#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 0.81 0.02 6.12 4.13 -1.26 -4.96 115.26 120.12 1mm5 n ASN 2 Ca 0.00 -2.79 -0.08 0.00 1.68 0.00 0.00 54.58 53.39 1mm5 n ASN 2 Cb 0.00 -0.64 -0.06 0.00 -1.54 0.00 0.00 39.78 37.55 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 4.37 -0.16 0.00 5.41 0.00 -2.06 -2.89 119.26 123.94 1mm5 h ALA 3 Ca 0.13 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.69 1mm5 h ALA 3 Cb 0.84 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 1mm5 h ALA 3 CO 0.52 -0.18 -0.72 -0.44 0.00 0.00 0.00 179.25 178.43 1mm5 h ASP 4 N -0.97 0.00 -0.55 0.00 5.19 -2.00 -3.17 116.42 114.92 1mm5 h ASP 4 Ca -0.02 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.33 1mm5 h ASP 4 Cb 0.44 0.00 -0.03 0.00 0.18 0.00 0.00 39.33 39.93 1mm5 h ASP 4 CO 0.03 0.72 0.13 -0.08 -3.12 0.00 0.00 179.24 176.91 1mm5 h GLU 5 N 0.00 0.93 -0.26 3.56 4.22 -1.94 -1.66 114.58 119.43 1mm5 h GLU 5 Ca -0.01 -0.21 -0.12 0.00 0.08 0.00 0.00 59.36 59.10 1mm5 h GLU 5 Cb 1.36 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.47 1mm5 h GLU 5 CO 0.09 0.84 -0.33 -1.49 -2.18 0.00 0.00 179.01 175.94 1mm5 h TRP 6 N 0.89 0.65 -0.05 0.92 4.06 -1.49 -2.84 115.95 118.08 1mm5 h TRP 6 Ca 0.19 -0.17 -0.12 0.00 2.06 0.00 0.00 58.89 60.85 1mm5 h TRP 6 Cb 0.34 -0.15 -0.01 0.00 -1.00 0.00 0.00 29.16 28.34 1mm5 h TRP 6 CO 0.02 0.83 -0.52 1.98 -3.56 0.00 0.00 178.44 177.19 1mm5 h MET 7 N 0.48 0.14 -0.54 0.49 4.05 -1.45 -1.81 114.93 116.29 1mm5 h MET 7 Ca 0.05 -0.08 -0.09 0.00 -0.28 0.00 0.00 59.70 59.31 1mm5 h MET 7 Cb 0.81 0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.60 1mm5 h MET 7 CO 0.07 0.63 0.00 1.15 0.23 0.00 0.00 176.91 178.99 1mm5 h THR 8 N 0.11 1.26 -0.10 -0.77 2.02 -1.09 0.30 112.91 114.64 1mm5 h THR 8 Ca 0.00 -1.10 -0.23 0.00 0.77 0.00 0.00 66.41 65.85 1mm5 h THR 8 Cb 0.96 0.90 0.01 0.00 -1.74 0.00 0.00 68.15 68.28 1mm5 h THR 8 CO 0.08 0.39 -0.85 0.00 0.37 0.00 0.00 175.52 175.51 1mm5 h THR 9 N 0.83 1.30 -0.33 3.16 1.03 -1.43 -2.82 112.91 114.64 1mm5 h THR 9 Ca 0.15 -2.08 -0.06 0.00 -0.01 0.00 0.00 66.41 64.41 1mm5 h THR 9 Cb 0.53 2.11 -0.01 0.00 -1.07 0.00 0.00 68.15 69.71 1mm5 h THR 9 CO 0.03 0.65 -0.03 -0.26 -0.01 0.00 0.00 175.52 175.90 1mm5 h PHE 10 N 0.46 0.67 -0.03 0.00 0.04 -1.25 -1.64 116.94 115.19 1mm5 h PHE 10 Ca -0.07 -0.13 0.01 0.00 2.80 0.00 0.00 57.97 60.58 1mm5 h PHE 10 Cb 1.48 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 39.45 1mm5 h PHE 10 CO 0.08 0.75 -0.02 -0.09 -0.60 0.00 0.00 178.31 178.43 1mm5 h ARG 11 N 0.41 -0.02 -0.15 1.51 9.65 -0.99 -0.55 114.38 124.23 1mm5 h ARG 11 Ca 0.09 0.00 -0.03 0.00 -1.10 0.00 0.00 59.98 58.94 1mm5 h ARG 11 Cb 0.50 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.07 1mm5 h ARG 11 CO 0.02 -0.01 -0.04 0.93 2.80 0.00 0.00 179.97 183.67 1mm5 h GLU 12 N -0.02 0.22 -0.18 0.20 5.08 -1.48 0.86 114.58 119.26 1mm5 h GLU 12 Ca 0.02 -0.04 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1mm5 h GLU 12 Cb 0.05 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.25 1mm5 h GLU 12 CO -0.04 0.29 -0.14 -0.97 -1.00 0.00 0.00 179.01 177.15 1mm5 h ASN 13 N 0.22 0.44 0.50 1.42 -0.00 -0.68 -2.34 115.58 115.13 1mm5 h ASN 13 Ca 0.05 -0.45 -0.14 0.00 -0.00 0.00 0.00 56.30 55.76 1mm5 h ASN 13 Cb 0.22 -0.12 -0.02 0.00 -0.00 0.00 0.00 38.32 38.41 1mm5 h ASN 13 CO 0.01 0.80 -0.63 0.40 -0.00 0.00 0.00 177.43 178.01 1mm5 h ILE 14 N 0.08 1.42 -0.11 2.57 2.04 -0.80 -2.55 117.51 120.17 1mm5 h ILE 14 Ca 0.03 -2.09 -0.09 0.00 1.00 0.00 0.00 64.86 63.71 1mm5 h ILE 14 Cb 0.66 2.10 -0.01 0.00 -0.74 0.00 0.00 36.82 38.82 1mm5 h ILE 14 CO 0.04 0.61 -0.36 0.00 0.00 0.00 0.00 178.15 178.44 1mm5 h ALA 15 N 1.27 1.20 0.08 1.87 0.00 -0.80 -2.17 119.26 120.71 1mm5 h ALA 15 Ca -0.01 -0.37 -0.21 0.00 0.00 0.00 0.00 54.91 54.32 1mm5 h ALA 15 Cb 1.13 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.85 1mm5 h ALA 15 CO 0.09 0.54 -0.88 1.96 0.00 0.00 0.00 179.25 180.96 1mm5 h GLN 16 N 0.19 0.45 0.25 0.00 4.20 -1.31 -2.82 115.11 116.07 1mm5 h GLN 16 Ca 0.02 -0.59 -0.01 0.00 0.06 0.00 0.00 58.65 58.13 1mm5 h GLN 16 Cb 0.72 0.19 0.00 0.00 0.30 0.00 0.00 27.48 28.70 1mm5 h GLN 16 CO 0.05 1.24 -0.13 1.79 -0.67 0.00 0.00 178.83 181.12 1mm5 h THR 17 N -0.05 0.74 -0.34 -0.54 1.35 -1.40 -2.47 112.91 110.20 1mm5 h THR 17 Ca -0.13 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1mm5 h THR 17 Cb 1.61 0.74 -0.02 0.00 -1.73 0.00 0.00 68.15 68.75 1mm5 h THR 17 CO 0.17 0.00 0.19 -0.50 -0.25 0.00 0.00 175.52 175.13 1mm5 h TRP 18 N -0.35 0.44 -0.21 4.73 -0.00 -1.52 -1.50 115.95 117.55 1mm5 h TRP 18 Ca -0.03 0.00 -0.01 0.00 -0.00 0.00 0.00 58.89 58.85 1mm5 h TRP 18 Cb 0.27 -0.15 -0.01 0.00 -0.00 0.00 0.00 29.16 29.27 1mm5 h TRP 18 CO -0.07 0.31 0.09 0.37 -0.00 0.00 0.00 178.44 179.14 1mm5 h GLN 19 N 0.47 0.28 -3.34 0.49 5.75 -1.18 -3.27 115.11 114.31 1mm5 h GLN 19 Ca 0.12 -0.03 -0.73 0.00 -0.15 0.00 0.00 58.65 57.86 1mm5 h GLN 19 Cb 0.00 -0.06 -0.33 0.00 1.07 0.00 0.00 27.48 28.16 1mm5 h GLN 19 CO -0.02 0.23 0.08 1.04 -2.65 0.00 0.00 178.83 177.51 1mm5 n GLN 20 N -4.46 2.95 -2.28 1.69 6.02 -0.56 -5.06 117.38 115.68 1mm5 n GLN 20 Ca 0.00 -4.48 -0.41 0.00 -0.01 0.00 0.00 57.00 52.10 1mm5 n GLN 20 Cb 0.11 -2.45 -0.03 0.00 1.02 0.00 0.00 30.24 28.89 1mm5 n GLN 20 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1mm5 s PRO 21 N -1.44 4.45 -0.02 -1.09 0.04 -1.24 -4.94 135.00 130.77 1mm5 s PRO 21 Ca 0.29 2.00 -0.04 0.00 0.04 0.00 0.00 61.00 63.29 1mm5 s PRO 21 Cb -0.07 -3.18 -0.02 0.00 0.04 0.00 0.00 34.50 31.27 1mm5 s PRO 21 CO -0.10 -0.12 0.35 0.93 0.04 0.00 0.00 177.00 178.09 1mm5 h GLU 22 N 4.67 -0.13 -4.96 4.56 5.08 -1.94 -3.44 114.58 118.43 1mm5 h GLU 22 Ca -0.46 0.01 -0.65 0.00 -1.00 0.00 0.00 59.36 57.26 1mm5 h GLU 22 Cb 1.22 0.03 -0.17 0.00 0.50 0.00 0.00 28.75 30.33 1mm5 h GLU 22 CO 0.72 -0.09 -0.38 -1.01 -1.00 0.00 0.00 179.01 177.26 1mm5 s HIS 23 N -2.00 3.23 -0.34 4.33 3.76 -1.26 -4.45 115.29 118.55 1mm5 s HIS 23 Ca -0.02 0.13 -0.22 0.00 -0.15 0.00 0.00 55.06 54.79 1mm5 s HIS 23 Cb 0.00 -2.51 0.00 0.00 1.11 0.00 0.00 32.58 31.18 1mm5 s HIS 23 CO 0.06 -0.27 0.74 0.71 -0.85 0.00 0.00 174.74 175.13 1mm5 s TYR 24 N 1.90 3.15 0.19 1.40 2.02 -0.18 -4.57 117.35 121.26 1mm5 s TYR 24 Ca 0.10 0.57 0.10 0.00 -0.37 0.00 0.00 57.07 57.47 1mm5 s TYR 24 Cb -0.16 -3.27 -0.04 0.00 -0.40 0.00 0.00 41.96 38.08 1mm5 s TYR 24 CO 0.11 -0.65 -0.15 -0.51 -1.57 0.00 0.00 175.55 172.78 1mm5 s ASP 25 N 1.77 3.94 0.05 2.29 1.01 -1.02 -0.41 116.67 124.29 1mm5 s ASP 25 Ca 0.30 -0.71 0.06 0.00 0.71 0.00 0.00 52.55 52.91 1mm5 s ASP 25 Cb -0.14 -0.54 -0.03 0.00 1.01 0.00 0.00 42.92 43.22 1mm5 s ASP 25 CO 0.15 0.10 -0.14 -0.22 0.21 0.00 0.00 175.17 175.27 1mm5 s LEU 26 N -2.84 2.82 -0.06 1.23 2.96 -0.56 -0.58 118.68 121.64 1mm5 s LEU 26 Ca 0.24 -0.38 -0.02 0.00 -0.22 0.00 0.00 54.13 53.75 1mm5 s LEU 26 Cb -0.08 -1.65 0.03 0.00 0.50 0.00 0.00 46.19 44.99 1mm5 s LEU 26 CO 0.13 0.24 0.05 -0.47 -1.32 0.00 0.00 176.35 174.98 1mm5 s TYR 27 N -1.02 0.21 0.11 5.38 6.14 0.43 -2.59 117.35 126.02 1mm5 s TYR 27 Ca 0.17 0.10 -0.19 0.00 0.64 0.00 0.00 57.07 57.79 1mm5 s TYR 27 Cb -0.11 -0.57 0.05 0.00 0.42 0.00 0.00 41.96 41.75 1mm5 s TYR 27 CO 0.08 -0.25 0.48 0.96 0.64 0.00 0.00 175.55 177.46 1mm5 s ILE 28 N 2.12 0.04 1.05 3.14 -4.36 -0.95 -2.30 121.20 119.94 1mm5 s ILE 28 Ca 0.05 -0.34 -0.16 0.00 -0.26 0.00 0.00 60.65 59.93 1mm5 s ILE 28 Cb -0.12 -1.07 0.07 0.00 1.25 0.00 0.00 42.46 42.59 1mm5 s ILE 28 CO -0.04 -0.19 0.14 -2.65 0.24 0.00 0.00 174.94 172.44 1mm5 n PRO 29 N -0.09 -1.04 0.05 0.37 -0.02 -1.26 -0.47 135.00 132.55 1mm5 n PRO 29 Ca -0.17 -0.28 0.00 0.00 -2.02 0.00 0.00 63.50 61.04 1mm5 n PRO 29 Cb 0.63 -1.74 0.00 0.00 -0.02 0.00 0.00 33.50 32.37 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 -4.05 2.60 -3.60 3.55 0.00 -1.09 -3.72 120.51 114.20 1mm5 n ALA 30 Ca 0.03 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.35 1mm5 n ALA 30 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.98 