02 43.91 1mm5 n GLY 87 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mm5 s TYR 88 N -1.62 -0.32 0.05 1.61 1.51 0.45 -2.60 117.35 116.44 1mm5 s TYR 88 Ca 0.01 0.80 0.02 0.00 -1.01 0.00 0.00 57.07 56.90 1mm5 s TYR 88 Cb 0.00 -0.10 -0.04 0.00 -0.11 0.00 0.00 41.96 41.71 1mm5 s TYR 88 CO 0.01 -0.30 0.05 0.20 -1.11 0.00 0.00 175.55 174.40 1mm5 s GLY 89 N 2.16 1.98 -0.11 0.71 0.00 -0.02 -2.60 107.32 109.44 1mm5 s GLY 89 Ca -0.00 -0.99 -0.04 0.00 0.00 0.00 0.00 44.72 43.69 1mm5 s GLY 89 CO -0.07 -0.92 0.23 0.66 0.00 0.00 0.00 173.10 172.99 1mm5 s TRP 90 N -1.28 -0.34 0.21 1.90 1.48 -1.07 -2.60 118.94 117.24 1mm5 s TRP 90 Ca 0.26 0.84 -0.11 0.00 -1.06 0.00 0.00 56.10 56.03 1mm5 s TRP 90 Cb -0.12 -0.09 -0.01 0.00 -1.16 0.00 0.00 33.47 32.09 1mm5 s TRP 90 CO 0.18 -0.31 0.38 -1.83 -4.06 0.00 0.00 176.95 171.30 1mm5 s GLU 91 N 2.22 1.36 -0.29 3.25 -1.05 -0.90 -1.14 118.70 122.15 1mm5 s GLU 91 Ca 0.00 -1.22 0.03 0.00 -0.15 0.00 0.00 54.97 53.63 1mm5 s GLU 91 Cb -0.12 0.42 0.08 0.00 -0.44 0.00 0.00 34.13 34.07 1mm5 s GLU 91 CO -0.08 -0.54 -0.03 -1.12 0.95 0.00 0.00 175.26 174.44 1mm5 s SER 92 N -3.00 4.46 -0.18 0.83 0.01 -1.06 -2.57 113.70 112.18 1mm5 s SER 92 Ca 0.21 -1.66 -0.05 0.00 1.31 0.00 0.00 55.95 55.76 1mm5 s SER 92 Cb 0.01 -1.49 -0.03 0.00 0.21 0.00 0.00 66.02 64.72 1mm5 s SER 92 CO 0.05 -0.28 0.01 0.42 0.41 0.00 0.00 173.24 173.85 1mm5 s THR 93 N 1.10 4.19 0.19 1.44 -4.23 -1.26 -2.59 115.64 114.48 1mm5 s THR 93 Ca -0.00 -0.24 0.05 0.00 -1.18 0.00 0.00 61.69 60.32 1mm5 s THR 93 Cb -0.19 -2.88 -0.05 0.00 1.34 0.00 0.00 72.50 70.72 1mm5 s THR 93 CO -0.07 0.45 -0.09 0.86 -0.54 0.00 0.00 174.62 175.23 1mm5 s TRP 94 N 0.67 1.52 0.20 3.99 -0.00 -0.69 -4.94 118.94 119.68 1mm5 s TRP 94 Ca 0.00 -0.74 0.10 0.00 -0.00 0.00 0.00 56.10 55.46 1mm5 s TRP 94 Cb -0.14 -0.79 -0.04 0.00 -0.00 0.00 0.00 33.47 32.50 1mm5 s TRP 94 CO 0.02 0.15 -0.13 -0.98 -0.00 0.00 0.00 176.95 176.01 1mm5 s ARG 95 N -3.74 1.91 1.16 5.86 3.03 -1.26 -2.36 118.95 123.55 1mm5 s ARG 95 Ca 0.22 -1.38 -0.17 0.00 2.03 0.00 0.00 55.73 56.43 1mm5 s ARG 95 Cb 0.02 -2.05 0.26 0.00 -1.03 0.00 0.00 34.95 32.16 1mm5 s ARG 95 CO 0.05 0.41 1.10 -1.25 -1.13 0.00 0.00 175.30 174.48 1mm5 s PRO 96 N -2.90 -0.86 0.50 3.89 0.04 -1.26 -4.86 135.00 129.55 1mm5 s PRO 96 Ca 0.25 0.11 0.14 0.00 0.04 0.00 0.00 61.00 61.53 1mm5 s PRO 96 Cb -0.08 -1.62 1.19 0.00 0.04 0.00 0.00 34.50 34.02 1mm5 s PRO 96 CO 0.14 -3.51 2.13 -0.07 0.04 0.00 0.00 177.00 175.74 1mm5 h LEU 97 N -2.44 0.09 -1.89 -3.56 4.07 -2.01 -1.30 115.31 108.27 1mm5 h LEU 97 Ca -0.48 -0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.49 1mm5 h LEU 97 Cb 1.31 -0.02 -0.01 0.00 1.08 0.00 0.00 40.66 43.02 1mm5 h LEU 97 CO 0.41 0.07 0.10 0.00 -1.08 0.00 0.00 178.44 177.94 1mm5 h ALA 98 N 1.95 1.96 -4.95 1.53 0.00 -2.02 -3.47 119.26 114.26 1mm5 h ALA 98 Ca 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.94 1mm5 h ALA 98 Cb -0.01 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 17.66 1mm5 h ALA 98 CO -0.01 0.02 -1.33 -0.25 0.00 0.00 0.00 179.25 177.68 1mm5 n ASP 99 N -4.51 -3.11 -2.67 0.00 8.00 -0.49 -5.08 116.55 108.69 1mm5 n ASP 99 Ca -0.00 1.33 -0.12 0.00 0.71 0.00 0.00 54.79 56.71 1mm5 n ASP 99 Cb 0.12 -5.13 -0.02 0.00 -0.02 0.00 0.00 41.12 36.08 1mm5 n ASP 99 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1mm5 n GLU 100 N 1.28 0.65 0.07 -1.24 1.02 -1.26 -5.03 120.64 116.12 1mm5 n GLU 100 Ca -0.26 -2.30 0.04 0.00 -0.02 0.00 0.00 57.16 54.62 1mm5 n GLU 100 Cb 0.40 2.29 0.46 0.00 -0.02 0.00 0.00 31.44 34.58 1mm5 n GLU 100 CO 0.00 0.00 0.00 -2.95 1.18 0.00 0.00 177.13 175.36 1mm5 h ASN 101 N 1.67 0.35 -2.63 1.62 -1.07 -1.96 -3.42 115.58 110.14 1mm5 h ASN 101 Ca -0.24 -0.02 -0.53 0.00 0.07 0.00 0.00 56.30 55.59 1mm5 h ASN 101 Cb 1.01 -0.09 0.04 0.00 -2.07 0.00 0.00 38.32 37.22 1mm5 h ASN 101 CO 0.32 0.28 1.04 0.12 0.07 0.00 0.00 177.43 179.26 1mm5 s PHE 102 N -5.32 2.51 -0.03 4.14 2.19 -1.26 -3.00 117.98 117.22 1mm5 s PHE 102 Ca -0.07 0.21 -0.05 0.00 0.33 0.00 0.00 56.93 57.34 1mm5 s PHE 102 Cb 0.17 -4.10 0.01 0.00 -1.31 0.00 0.00 43.02 37.78 1mm5 s PHE 102 CO 0.72 -4.38 0.13 -3.38 1.83 0.00 0.00 175.22 170.13 1mm5 s HIS 103 N 2.09 -0.05 -0.00 10.12 -3.43 -0.75 -4.64 115.29 118.62 1mm5 s HIS 103 Ca 0.77 0.13 0.02 0.00 -0.80 0.00 0.00 55.06 55.18 1mm5 s HIS 103 Cb -0.46 -0.00 -0.01 0.00 -1.43 0.00 0.00 32.58 30.68 1mm5 s HIS 103 CO 0.34 -0.16 -0.08 -1.17 -2.00 0.00 0.00 174.74 171.67 1mm5 s LEU 104 N -0.55 2.02 0.32 5.38 0.20 -0.99 -2.49 118.68 122.57 1mm5 s LEU 104 Ca -0.06 -0.16 -0.15 0.00 0.69 0.00 0.00 54.13 54.45 1mm5 s LEU 104 Cb -0.04 -0.41 0.03 0.00 -0.43 0.00 0.00 46.19 45.34 1mm5 s LEU 104 CO 0.01 0.09 0.67 -0.83 -0.29 0.00 0.00 176.35 175.99 1mm5 s GLY 105 N -0.23 0.40 -0.07 7.98 0.00 0.07 -1.71 107.32 113.75 1mm5 s GLY 105 Ca 0.03 -0.73 -0.06 0.00 0.00 0.00 0.00 44.72 43.96 1mm5 s GLY 105 CO -0.00 -0.39 0.18 1.08 0.00 0.00 0.00 173.10 173.97 1mm5 s LEU 106 N -3.03 1.20 0.00 0.66 1.43 -1.07 -2.50 118.68 115.38 1mm5 s LEU 106 Ca 0.17 0.37 0.00 0.00 -1.03 0.00 0.00 54.13 53.64 1mm5 s LEU 106 Cb -0.04 0.60 0.00 0.00 0.03 0.00 0.00 46.19 46.78 1mm5 s LEU 106 CO 0.11 -0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.22 1mm5 n GLY 107 N 3.17 2.67 2.86 -3.19 0.00 -0.87 -2.56 105.19 107.27 1mm5 n GLY 107 Ca -0.15 -0.69 -0.23 0.00 0.00 0.00 0.00 46.02 44.95 1mm5 n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mm5 s PHE 108 N -2.60 0.97 -0.43 1.61 0.40 -0.29 -2.61 117.98 115.02 1mm5 s PHE 108 Ca 0.00 -0.36 -0.17 0.00 -0.60 0.00 0.00 56.93 55.81 1mm5 s PHE 108 Cb 0.00 -0.90 0.03 0.00 0.51 0.00 0.00 43.02 42.66 1mm5 s PHE 108 CO 0.00 -0.33 0.41 0.99 0.70 0.00 0.00 175.22 176.99 1mm5 s THR 109 N 1.50 5.13 0.33 0.64 2.01 -0.04 -2.59 115.64 122.62 1mm5 s THR 109 Ca -0.01 -0.51 0.09 0.00 0.31 0.00 0.00 61.69 61.57 1mm5 s THR 109 Cb -0.13 -4.04 -0.05 0.00 0.01 0.00 0.00 72.50 68.29 1mm5 s THR 109 CO -0.04 -0.44 0.01 0.00 -0.69 0.00 0.00 174.62 173.46 1mm5 s ALA 110 N 2.00 3.20 -0.14 7.40 0.00 -1.07 -2.22 121.76 130.93 1mm5 s ALA 110 Ca 0.10 -1.92 -0.34 0.00 0.00 0.00 0.00 51.96 49.79 1mm5 s ALA 110 Cb -0.18 -0.42 0.15 0.00 0.00 0.00 0.00 23.12 22.66 1mm5 s ALA 110 CO 0.12 0.09 1.39 0.20 0.00 0.00 0.00 175.76 177.56 1mm5 s GLY 111 N -3.71 -0.40 0.35 0.00 0.00 -0.71 -0.41 107.32 102.45 1mm5 s GLY 111 Ca 0.34 1.21 0.09 0.00 0.00 0.00 0.00 44.72 46.37 1mm5 s GLY 111 CO 0.19 0.31 -0.07 -1.34 0.00 0.00 0.00 173.10 172.19 1mm5 s VAL 112 N -2.11 2.22 0.10 1.40 -7.23 -0.74 -0.43 120.40 113.61 1mm5 s VAL 112 Ca 0.14 -2.16 0.10 0.00 -1.81 0.00 0.00 61.98 58.24 1mm5 s VAL 112 Cb 0.04 -2.71 -0.03 0.00 0.56 0.00 0.00 36.38 34.24 1mm5 s VAL 112 CO -0.05 -0.17 -0.25 0.42 -0.31 0.00 0.00 175.10 174.74 1mm5 s THR 113 N -2.62 2.02 -0.03 5.32 -4.23 -0.83 -2.60 115.64 112.68 1mm5 s THR 113 Ca 0.33 -1.57 -0.30 0.00 -1.18 0.00 0.00 61.69 58.97 1mm5 s THR 113 Cb 0.03 -1.79 -0.06 0.00 1.34 0.00 0.00 72.50 72.03 1mm5 s THR 113 CO 0.17 0.11 1.57 0.00 -0.54 0.00 0.00 174.62 175.93 1mm5 s ALA 114 N -1.01 3.63 -0.05 3.99 0.00 -1.07 -2.61 121.76 124.63 1mm5 s ALA 114 Ca 0.11 0.93 -0.28 0.00 0.00 0.00 0.00 51.96 52.73 1mm5 s ALA 114 Cb -0.10 -3.70 0.06 0.00 0.00 0.00 0.00 23.12 19.38 1mm5 s ALA 114 CO 0.04 -1.23 0.60 1.03 0.00 0.00 0.00 175.76 176.21 1mm5 s ARG 115 N 3.43 0.97 -0.07 0.00 1.81 -1.26 -4.94 118.95 118.89 1mm5 s ARG 115 Ca 0.70 0.18 -0.01 0.00 -1.72 0.00 0.00 55.73 54.88 1mm5 s ARG 115 Cb -0.33 0.46 -0.03 0.00 -0.45 0.00 0.00 34.95 34.59 1mm5 s ARG 115 CO 0.28 -0.29 -0.01 -0.51 -0.68 0.00 0.00 175.30 174.09 1mm5 s ASP 116 N -1.18 5.14 0.35 0.23 1.11 -1.26 -4.43 116.67 116.62 1mm5 s ASP 116 Ca -0.11 0.10 0.00 0.00 0.18 0.00 0.00 52.55 52.71 1mm5 s ASP 116 Cb -0.01 -1.41 0.00 0.00 1.07 0.00 0.00 42.92 42.57 1mm5 s ASP 116 CO 0.09 0.36 0.00 -3.20 1.18 0.00 0.00 175.17 173.60 1mm5 n ASN 117 N 2.02 -1.79 0.00 0.27 2.85 -1.26 -5.03 115.26 112.32 1mm5 n ASN 117 Ca -0.18 0.63 0.00 0.00 -0.11 0.00 0.00 54.58 54.93 1mm5 n ASN 117 Cb 0.53 1.80 0.00 0.00 1.24 0.00 0.00 39.78 43.36 1mm5 n ASN 117 CO 0.00 0.00 0.00 1.87 -2.11 0.00 0.00 177.26 177.02 1mm5 n TRP 118 N -3.41 0.00 0.00 1.20 -0.00 -1.26 -5.04 117.44 108.93 1mm5 n TRP 118 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1mm5 n TRP 118 Cb 0.00 0.03 0.00 0.00 -0.00 0.00 0.00 31.31 31.34 1mm5 n TRP 118 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 