1mm5 n ALA 30 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 1mm5 s ILE 31 N -1.30 0.00 0.24 0.00 2.07 -1.15 -5.00 121.20 116.05 1mm5 s ILE 31 Ca 0.00 0.00 -0.04 0.00 -1.41 0.00 0.00 60.65 59.20 1mm5 s ILE 31 Cb 0.00 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.57 1mm5 s ILE 31 CO 0.00 0.00 0.28 0.42 -1.91 0.00 0.00 174.94 173.73 1mm5 s THR 32 N -0.46 0.00 0.14 4.00 -4.23 -1.26 -1.80 115.64 112.03 1mm5 s THR 32 Ca -0.01 -1.77 -0.23 0.00 -1.18 0.00 0.00 61.69 58.50 1mm5 s THR 32 Cb -0.03 -2.42 -0.08 0.00 1.34 0.00 0.00 72.50 71.32 1mm5 s THR 32 CO 0.00 0.00 0.70 0.26 -0.54 0.00 0.00 174.62 175.04 1mm5 s TRP 33 N -3.96 3.85 -0.34 3.99 0.52 -1.26 -5.04 118.94 116.71 1mm5 s TRP 33 Ca 0.33 1.49 -0.22 0.00 0.02 0.00 0.00 56.10 57.71 1mm5 s TRP 33 Cb 0.04 -2.66 0.00 0.00 -1.15 0.00 0.00 33.47 29.70 1mm5 s TRP 33 CO 0.13 0.52 0.74 -3.38 0.02 0.00 0.00 176.95 174.98 1mm5 s HIS 34 N -1.18 3.16 -0.31 -1.98 -3.43 -1.26 -4.95 115.29 105.34 1mm5 s HIS 34 Ca 0.34 0.61 -0.10 0.00 -0.80 0.00 0.00 55.06 55.11 1mm5 s HIS 34 Cb -0.21 -3.25 0.19 0.00 -1.43 0.00 0.00 32.58 27.88 1mm5 s HIS 34 CO 0.23 -0.63 1.05 0.00 -2.00 0.00 0.00 174.74 173.39 1mm5 s ALA 35 N 2.93 -4.20 0.14 -1.38 0.00 -1.26 -4.85 121.76 113.14 1mm5 s ALA 35 Ca 0.30 1.32 0.00 0.00 0.00 0.00 0.00 51.96 53.58 1mm5 s ALA 35 Cb -0.14 -2.91 0.00 0.00 0.00 0.00 0.00 23.12 20.07 1mm5 s ALA 35 CO 0.14 -2.26 0.00 -2.13 0.00 0.00 0.00 175.76 171.52 1mm5 n ARG 36 N 4.55 0.00 0.00 0.00 0.63 -1.26 -4.98 116.66 115.61 1mm5 n ARG 36 Ca 0.08 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.01 1mm5 n ARG 36 Cb 0.60 -0.33 0.00 0.00 0.45 0.00 0.00 32.46 33.18 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 -3.39 -0.72 -3.25 -0.14 7.35 -1.26 -5.09 117.46 110.96 1mm5 n PHE 37 Ca 0.00 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.37 1mm5 n PHE 37 Cb 0.05 0.14 -0.06 0.00 0.35 0.00 0.00 39.48 39.97 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 -1.36 3.42 -0.97 3.13 0.00 -1.26 -4.94 121.76 119.77 1mm5 s ALA 38 Ca 0.00 -0.09 -0.26 0.00 0.00 0.00 0.00 51.96 51.61 1mm5 s ALA 38 Cb 0.00 -2.63 -0.17 0.00 0.00 0.00 0.00 23.12 20.31 1mm5 s ALA 38 CO 0.00 0.40 2.20 1.52 0.00 0.00 0.00 175.76 179.89 1mm5 s TYR 39 N -1.92 1.27 0.01 0.00 1.13 -1.26 -4.90 117.35 111.68 1mm5 s TYR 39 Ca 0.51 1.98 -0.05 0.00 -1.41 0.00 0.00 57.07 58.10 1mm5 s TYR 39 Cb -0.11 -3.45 -0.05 0.00 -1.10 0.00 0.00 41.96 37.26 1mm5 s TYR 39 CO 0.19 -1.09 0.25 0.34 -2.51 0.00 0.00 175.55 172.72 1mm5 s ASP 40 N 9.23 6.45 0.00 -0.18 -1.08 -1.26 -4.70 116.67 125.13 1mm5 s ASP 40 Ca 0.84 0.49 0.00 0.00 -0.52 0.00 0.00 52.55 53.36 1mm5 s ASP 40 Cb -0.08 -2.06 0.00 0.00 -1.46 0.00 0.00 42.92 39.32 1mm5 s ASP 40 CO 0.13 0.24 0.00 2.29 0.52 0.00 0.00 175.17 178.35 1mm5 n LYS 41 N 1.00 0.00 -2.71 4.34 0.00 -1.26 -4.86 118.16 114.67 1mm5 n LYS 41 Ca -0.11 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.15 1mm5 n LYS 41 Cb 0.53 0.00 0.04 0.00 -0.00 0.00 0.00 35.03 35.60 1mm5 n LYS 41 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1mm5 n GLU 42 N -1.30 1.86 -2.49 -1.58 4.07 -1.26 -4.95 120.64 114.99 1mm5 n GLU 42 Ca 0.00 -3.56 -0.20 0.00 -0.06 0.00 0.00 57.16 53.34 1mm5 n GLU 42 Cb 0.00 -1.62 -0.00 0.00 -0.06 0.00 0.00 31.44 29.75 1mm5 n GLU 42 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1mm5 n LYS 43 N -0.50 -2.15 -1.25 5.31 5.02 -1.26 -4.88 118.16 118.45 1mm5 n LYS 43 Ca 0.12 0.95 -0.29 0.00 -2.02 0.00 0.00 58.31 57.07 1mm5 n LYS 43 Cb 0.82 -5.58 0.12 0.00 -0.02 0.00 0.00 35.03 30.37 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 -4.10 3.38 -1.95 -0.18 -1.04 -1.26 -4.98 114.28 104.15 1mm5 n THR 44 Ca -0.21 -2.40 -0.30 0.00 -2.04 0.00 0.00 64.05 59.10 1mm5 n THR 44 Cb 0.67 -0.87 0.19 0.00 -1.82 0.00 0.00 70.33 68.49 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 -1.48 3.11 -0.47 8.00 -1.08 -1.26 -4.93 116.67 118.56 1mm5 s ASP 45 Ca 0.59 0.24 0.04 0.00 -0.52 0.00 0.00 52.55 52.89 