177.69 177.96 1mm5 n ASN 119 N -2.72 0.00 -2.72 5.87 0.23 -1.26 -5.02 115.26 109.64 1mm5 n ASN 119 Ca 0.00 0.00 -0.08 0.00 -0.53 0.00 0.00 54.58 53.97 1mm5 n ASN 119 Cb 0.45 0.09 0.10 0.00 -2.08 0.00 0.00 39.78 38.34 1mm5 n ASN 119 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1mm5 n TYR 120 N -1.47 -2.59 -3.47 -2.53 4.19 -1.26 -5.05 117.16 104.98 1mm5 n TYR 120 Ca 0.00 -1.97 -0.43 0.00 3.31 0.00 0.00 57.90 58.81 1mm5 n TYR 120 Cb 0.00 1.60 -0.05 0.00 0.49 0.00 0.00 39.34 41.38 1mm5 n TYR 120 CO 0.00 0.00 0.00 0.42 0.91 0.00 0.00 176.86 178.19 1mm5 s ILE 121 N 0.23 4.82 0.82 2.97 1.01 -1.26 -5.07 121.20 124.72 1mm5 s ILE 121 Ca 0.22 -2.39 -0.11 0.00 0.00 0.00 0.00 60.65 58.37 1mm5 s ILE 121 Cb 0.32 -4.06 0.08 0.00 0.01 0.00 0.00 42.46 38.82 1mm5 s ILE 121 CO -0.07 -0.93 1.09 -2.16 0.00 0.00 0.00 174.94 172.87 1mm5 s PRO 122 N 0.46 1.89 -0.61 2.79 0.04 -1.26 -4.68 135.00 133.62 1mm5 s PRO 122 Ca 0.14 0.90 -0.13 0.00 0.04 0.00 0.00 61.00 61.95 1mm5 s PRO 122 Cb -0.18 -1.87 0.15 0.00 0.04 0.00 0.00 34.50 32.64 1mm5 s PRO 122 CO -0.05 -1.83 0.54 -1.17 0.04 0.00 0.00 177.00 174.53 1mm5 s LEU 123 N -5.98 6.19 0.47 -3.56 2.96 -1.07 -4.91 118.68 112.79 1mm5 s LEU 123 Ca 0.62 -2.12 -0.22 0.00 -0.22 0.00 0.00 54.13 52.19 1mm5 s LEU 123 Cb -0.17 -2.15 -0.07 0.00 0.50 0.00 0.00 46.19 44.30 1mm5 s LEU 123 CO 0.56 -0.72 1.16 -2.16 -1.32 0.00 0.00 176.35 173.86 1mm5 s PRO 124 N 1.07 3.69 -0.16 0.98 0.04 -1.26 -1.96 135.00 137.41 1mm5 s PRO 124 Ca 0.08 1.74 -0.07 0.00 0.04 0.00 0.00 61.00 62.79 1mm5 s PRO 124 Cb -0.23 -2.34 0.07 0.00 0.04 0.00 0.00 34.50 32.03 1mm5 s PRO 124 CO -0.01 -0.60 0.36 0.08 0.04 0.00 0.00 177.00 176.87 1mm5 s VAL 125 N -1.59 -0.24 -0.13 -0.36 1.01 0.43 -4.95 120.40 114.57 1mm5 s VAL 125 Ca 0.65 0.15 -0.07 0.00 0.00 0.00 0.00 61.98 62.72 1mm5 s VAL 125 Cb -0.28 -0.55 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 1mm5 s VAL 125 CO 0.33 0.06 0.11 -0.76 0.00 0.00 0.00 175.10 174.85 1mm5 s LEU 126 N 1.83 4.22 -0.19 3.92 1.02 -1.26 -1.73 118.68 126.48 1mm5 s LEU 126 Ca -0.06 0.37 -0.05 0.00 0.02 0.00 0.00 54.13 54.41 1mm5 s LEU 126 Cb -0.10 -2.03 0.09 0.00 0.02 0.00 0.00 46.19 44.17 1mm5 s LEU 126 CO -0.11 0.36 0.35 -0.22 0.02 0.00 0.00 176.35 176.74 1mm5 s LEU 127 N -0.71 -0.51 0.09 1.79 1.98 -0.94 -5.01 118.68 115.37 1mm5 s LEU 127 Ca 0.13 0.61 -0.31 0.00 -2.89 0.00 0.00 54.13 51.67 1mm5 s LEU 127 Cb -0.12 1.04 -0.08 0.00 0.66 0.00 0.00 46.19 47.70 1mm5 s LEU 127 CO 0.03 -0.26 1.43 -2.84 -1.89 0.00 0.00 176.35 172.82 1mm5 s PRO 128 N 2.52 4.29 0.09 0.98 0.02 -1.26 -0.87 135.00 140.78 1mm5 s PRO 128 Ca 0.03 2.10 -0.04 0.00 0.02 0.00 0.00 61.00 63.12 1mm5 s PRO 128 Cb -0.13 -3.35 -0.03 0.00 0.02 0.00 0.00 34.50 31.02 1mm5 s PRO 128 CO -0.12 -0.51 0.08 -0.51 -0.33 0.00 0.00 177.00 175.61 1mm5 s LEU 129 N 1.54 1.89 0.17 -5.54 1.02 -1.07 -2.60 118.68 114.07 1mm5 s LEU 129 Ca 0.66 -0.96 0.04 0.00 0.02 0.00 0.00 54.13 53.89 1mm5 s LEU 129 Cb -0.37 0.53 -0.05 0.00 0.02 0.00 0.00 46.19 46.33 1mm5 s LEU 129 CO 0.30 -0.70 -0.08 0.00 0.02 0.00 0.00 176.35 175.89 1mm5 s ALA 130 N -3.95 1.56 -0.19 4.21 0.00 -0.78 -2.04 121.76 120.58 1mm5 s ALA 130 Ca 0.12 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.52 1mm5 s ALA 130 Cb 0.07 0.15 0.02 0.00 0.00 0.00 0.00 23.12 23.35 1mm5 s ALA 130 CO -0.06 -0.12 -0.17 -1.12 0.00 0.00 0.00 175.76 174.29 1mm5 s SER 131 N -3.21 3.36 -0.14 0.00 0.01 -1.04 -2.58 113.70 110.11 1mm5 s SER 131 Ca 0.20 -0.62 -0.04 0.00 1.31 0.00 0.00 55.95 56.80 1mm5 s SER 131 Cb 0.03 -1.53 0.07 0.00 0.21 0.00 0.00 66.02 64.80 1mm5 s SER 131 CO 0.03 -0.01 0.21 -0.69 0.41 0.00 0.00 173.24 173.19 1mm5 s VAL 132 N 1.32 -0.33 0.00 3.43 1.01 0.15 -0.76 120.40 125.22 1mm5 s VAL 132 Ca 0.05 0.14 0.00 0.00 0.00 0.00 0.00 61.98 62.17 1mm5 s VAL 132 Cb -0.13 -0.49 0.00 0.00 0.00 0.00 0.00 36.38 35.75 1mm5 s VAL 132 CO -0.11 -0.01 0.00 0.61 0.00 0.00 0.00 175.10 175.59 1mm5 n GLY 133 N 5.33 1.91 3.41 4.51 0.00 -1.04 -0.41 105.19 118.90 1mm5 n GLY 133 Ca -0.05 -0.32 0.01 0.00 0.00 0.00 0.00 46.02 45.66 1mm5 n GLY 133 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mm5 s TYR 134 N -0.94 -0.70 0.00 1.61 1.13 0.63 -1.81 117.35 117.28 1mm5 s TYR 134 Ca 0.00 1.21 0.00 0.00 -1.41 0.00 0.00 57.07 56.87 1mm5 s TYR 134 Cb 0.00 0.42 0.00 0.00 -1.10 0.00 0.00 41.96 41.28 1mm5 s TYR 134 CO 0.00 -0.35 0.00 0.41 -2.51 0.00 0.00 175.55 173.10 1mm5 n GLY 135 N 4.99 2.28 0.00 5.49 0.00 -1.16 -2.67 105.19 114.11 1mm5 n GLY 135 Ca -0.09 -0.39 0.08 0.00 0.00 0.00 0.00 46.02 45.62 1mm5 n GLY 135 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1mm5 n PRO 136 N 13.25 0.29 -3.83 1.61 -0.02 -1.26 -4.63 135.00 140.41 1mm5 n PRO 136 Ca 0.00 0.11 -0.36 0.00 -2.02 0.00 0.00 63.50 61.23 1mm5 n PRO 136 Cb 0.00 -1.50 -0.13 0.00 -0.02 0.00 0.00 33.50 31.85 1mm5 n PRO 136 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1mm5 s VAL 137 N -2.47 3.84 -0.25 -1.45 -7.23 -1.09 -4.20 120.40 107.55 1mm5 s VAL 137 Ca 0.17 -0.36 0.01 0.00 -1.81 0.00 0.00 61.98 59.99 1mm5 s VAL 137 Cb 0.11 -2.79 0.06 0.00 0.56 0.00 0.00 36.38 34.32 1mm5 s VAL 137 CO 0.24 0.36 -0.05 -0.89 -0.31 0.00 0.00 175.10 174.45 1mm5 s THR 138 N 1.54 1.60 -0.34 5.32 2.01 -1.02 -0.26 115.64 124.49 1mm5 s THR 138 Ca 0.06 -1.34 -0.12 0.00 0.31 0.00 0.00 61.69 60.60 1mm5 s THR 138 Cb -0.15 -1.89 -0.01 0.00 0.01 0.00 0.00 72.50 70.46 1mm5 s THR 138 CO 0.00 -0.15 0.22 0.12 -0.69 0.00 0.00 174.62 174.12 1mm5 s PHE 139 N 1.35 3.22 0.03 4.92 2.19 0.45 -1.67 117.98 128.47 1mm5 s PHE 139 Ca -0.04 -0.40 0.03 0.00 0.33 0.00 0.00 56.93 