1mm5 s ASP 45 Cb 0.48 -0.28 0.62 0.00 -1.46 0.00 0.00 42.92 42.28 1mm5 s ASP 45 CO 0.04 -2.73 1.89 -1.14 0.52 0.00 0.00 175.17 173.75 1mm5 n ARG 46 N -3.75 2.29 -3.50 4.34 0.00 -1.26 -4.94 116.66 109.84 1mm5 n ARG 46 Ca 0.15 -3.08 -0.09 0.00 -0.00 0.00 0.00 57.85 54.84 1mm5 n ARG 46 Cb 0.59 -2.17 -0.02 0.00 0.00 0.00 0.00 32.46 30.87 1mm5 n ARG 46 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.63 177.16 1mm5 s TYR 47 N -3.38 -0.37 -0.24 -0.14 5.04 -1.26 -5.15 117.35 111.86 1mm5 s TYR 47 Ca 0.57 0.25 0.01 0.00 -2.44 0.00 0.00 57.07 55.45 1mm5 s TYR 47 Cb 0.48 0.54 0.04 0.00 0.35 0.00 0.00 41.96 43.36 1mm5 s TYR 47 CO 0.08 -0.57 -0.11 1.21 -1.34 0.00 0.00 175.55 174.82 1mm5 s ASN 48 N -2.46 4.08 -0.04 4.32 2.47 -1.26 -5.04 114.94 117.01 1mm5 s ASN 48 Ca 0.04 -1.01 0.07 0.00 0.42 0.00 0.00 52.86 52.37 1mm5 s ASN 48 Cb -0.01 -1.58 -0.01 0.00 -1.45 0.00 0.00 41.25 38.20 1mm5 s ASN 48 CO -0.09 -0.12 -0.25 -0.70 -3.72 0.00 0.00 177.10 172.22 1mm5 s GLU 49 N 1.24 2.31 -0.55 0.43 2.12 -1.26 -5.08 118.70 117.90 1mm5 s GLU 49 Ca -0.02 -0.89 0.04 0.00 0.36 0.00 0.00 54.97 54.46 1mm5 s GLU 49 Cb -0.17 -2.06 0.17 0.00 0.26 0.00 0.00 34.13 32.33 1mm5 s GLU 49 CO -0.07 0.44 0.42 0.54 -0.54 0.00 0.00 175.26 176.05 1mm5 n ARG 50 N 2.76 0.98 -2.37 4.30 5.12 -1.26 -5.12 116.66 121.07 1mm5 n ARG 50 Ca -0.17 -3.80 -0.37 0.00 -1.93 0.00 0.00 57.85 51.57 1mm5 n ARG 50 Cb 0.52 -1.96 -0.02 0.00 -1.16 0.00 0.00 32.46 29.83 1mm5 n ARG 50 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1mm5 s PRO 51 N -0.69 4.03 0.09 5.56 0.04 -1.26 -5.06 135.00 137.71 1mm5 s PRO 51 Ca 0.29 1.71 -0.10 0.00 0.04 0.00 0.00 61.00 62.94 1mm5 s PRO 51 Cb 0.00 -2.57 0.00 0.00 0.04 0.00 0.00 34.50 31.98 1mm5 s PRO 51 CO -0.18 -0.31 0.22 1.67 0.04 0.00 0.00 177.00 178.44 1mm5 s TRP 52 N -1.53 0.09 0.00 0.56 -2.14 -1.26 -5.14 118.94 109.52 1mm5 s TRP 52 Ca 0.59 -0.49 0.00 0.00 2.66 0.00 0.00 56.10 58.86 1mm5 s TRP 52 Cb -0.27 -0.01 0.00 0.00 -3.10 0.00 0.00 33.47 30.09 1mm5 s TRP 52 CO 0.34 -0.56 0.00 0.41 -2.66 0.00 0.00 176.95 174.48 1mm5 n GLY 53 N -0.03 4.58 0.00 3.67 0.00 -1.26 -4.73 105.19 107.43 1mm5 n GLY 53 Ca -0.15 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.03 1mm5 n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mm5 n GLY 54 N -1.70 -0.66 0.00 -0.02 0.00 -1.06 -4.66 105.19 97.08 1mm5 n GLY 54 Ca 0.00 -1.17 0.00 0.00 0.00 0.00 0.00 46.02 44.85 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 0.00 -0.79 3.76 -0.02 0.00 -0.97 -1.55 105.19 105.61 1mm5 n GLY 55 Ca 0.00 -0.31 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 1mm5 n GLY 55 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1mm5 s PHE 56 N -4.00 2.91 0.49 1.61 -0.12 0.28 -0.42 117.98 118.73 1mm5 s PHE 56 Ca 0.00 -0.19 0.02 0.00 -0.05 0.00 0.00 56.93 56.71 1mm5 s PHE 56 Cb 0.00 -1.38 -0.02 0.00 -0.63 0.00 0.00 43.02 40.99 1mm5 s PHE 56 CO 0.00 0.51 0.02 0.20 -0.05 0.00 0.00 175.22 175.90 1mm5 s GLY 57 N -3.80 2.92 0.28 1.99 0.00 0.25 -1.42 107.32 107.56 1mm5 s GLY 57 Ca 0.33 -0.68 0.04 0.00 0.00 0.00 0.00 44.72 44.41 1mm5 s GLY 57 CO 0.23 -2.15 0.20 1.08 0.00 0.00 0.00 173.10 172.46 1mm5 s LEU 58 N -3.83 1.55 -0.09 0.66 1.02 -1.00 -2.44 118.68 114.55 1mm5 s LEU 58 Ca 0.11 -1.59 -0.20 0.00 0.02 0.00 0.00 54.13 52.47 1mm5 s LEU 58 Cb 0.03 0.39 0.04 0.00 0.02 0.00 0.00 46.19 46.67 1mm5 s LEU 58 CO 0.06 -0.94 0.47 -0.94 0.02 0.00 0.00 176.35 175.01 1mm5 s SER 59 N -3.31 -0.43 -0.08 2.29 1.04 -1.26 -2.39 113.70 109.56 1mm5 s SER 59 Ca 0.38 0.58 -0.01 0.00 0.48 0.00 0.00 55.95 57.39 1mm5 s SER 59 Cb 0.05 0.62 0.03 0.00 0.10 0.00 0.00 66.02 66.82 1mm5 s SER 59 CO 0.20 -0.39 -0.04 -0.13 0.98 0.00 0.00 173.24 173.87 1mm5 s ARG 60 N -0.71 1.01 -0.36 4.02 0.52 -1.07 -4.83 118.95 117.54 1mm5 s ARG 60 Ca -0.08 -0.07 -0.14 0.00 -0.52 0.00 0.00 55.73 54.93 1mm5 s ARG 60 Cb -0.03 -1.20 -0.01 0.00 0.52 0.00 0.00 34.95 34.23 1mm5 s ARG 60 CO 0.04 -0.25 0.26 -0.46 0.02 0.00 0.00 175.30 174.91 1mm5 s TRP 61 