56.85 1mm5 s PHE 139 Cb -0.19 -2.45 -0.04 0.00 -1.31 0.00 0.00 43.02 39.03 1mm5 s PHE 139 CO -0.07 -0.43 -0.03 1.14 1.83 0.00 0.00 175.22 177.66 1mm5 s GLN 140 N 1.68 2.60 0.08 10.12 -2.07 -1.07 -0.68 119.66 130.32 1mm5 s GLN 140 Ca 0.05 -0.73 0.06 0.00 -1.82 0.00 0.00 55.36 52.92 1mm5 s GLN 140 Cb -0.18 -2.55 -0.04 0.00 -1.09 0.00 0.00 33.01 29.15 1mm5 s GLN 140 CO 0.09 0.59 -0.07 1.41 -1.32 0.00 0.00 175.29 175.99 1mm5 s MET 141 N -1.70 2.33 0.14 9.60 1.75 -1.06 -2.10 119.30 128.26 1mm5 s MET 141 Ca 0.20 -0.91 0.09 0.00 -1.25 0.00 0.00 55.69 53.82 1mm5 s MET 141 Cb -0.11 -2.41 -0.04 0.00 2.84 0.00 0.00 34.83 35.11 1mm5 s MET 141 CO 0.11 0.54 -0.22 0.99 -0.65 0.00 0.00 175.02 175.79 1mm5 s THR 142 N -1.19 1.94 -0.11 10.11 2.01 0.43 -1.86 115.64 126.96 1mm5 s THR 142 Ca 0.22 -1.76 0.01 0.00 0.31 0.00 0.00 61.69 60.46 1mm5 s THR 142 Cb -0.11 -1.80 0.02 0.00 0.01 0.00 0.00 72.50 70.62 1mm5 s THR 142 CO 0.14 -0.11 -0.11 -0.47 -0.69 0.00 0.00 174.62 173.38 1mm5 s TYR 143 N -1.46 1.70 -0.65 4.92 6.14 -1.07 -2.27 117.35 124.66 1mm5 s TYR 143 Ca 0.12 -0.83 -0.07 0.00 0.64 0.00 0.00 57.07 56.93 1mm5 s TYR 143 Cb -0.09 -1.31 0.17 0.00 0.42 0.00 0.00 41.96 41.15 1mm5 s TYR 143 CO 0.06 -0.50 0.51 0.42 0.64 0.00 0.00 175.55 176.68 1mm5 s ILE 144 N 1.37 4.27 0.46 3.14 1.09 -1.07 -4.44 121.20 126.02 1mm5 s ILE 144 Ca -0.00 -2.66 -0.21 0.00 -1.10 0.00 0.00 60.65 56.69 1mm5 s ILE 144 Cb -0.13 -3.74 -0.10 0.00 -1.06 0.00 0.00 42.46 37.43 1mm5 s ILE 144 CO -0.06 -0.90 1.00 -2.16 -0.10 0.00 0.00 174.94 172.72 1mm5 s PRO 145 N 0.21 4.00 -0.38 2.79 0.04 -1.26 -3.31 135.00 137.09 1mm5 s PRO 145 Ca 0.15 1.25 -0.02 0.00 0.04 0.00 0.00 61.00 62.42 1mm5 s PRO 145 Cb -0.18 -2.13 0.23 0.00 0.04 0.00 0.00 34.50 32.45 1mm5 s PRO 145 CO -0.05 -0.24 1.08 0.41 0.04 0.00 0.00 177.00 178.24 1mm5 n GLY 146 N -0.43 -1.40 5.13 0.56 0.00 -1.25 -4.79 105.19 103.02 1mm5 n GLY 146 Ca 0.08 0.97 0.00 0.00 0.00 0.00 0.00 46.02 47.08 1mm5 n GLY 146 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1mm5 n THR 147 N 2.18 0.00 0.04 2.61 -1.04 -1.26 -2.09 114.28 114.72 1mm5 n THR 147 Ca 0.09 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.10 1mm5 n THR 147 Cb 0.65 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.16 1mm5 n THR 147 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1mm5 n TYR 148 N 0.00 -1.92 -0.23 -1.42 9.36 -1.26 -4.90 117.16 116.79 1mm5 n TYR 148 Ca 0.00 0.25 -0.06 0.00 3.32 0.00 0.00 57.90 61.41 1mm5 n TYR 148 Cb 0.00 0.85 0.04 0.00 -0.63 0.00 0.00 39.34 39.61 1mm5 n TYR 148 CO 0.00 0.00 0.00 -0.91 0.22 0.00 0.00 176.86 176.17 1mm5 h ASN 149 N 0.00 0.79 -0.79 2.98 2.35 -2.04 -2.20 115.58 116.67 1mm5 h ASN 149 Ca 0.00 -0.06 -0.33 0.00 -0.55 0.00 0.00 56.30 55.35 1mm5 h ASN 149 Cb 0.00 -0.20 -0.20 0.00 0.05 0.00 0.00 38.32 37.97 1mm5 h ASN 149 CO 0.00 0.62 0.42 0.59 -1.65 0.00 0.00 177.43 177.42 1mm5 n ASN 150 N -4.57 4.13 -3.28 5.81 4.13 -1.17 -4.75 115.26 115.56 1mm5 n ASN 150 Ca 0.05 -3.27 -0.07 0.00 1.68 0.00 0.00 54.58 52.97 1mm5 n ASN 150 Cb 0.06 -0.77 -0.05 0.00 -1.54 0.00 0.00 39.78 37.48 1mm5 n ASN 150 CO 0.00 0.00 0.00 -0.83 0.28 0.00 0.00 177.26 176.71 1mm5 s GLY 151 N -0.96 -0.67 0.00 7.41 0.00 -0.83 -3.87 107.32 108.40 1mm5 s GLY 151 Ca 0.51 0.25 0.00 0.00 0.00 0.00 0.00 44.72 45.48 1mm5 s GLY 151 CO 0.11 3.15 0.00 1.16 0.00 0.00 0.00 173.10 177.52 1mm5 n ASN 152 N 5.24 0.00 -4.35 1.64 6.94 -1.21 -4.40 115.26 119.12 1mm5 n ASN 152 Ca 0.02 0.00 -0.24 0.00 -0.02 0.00 0.00 54.58 54.34 1mm5 n ASN 152 Cb 0.50 0.00 -0.12 0.00 -2.36 0.00 0.00 39.78 37.80 1mm5 n ASN 152 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1mm5 s VAL 153 N 0.00 1.98 -0.12 3.53 -7.23 -1.26 -4.92 120.40 112.37 1mm5 s VAL 153 Ca 0.00 -1.83 0.02 0.00 -1.81 0.00 0.00 61.98 58.36 1mm5 s VAL 153 Cb 0.00 -1.86 0.01 0.00 0.56 0.00 0.00 36.38 35.10 1mm5 s VAL 153 CO 0.00 -0.15 -0.17 -0.31 -0.31 0.00 0.00 175.10 174.16 1mm5 s TYR 154 N -1.60 2.19 -0.24 2.82 2.02 -1.26 -2.61 117.35 118.67 1mm5 s TYR 154 Ca 0.14 -1.06 -0.08 0.00 -0.37 0.00 0.00 57.07 55.70 1mm5 s TYR 154 Cb -0.08 -1.55 -0.04 0.00 -0.40 0.00 0.00 41.96 39.90 1mm5 s TYR 154 CO 0.07 -0.52 0.10 -0.06 -1.57 0.00 0.00 175.55 173.56 1mm5 s PHE 155 N 0.94 3.16 -0.05 2.71 0.40 -0.96 -4.12 117.98 120.06 1mm5 s PHE 155 Ca -0.07 -0.16 -0.10 0.00 -0.60 0.00 0.00 56.93 56.00 1mm5 s PHE 155 Cb -0.15 -2.23 -0.05 0.00 0.51 0.00 0.00 43.02 41.10 1mm5 s PHE 155 CO -0.02 -0.17 0.28 0.00 0.70 0.00 0.00 175.22 176.01 1mm5 s ALA 156 N 1.31 3.80 0.08 5.36 0.00 -1.05 -0.43 121.76 130.82 1mm5 s ALA 156 Ca 0.05 -0.45 0.01 0.00 0.00 0.00 0.00 51.96 51.58 1mm5 s ALA 156 Cb -0.15 -2.17 -0.04 0.00 0.00 0.00 0.00 23.12 20.77 1mm5 s ALA 156 CO 0.05 0.56 -0.06 -1.58 0.00 0.00 0.00 175.76 174.73 1mm5 s TRP 157 N -1.10 0.79 -0.00 0.00 0.52 -0.89 -3.24 118.94 115.02 1mm5 s TRP 157 Ca 0.21 -0.88 0.08 0.00 0.02 0.00 0.00 56.10 55.53 1mm5 s TRP 157 Cb -0.14 -0.47 -0.02 0.00 -1.15 0.00 0.00 33.47 31.68 1mm5 s TRP 157 CO 0.10 -0.18 -0.25 1.41 0.02 0.00 0.00 176.95 178.04 1mm5 s MET 158 N -3.51 1.97 -0.06 4.98 1.75 -0.72 -2.59 119.30 121.12 1mm5 s MET 158 Ca 0.08 -0.96 0.00 0.00 -1.25 0.00 0.00 55.69 53.56 1mm5 s MET 158 Cb 0.03 -1.97 0.02 0.00 2.84 0.00 0.00 34.83 35.76 1mm5 s MET 158 CO -0.05 0.53 -0.03 0.50 -0.65 0.00 0.00 175.02 175.32 1mm5 s ARG 159 N -0.78 0.81 -0.11 4.11 3.52 -0.67 -2.59 118.95 123.24 1mm5 s ARG 159 Ca 0.10 -0.05 0.04 0.00 -0.13 0.00 0.00 55.73 55.68 1mm5 s ARG 159 Cb -0.10 -0.93 0.00 0.00 -1.56 0.00 0.00 34.95 32.37 1mm5 s ARG 159 CO -0.00 -0.16 -0.23 -0.06 -0.81 0.00 0.00 175.30 174.04 