N 1.70 3.23 0.19 -0.53 -0.11 -1.26 -0.40 118.94 121.76 1mm5 s TRP 61 Ca 0.02 -0.32 -0.17 0.00 1.22 0.00 0.00 56.10 56.85 1mm5 s TRP 61 Cb -0.13 -2.51 -0.08 0.00 -1.50 0.00 0.00 33.47 29.25 1mm5 s TRP 61 CO -0.05 -0.43 0.65 0.34 -4.62 0.00 0.00 176.95 172.84 1mm5 s ASP 62 N 1.71 6.95 0.60 5.86 2.15 0.42 -4.94 116.67 129.42 1mm5 s ASP 62 Ca 0.06 1.27 0.36 0.00 0.43 0.00 0.00 52.55 54.66 1mm5 s ASP 62 Cb -0.18 -2.36 1.95 0.00 -0.30 0.00 0.00 42.92 42.03 1mm5 s ASP 62 CO 0.10 0.05 2.09 1.05 -0.17 0.00 0.00 175.17 178.30 1mm5 h GLU 63 N 3.44 0.00 -1.26 4.34 9.09 -1.98 -1.82 114.58 126.40 1mm5 h GLU 63 Ca -0.48 0.00 -0.30 0.00 0.05 0.00 0.00 59.36 58.63 1mm5 h GLU 63 Cb 1.19 0.00 -0.15 0.00 -1.65 0.00 0.00 28.75 28.14 1mm5 h GLU 63 CO 0.65 0.00 0.38 1.17 0.05 0.00 0.00 179.01 181.27 1mm5 n LYS 64 N -2.85 1.73 -3.63 1.06 4.81 -1.26 -4.83 118.16 113.18 1mm5 n LYS 64 Ca -0.02 -1.56 -0.22 0.00 -0.87 0.00 0.00 58.31 55.64 1mm5 n LYS 64 Cb 0.16 -1.61 0.06 0.00 0.02 0.00 0.00 35.03 33.66 1mm5 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mm5 n GLY 65 N 0.00 -0.38 3.36 3.14 0.00 -0.70 -5.00 105.19 105.61 1mm5 n GLY 65 Ca 0.30 0.15 -0.26 0.00 0.00 0.00 0.00 46.02 46.21 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 -4.06 3.06 -0.35 1.61 0.01 -1.08 -4.82 114.94 109.30 1mm5 s ASN 66 Ca 0.18 -0.78 -0.00 0.00 -0.71 0.00 0.00 52.86 51.55 1mm5 s ASN 66 Cb -0.09 -0.20 0.13 0.00 0.41 0.00 0.00 41.25 41.51 1mm5 s ASN 66 CO 0.78 0.10 0.20 0.86 -1.51 0.00 0.00 177.10 177.53 1mm5 s TRP 67 N -1.39 0.93 0.65 2.20 -0.11 -0.91 -0.44 118.94 119.87 1mm5 s TRP 67 Ca 0.14 -1.65 -0.15 0.00 1.22 0.00 0.00 56.10 55.66 1mm5 s TRP 67 Cb -0.09 -1.12 -0.00 0.00 -1.50 0.00 0.00 33.47 30.75 1mm5 s TRP 67 CO 0.07 -0.82 1.10 -1.01 -4.62 0.00 0.00 176.95 171.66 1mm5 s HIS 68 N 1.14 2.70 -0.10 5.86 3.76 0.46 -1.78 115.29 127.33 1mm5 s HIS 68 Ca 0.16 1.54 0.01 0.00 -0.15 0.00 0.00 55.06 56.62 1mm5 s HIS 68 Cb -0.22 -3.12 0.02 0.00 1.11 0.00 0.00 32.58 30.36 1mm5 s HIS 68 CO -0.06 -1.57 -0.12 0.20 -0.85 0.00 0.00 174.74 172.33 1mm5 s GLY 69 N -2.69 0.93 0.05 -2.22 0.00 -0.98 -2.59 107.32 99.82 1mm5 s GLY 69 Ca 0.66 -0.63 0.05 0.00 0.00 0.00 0.00 44.72 44.80 1mm5 s GLY 69 CO 0.42 0.41 -0.07 -2.27 0.00 0.00 0.00 173.10 171.58 1mm5 s LEU 70 N 1.18 3.16 -0.14 0.66 0.20 -1.00 -2.60 118.68 120.14 1mm5 s LEU 70 Ca -0.04 -0.23 -0.00 0.00 0.69 0.00 0.00 54.13 54.55 1mm5 s LEU 70 Cb -0.14 -1.88 0.03 0.00 -0.43 0.00 0.00 46.19 43.77 1mm5 s LEU 70 CO -0.03 0.23 -0.10 -0.31 -0.29 0.00 0.00 176.35 175.85 1mm5 s TYR 71 N -1.11 1.88 -0.25 5.38 2.02 -1.09 -2.39 117.35 121.79 1mm5 s TYR 71 Ca 0.20 -1.07 0.03 0.00 -0.37 0.00 0.00 57.07 55.85 1mm5 s TYR 71 Cb -0.11 -1.43 0.06 0.00 -0.40 0.00 0.00 41.96 40.08 1mm5 s TYR 71 CO 0.11 -0.61 -0.10 0.00 -1.57 0.00 0.00 175.55 173.38 1mm5 s ALA 72 N 1.58 2.44 0.32 3.71 0.00 -0.50 -1.45 121.76 127.85 1mm5 s ALA 72 Ca 0.04 -1.68 0.03 0.00 0.00 0.00 0.00 51.96 50.35 1mm5 s ALA 72 Cb -0.13 -1.55 -0.02 0.00 0.00 0.00 0.00 23.12 21.41 1mm5 s ALA 72 CO -0.09 -1.20 0.33 -1.64 0.00 0.00 0.00 175.76 173.16 1mm5 s MET 73 N 1.16 1.75 -0.03 0.00 -1.94 -1.09 -0.55 119.30 118.60 1mm5 s MET 73 Ca -0.08 -1.89 -0.00 0.00 -1.71 0.00 0.00 55.69 52.00 1mm5 s MET 73 Cb -0.20 0.36 0.03 0.00 2.01 0.00 0.00 34.83 37.04 1mm5 s MET 73 CO -0.05 -0.67 0.05 0.00 -0.01 0.00 0.00 175.02 174.33 1mm5 s ALA 74 N -3.39 0.02 0.17 3.03 0.00 -0.60 -0.36 121.76 120.64 1mm5 s ALA 74 Ca 0.37 0.37 0.10 0.00 0.00 0.00 0.00 51.96 52.81 1mm5 s ALA 74 Cb 0.02 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.81 1mm5 s ALA 74 CO 0.24 -0.12 -0.20 0.12 0.00 0.00 0.00 175.76 175.80 1mm5 s PHE 75 N 1.10 2.42 -0.05 0.00 5.36 -0.67 -2.56 117.98 123.59 1mm5 s PHE 75 Ca -0.09 -0.31 -0.01 0.00 -0.96 0.00 0.00 56.93 55.56 1mm5 s PHE 75 Cb -0.13 -1.23 -0.04 0.00 -0.34 0.00 0.00 43.02 41.29 1mm5 s PHE 75 CO -0.04 0.46 0.02 0.21 -1.46 0.00 0.00 175.22 174.42 1mm5 s LYS 76 N -2.52 2.97 0.49 10.12 2.47 -1.26 -0.62 119.74 131.40 1mm5 s LYS 76 Ca 0.20 -0.46 0.06 0.00 -1.56 0.00 0.00 55.97 54.21 1mm5 s LYS 76 Cb -0.09 -2.80 0.01 0.00 -1.46 0.00 0.00 37.83 33.49 1mm5 s LYS 76 CO 0.10 0.68 0.35 0.34 0.16 0.00 0.00 175.35 176.98 1mm5 s ASP 77 N -1.23 4.66 0.29 1.43 3.68 -1.22 -5.00 116.67 119.28 1mm5 s ASP 77 Ca 0.17 -1.13 0.26 0.00 2.13 0.00 0.00 52.55 53.98 1mm5 s ASP 77 Cb -0.12 0.06 0.88 0.00 -1.45 0.00 0.00 42.92 42.29 1mm5 s ASP 77 CO 0.07 -0.91 1.76 0.28 0.13 0.00 0.00 175.17 176.49 1mm5 h SER 78 N 0.94 0.00 -0.39 -0.34 0.02 -2.00 -2.99 113.55 108.78 1mm5 h SER 78 Ca -0.39 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.56 1mm5 h SER 78 Cb 1.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.83 1mm5 h SER 78 CO 0.60 0.00 0.00 0.79 -1.14 0.00 0.00 176.83 177.08 1mm5 n TRP 79 N -2.43 1.18 -2.91 3.45 7.02 -1.26 -4.97 117.44 117.52 1mm5 n TRP 79 Ca 0.04 -0.43 -0.07 0.00 -1.02 0.00 0.00 57.50 56.01 1mm5 n TRP 79 Cb 0.36 -0.28 0.01 0.00 -2.42 0.00 0.00 31.31 28.97 1mm5 n TRP 79 CO 0.00 0.00 0.00 -1.71 -2.02 0.00 0.00 177.69 173.96 1mm5 n ASN 80 N 0.51 -7.58 -3.75 -0.99 2.85 -1.13 -5.05 115.26 100.12 1mm5 n ASN 80 Ca 0.17 0.81 -0.04 0.00 -0.11 0.00 0.00 54.58 55.42 1mm5 n ASN 80 Cb 0.75 -4.54 -0.01 0.00 1.24 0.00 0.00 39.78 37.22 1mm5 n ASN 80 CO 0.00 0.00 0.00 -0.54 -2.11 0.00 0.00 177.26 174.61 1mm5 s LYS 81 N -2.01 1.33 -0.25 1.20 -0.14 -1.26 -4.99 119.74 113.62 1mm5 s LYS 81 Ca 0.14 -0.74 -0.01 0.00 -1.36 0.00 0.00 55.97 53.99 1mm5 s LYS 81 Cb -0.03 0.45 0.03 0.00 -1.68 0.00 0.00 37.83 36.60 1mm5 s LYS 81 CO 0.70 -0.61 -0.06 -1.58 -0.76 0.00 0.00 175.35 173.04 1mm5 s TRP 82 N -3.36 3.07 -0.54 3.18 0.51 -1.26 -3.37 118.94 117.17 1mm5 s TRP 82 Ca 0.12 -1.59 -0.13 0.00 -2.12 0.00 0.00 56.10 52.39 1mm5 s TRP 82 Cb -0.02 -2.05 0.13 0.00 -0.81 0.00 0.00 33.47 30.72 1mm5 s TRP 82 CO 0.03 -0.74 0.46 -1.21 -0.51 0.00 0.00 176.95 174.99 1mm5 s GLU 83 N 1.32 2.82 0.60 4.98 0.41 0.21 -4.93 118.70 124.11 1mm5 s GLU 83 Ca -0.00 -1.82 -0.18 0.00 -0.41 0.00 0.00 54.97 52.56 1mm5 s GLU 83 Cb -0.17 -4.15 -0.03 0.00 -1.78 0.00 0.00 34.13 28.00 1mm5 s GLU 83 CO -0.04 -1.27 1.16 -1.25 -0.49 0.00 0.00 175.26 173.36 1mm5 s PRO 84 N 1.34 3.01 -0.03 0.39 0.04 -1.26 -1.67 135.00 136.83 1mm5 s PRO 84 Ca 0.06 1.64 0.07 0.00 0.04 0.00 0.00 61.00 62.80 1mm5 s PRO 84 Cb -0.27 -1.96 -0.01 0.00 0.04 0.00 0.00 34.50 32.30 1mm5 s PRO 84 CO 0.00 -1.13 -0.23 0.42 0.04 0.00 0.00 177.00 176.11 1mm5 s ILE 85 N -1.86 1.84 -0.08 0.56 -1.09 0.52 -2.62 121.20 118.46 1mm5 s ILE 85 Ca 0.73 -0.98 -0.02 0.00 -2.23 0.00 0.00 60.65 58.15 1mm5 s ILE 85 Cb -0.25 -1.54 0.04 0.00 -1.58 0.00 0.00 42.46 39.13 1mm5 s ILE 85 CO 0.33 0.52 0.04 0.00 -1.23 0.00 0.00 174.94 174.60 1mm5 s ALA 86 N -0.41 0.50 0.15 9.38 0.00 -1.06 -2.68 121.76 127.63 1mm5 s ALA 86 Ca 0.05 -0.07 0.08 0.00 0.00 0.00 0.00 51.96 52.02 1mm5 s ALA 86 Cb -0.10 -0.77 -0.04 0.00 0.00 0.00 0.00 23.12 22.21 1mm5 s ALA 86 CO 0.00 -0.63 -0.08 0.20 0.00 0.00 0.00 175.76 175.25 1mm5 s GLY 87 N 2.07 1.75 -0.28 0.00 0.00 -0.53 -1.63 107.32 108.70 1mm5 s GLY 87 Ca 0.04 -1.38 -0.03 0.00 0.00 0.00 0.00 44.72 43.35 1mm5 s GLY 87 CO -0.05 -1.38 0.54 -0.47 0.00 0.00 0.00 173.10 171.74 1mm5 s TYR 88 N -1.53 -1.31 0.11 1.90 5.04 -1.00 -2.66 117.35 117.91 1mm5 s TYR 88 Ca 0.24 1.58 -0.01 0.00 -2.44 0.00 0.00 57.07 56.44 1mm5 s TYR 88 Cb -0.10 0.45 0.00 0.00 0.35 0.00 0.00 41.96 42.66 1mm5 s TYR 88 CO 0.15 -0.77 0.17 0.41 -1.34 0.00 0.00 175.55 174.16 1mm5 n GLY 89 N 5.41 2.71 3.74 8.97 0.00 -1.07 -2.31 105.19 122.64 1mm5 n GLY 89 Ca -0.04 -1.42 -0.35 0.00 0.00 0.00 0.00 46.02 44.20 1mm5 n GLY 89 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1mm5 s TRP 90 N -4.56 3.28 -0.07 1.61 -0.00 -0.82 -2.31 118.94 116.07 1mm5 s TRP 90 Ca 0.09 0.28 -0.04 0.00 -0.00 0.00 0.00 56.10 56.43 1mm5 s TRP 90 Cb -0.00 -1.83 0.03 0.00 -0.00 0.00 0.00 33.47 31.67 1mm5 s TRP 90 CO 0.06 0.54 0.17 -2.00 -0.00 0.00 0.00 176.95 175.73 1mm5 s GLU 91 N -0.94 0.15 0.09 