1mm5 s PHE 160 N 1.27 2.55 -0.25 5.12 0.40 -1.07 -2.43 117.98 123.58 1mm5 s PHE 160 Ca -0.05 -1.11 -0.07 0.00 -0.60 0.00 0.00 56.93 55.09 1mm5 s PHE 160 Cb -0.14 -1.72 -0.03 0.00 0.51 0.00 0.00 43.02 41.65 1mm5 s PHE 160 CO -0.02 -0.47 0.07 -1.14 0.70 0.00 0.00 175.22 174.36 1mm5 s GLN 161 N 0.47 3.65 0.41 0.44 -0.44 -1.26 -0.41 119.66 122.52 1mm5 s GLN 161 Ca -0.16 -0.48 0.03 0.00 -2.50 0.00 0.00 55.36 52.26 1mm5 s GLN 161 Cb -0.17 -3.31 -0.04 0.00 -1.64 0.00 0.00 33.01 27.85 1mm5 s GLN 161 CO 0.06 -0.18 0.07 -0.06 0.50 0.00 0.00 175.29 175.68 1mm5 s PHE 162 N 1.59 1.93 0.04 1.67 0.40 -0.74 -4.91 117.98 117.95 1mm5 s PHE 162 Ca 0.06 -1.06 0.07 0.00 -0.60 0.00 0.00 56.93 55.40 1mm5 s PHE 162 Cb -0.15 -1.35 -0.02 0.00 0.51 0.00 0.00 43.02 42.00 1mm5 s PHE 162 CO 0.03 -0.02 -0.20 -1.17 0.70 0.00 0.00 175.22 174.56 1mm5 s LEU 163 N -3.64 2.15 -1.19 -0.37 2.96 -1.26 -2.54 118.68 114.78 1mm5 s LEU 163 Ca 0.24 -0.49 -0.21 0.00 -0.22 0.00 0.00 54.13 53.45 1mm5 s LEU 163 Cb 0.05 -0.94 -0.05 0.00 0.50 0.00 0.00 46.19 45.75 1mm5 s LEU 163 CO 0.13 0.16 1.89 1.21 -1.32 0.00 0.00 176.35 178.41 1mm5 n GLU 164 N 1.95 2.10 -3.15 1.98 4.07 -1.26 -4.68 120.64 121.65 1mm5 n GLU 164 Ca -0.17 -2.65 0.06 0.00 -0.06 0.00 0.00 57.16 54.34 1mm5 n GLU 164 Cb 0.53 -3.57 -0.01 0.00 -0.06 0.00 0.00 31.44 28.34 1mm5 n GLU 164 CO 0.00 0.00 0.00 -1.58 -0.06 0.00 0.00 177.13 175.49 1mm5 s HIS 165 N 8.18 -0.33 0.00 4.31 2.46 -1.26 -5.10 115.29 123.56 1mm5 s HIS 165 Ca 0.62 0.25 0.00 0.00 0.47 0.00 0.00 55.06 56.41 1mm5 s HIS 165 Cb 0.03 0.08 0.00 0.00 -0.13 0.00 0.00 32.58 32.56 1mm5 s HIS 165 CO 0.11 -0.18 0.00 0.72 -2.47 0.00 0.00 174.74 172.91 1mm5 n HIS 166 N 5.26 0.00 -4.13 3.88 8.25 -1.26 -5.14 115.22 122.08 1mm5 n HIS 166 Ca 0.02 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.33 1mm5 n HIS 166 Cb 0.56 0.17 -0.12 0.00 1.12 0.00 0.00 29.99 31.72 1mm5 n HIS 166 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 1mm5 s HIS 167 N -0.50 0.80 -0.06 4.41 3.76 -1.26 -5.16 115.29 117.28 1mm5 s HIS 167 Ca 0.00 -0.42 -0.12 0.00 -0.15 0.00 0.00 55.06 54.37 1mm5 s HIS 167 Cb 0.00 -0.47 0.02 0.00 1.11 0.00 0.00 32.58 33.24 1mm5 s HIS 167 CO 0.00 -0.04 0.30 -3.38 -0.85 0.00 0.00 174.74 170.77 1mm5 s HIS 168 N -1.13 -0.24 0.27 1.40 -3.43 -1.26 -5.15 115.29 105.75 1mm5 s HIS 168 Ca -0.06 0.49 -0.29 0.00 -0.80 0.00 0.00 55.06 54.40 1mm5 s HIS 168 Cb -0.09 0.09 -0.09 0.00 -1.43 0.00 0.00 32.58 31.06 1mm5 s HIS 168 CO 0.01 -0.28 1.02 -1.58 -2.00 0.00 0.00 174.74 171.91 1mm5 s HIS 169 N -0.64 3.76 -2.00 0.38 5.04 -1.26 -5.32 115.29 115.25 1mm5 s HIS 169 Ca -0.07 1.80 0.01 0.00 -1.54 0.00 0.00 55.06 55.25 1mm5 s HIS 169 Cb -0.04 -3.13 0.03 0.00 0.04 0.00 0.00 32.58 29.48 1mm5 s HIS 169 CO 0.02 -0.06 0.53 0.72 -2.34 0.00 0.00 174.74 173.61