5.86 2.12 -0.73 -1.68 118.70 123.57 1mm5 s GLU 91 Ca 0.14 0.34 -0.19 0.00 0.36 0.00 0.00 54.97 55.62 1mm5 s GLU 91 Cb -0.12 -0.06 -0.07 0.00 0.26 0.00 0.00 34.13 34.14 1mm5 s GLU 91 CO 0.03 -0.11 0.57 -1.12 -0.54 0.00 0.00 175.26 174.09 1mm5 s SER 92 N 0.76 7.04 -0.12 -1.70 0.01 0.42 -2.15 113.70 117.95 1mm5 s SER 92 Ca -0.06 1.25 -0.08 0.00 1.31 0.00 0.00 55.95 58.37 1mm5 s SER 92 Cb -0.07 -2.35 -0.04 0.00 0.21 0.00 0.00 66.02 63.76 1mm5 s SER 92 CO -0.04 0.24 0.16 -0.89 0.41 0.00 0.00 173.24 173.12 1mm5 s THR 93 N -1.17 5.47 -0.12 1.44 2.01 -1.26 -2.59 115.64 119.42 1mm5 s THR 93 Ca 0.31 0.25 -0.04 0.00 0.31 0.00 0.00 61.69 62.51 1mm5 s THR 93 Cb -0.19 -3.43 0.06 0.00 0.01 0.00 0.00 72.50 68.95 1mm5 s THR 93 CO 0.19 0.59 0.24 0.26 -0.69 0.00 0.00 174.62 175.21 1mm5 s TRP 94 N -0.84 -0.35 0.00 4.92 0.52 0.45 -4.97 118.94 118.67 1mm5 s TRP 94 Ca 0.15 0.86 0.03 0.00 0.02 0.00 0.00 56.10 57.16 1mm5 s TRP 94 Cb -0.12 -0.07 -0.01 0.00 -1.15 0.00 0.00 33.47 32.11 1mm5 s TRP 94 CO 0.04 -0.32 -0.11 1.03 0.02 0.00 0.00 176.95 177.62 1mm5 s ARG 95 N 2.21 0.81 0.80 4.98 0.52 -1.26 -1.52 118.95 125.49 1mm5 s ARG 95 Ca -0.00 -0.46 -0.12 0.00 -0.52 0.00 0.00 55.73 54.63 1mm5 s ARG 95 Cb -0.12 -0.77 0.18 0.00 0.52 0.00 0.00 34.95 34.76 1mm5 s ARG 95 CO -0.08 0.21 0.41 -2.30 0.02 0.00 0.00 175.30 173.56 1mm5 n PRO 96 N 2.56 -2.21 -0.06 3.54 -0.02 -1.25 -5.00 135.00 132.56 1mm5 n PRO 96 Ca -0.15 -0.69 -0.08 0.00 -2.02 0.00 0.00 63.50 60.56 1mm5 n PRO 96 Cb 0.56 -1.10 -0.05 0.00 -0.02 0.00 0.00 33.50 32.89 1mm5 n PRO 96 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1mm5 n LEU 97 N 0.00 2.96 0.09 2.45 0.00 -1.26 -4.64 117.00 116.60 1mm5 n LEU 97 Ca 0.07 -0.06 -0.07 0.00 0.00 0.00 0.00 56.01 55.95 1mm5 n LEU 97 Cb 0.29 -0.41 0.02 0.00 0.00 0.00 0.00 43.42 43.32 1mm5 n LEU 97 CO 0.19 0.69 0.30 0.00 0.00 0.00 0.00 177.39 178.57 1mm5 h ALA 98 N -0.01 0.60 -2.25 1.96 0.00 -2.05 -3.46 119.26 114.07 1mm5 h ALA 98 Ca -0.26 -0.70 -0.29 0.00 0.00 0.00 0.00 54.91 53.65 1mm5 h ALA 98 Cb 1.40 -0.09 -0.15 0.00 0.00 0.00 0.00 17.79 18.95 1mm5 h ALA 98 CO -0.04 0.92 -0.69 0.34 0.00 0.00 0.00 179.25 179.78 1mm5 s ASP 99 N -6.88 1.43 -0.12 0.00 3.68 -1.26 -5.06 116.67 108.45 1mm5 s ASP 99 Ca -0.02 -1.09 0.14 0.00 2.13 0.00 0.00 52.55 53.71 1mm5 s ASP 99 Cb 0.11 0.06 0.29 0.00 -1.45 0.00 0.00 42.92 41.93 1mm5 s ASP 99 CO 0.81 -0.47 1.15 -0.62 0.13 0.00 0.00 175.17 176.17 1mm5 n GLU 100 N -0.20 1.05 -0.12 4.34 1.02 -1.26 -3.84 120.64 121.64 1mm5 n GLU 100 Ca -0.09 -2.48 -0.23 0.00 -0.02 0.00 0.00 57.16 54.33 1mm5 n GLU 100 Cb 0.62 -1.24 -0.10 0.00 -0.02 0.00 0.00 31.44 30.69 1mm5 n GLU 100 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1mm5 n ASN 101 N -0.96 1.90 -4.55 1.62 5.03 -1.26 -4.81 115.26 112.23 1mm5 n ASN 101 Ca 0.13 0.40 -0.34 0.00 0.87 0.00 0.00 54.58 55.64 1mm5 n ASN 101 Cb 0.71 -0.90 -0.03 0.00 -1.02 0.00 0.00 39.78 38.54 1mm5 n ASN 101 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 1mm5 s PHE 102 N -2.43 1.17 0.19 3.10 0.08 -1.26 -3.75 117.98 115.07 1mm5 s PHE 102 Ca -0.32 1.49 -0.26 0.00 0.12 0.00 0.00 56.93 57.96 1mm5 s PHE 102 Cb 0.09 -3.64 -0.08 0.00 -0.57 0.00 0.00 43.02 38.82 1mm5 s PHE 102 CO 0.52 -2.40 0.82 -1.01 -0.10 0.00 0.00 175.22 173.05 1mm5 s HIS 103 N 12.02 3.91 -0.02 0.36 3.76 -0.39 -4.24 115.29 130.69 1mm5 s HIS 103 Ca 0.93 1.70 -0.02 0.00 -0.15 0.00 0.00 55.06 57.52 1mm5 s HIS 103 Cb -0.16 -2.82 0.00 0.00 1.11 0.00 0.00 32.58 30.72 1mm5 s HIS 103 CO 0.23 0.49 0.05 -0.51 -0.85 0.00 0.00 174.74 174.15 1mm5 s LEU 104 N -1.21 1.81 -0.26 0.89 1.43 -0.58 -2.51 118.68 118.25 1mm5 s LEU 104 Ca 0.38 0.06 -0.27 0.00 -1.03 0.00 0.00 54.13 53.27 1mm5 s LEU 104 Cb -0.23 0.20 0.16 0.00 0.03 0.00 0.00 46.19 46.34 1mm5 s LEU 104 CO 0.27 -0.05 1.21 -0.83 0.23 0.00 0.00 176.35 177.19 1mm5 s GLY 105 N -0.10 0.02 0.02 -3.19 0.00 -0.59 -0.41 107.32 103.07 1mm5 s GLY 105 Ca -0.01 2.84 -0.01 0.00 0.00 0.00 0.00 44.72 47.53 1mm5 s GLY 105 CO 0.00 1.58 -0.00 1.08 0.00 0.00 0.00 173.10 175.76 1mm5 s LEU 106 N -0.31 2.13 0.00 0.66 1.02 -1.07 -0.83 118.68 120.29 1mm5 s LEU 106 Ca 0.04 -0.47 0.00 0.00 0.02 0.00 0.00 54.13 53.73 1mm5 s LEU 106 Cb -0.03 0.20 0.00 0.00 0.02 0.00 0.00 46.19 46.37 1mm5 s LEU 106 CO -0.08 -0.32 0.00 0.61 0.02 0.00 0.00 176.35 176.58 1mm5 n GLY 107 N 1.53 -1.17 3.24 -3.19 0.00 -0.97 -0.44 105.19 104.20 1mm5 n GLY 107 Ca -0.24 -0.95 -0.25 0.00 0.00 0.00 0.00 46.02 44.59 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 -3.00 1.74 -0.07 1.61 0.40 -0.67 -2.04 117.98 115.95 1mm5 s PHE 108 Ca 0.00 -0.38 0.03 0.00 -0.60 0.00 0.00 56.93 55.98 1mm5 s PHE 108 Cb 0.00 -1.02 -0.02 0.00 0.51 0.00 0.00 43.02 42.48 1mm5 s PHE 108 CO 0.00 0.10 -0.14 0.95 0.70 0.00 0.00 175.22 176.83 1mm5 s THR 109 N -0.87 3.03 -0.13 0.64 -4.23 -1.00 -1.95 115.64 111.13 1mm5 s THR 109 Ca 0.07 -0.72 -0.04 0.00 -1.18 0.00 0.00 61.69 59.82 1mm5 s THR 109 Cb -0.09 -2.21 0.06 0.00 1.34 0.00 0.00 72.50 71.60 1mm5 s THR 109 CO 0.02 0.57 0.13 0.00 -0.54 0.00 0.00 174.62 174.80 1mm5 s ALA 110 N -0.40 0.09 0.00 3.99 0.00 -0.98 -1.37 121.76 123.09 1mm5 s ALA 110 Ca 0.04 0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.14 1mm5 s ALA 110 Cb -0.12 -0.96 0.00 0.00 0.00 0.00 0.00 23.12 22.04 1mm5 s ALA 110 CO 0.02 -0.89 0.00 0.41 0.00 0.00 0.00 175.76 175.30 1mm5 n GLY 111 N 5.30 4.91 3.28 0.00 0.00 -0.42 -2.38 105.19 115.89 1mm5 n GLY 111 Ca -0.05 -0.95 -0.09 0.00 0.00 0.00 0.00 46.02 44.93 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 0.52 0.10 0.20 1.61 -7.23 -0.65 -0.60 120.40 114.36 1mm5 s VAL 112 Ca 0.00 -1.21 0.07 0.00 -1.81 0.00 0.00 61.98 59.03 1mm5 s VAL 112 Cb 0.00 -1.56 -0.05 0.00 0.56 0.00 0.00 36.38 35.33 1mm5 s VAL 112 CO 0.00 -0.45 -0.12 0.28 -0.31 0.00 0.00 175.10 174.50 1mm5 s THR 113 N -3.90 1.59 0.25 5.32 -1.32 -1.01 -2.57 115.64 113.99 1mm5 s THR 113 Ca 0.10 -2.17 -0.30 0.00 -1.21 0.00 0.00 61.69 58.12 1mm5 s THR 113 Cb 0.04 -2.06 -0.10 0.00 -1.51 0.00 0.00 72.50 68.87 1mm5 s THR 113 CO -0.06 -0.58 1.34 0.00 -2.21 0.00 0.00 174.62 173.11 1mm5 s ALA 114 N -3.06 3.54 0.55 11.08 0.00 -1.08 -2.55 121.76 130.25 1mm5 s ALA 114 Ca 0.22 1.20 0.01 0.00 0.00 0.00 0.00 51.96 53.40 1mm5 s ALA 114 Cb 0.01 -3.50 0.03 0.00 0.00 0.00 0.00 23.12 19.66 1mm5 s ALA 114 CO 0.06 -0.61 0.77 0.50 0.00 0.00 0.00 175.76 176.49 1mm5 s ARG 115 N -0.66 2.54 0.32 0.00 3.52 -1.26 -4.92 118.95 118.49 1mm5 s ARG 115 Ca 0.55 -0.79 0.04 0.00 -0.13 0.00 0.00 55.73 55.40 1mm5 s ARG 115 Cb -0.39 -2.49 0.56 0.00 -1.56 0.00 0.00 34.95 31.07 1mm5 s ARG 115 CO 0.43 -0.72 1.84 -0.44 -0.81 0.00 0.00 175.30 175.60 1mm5 h ASP 116 N 0.07 0.48 0.15 -2.12 3.32 -1.95 -2.98 116.42 113.39 1mm5 h ASP 116 Ca -0.42 -0.11 -0.29 0.00 0.02 0.00 0.00 57.03 56.24 1mm5 h ASP 116 Cb 1.30 -0.13 0.03 0.00 0.22 0.00 0.00 39.33 40.75 1mm5 h ASP 116 CO 0.52 0.60 -1.21 0.78 -1.72 0.00 0.00 179.24 178.21 1mm5 h ASN 117 N 0.47 0.81 -3.65 6.45 2.35 -1.95 -3.47 115.58 116.59 1mm5 h ASN 117 Ca 0.09 -0.86 -0.40 0.00 -0.55 0.00 0.00 56.30 54.59 1mm5 h ASN 117 Cb 0.42 -0.26 0.02 0.00 0.05 0.00 0.00 38.32 38.55 1mm5 h ASN 117 CO 0.02 1.59 -0.56 1.87 -1.65 0.00 0.00 177.43 178.70 1mm5 n TRP 118 N -3.85 -1.46 -0.01 1.19 -0.00 -1.13 -4.93 117.44 107.26 1mm5 n TRP 118 Ca -0.14 0.26 -0.01 0.00 -0.00 0.00 0.00 57.50 57.61 1mm5 n TRP 118 Cb 0.97 -4.17 -0.00 0.00 -0.00 0.00 0.00 31.31 28.11 1mm5 n TRP 118 CO 0.00 0.00 0.00 -0.97 -0.00 0.00 0.00 177.69 176.72 1mm5 h ASN 119 N -0.70 0.00 0.00 5.87 -1.24 -1.92 -3.48 115.58 114.11 1mm5 h ASN 119 Ca -0.50 0.00 -0.08 0.00 0.71 0.00 0.00 56.30 56.43 1mm5 h ASN 119 Cb 1.36 0.00 -0.07 0.00 0.73 0.00 0.00 38.32 40.34 1mm5 h ASN 119 CO 0.56 0.13 -0.14 0.00 -1.29 0.00 0.00 177.43 176.69 1mm5 n TYR 120 N -2.65 -0.47 -3.78 0.67 9.36 -1.26 -5.09 117.16 113.94 1mm5 n TYR 120 Ca -0.01 -0.53 -0.30 0.00 3.32 0.00 0.00 57.90 60.38 1mm5 n TYR 120 Cb 0.04 0.68 -0.14 0.00 -0.63 0.00 0.00 39.34 39.30 1mm5 n TYR 120 CO 0.00 0.00 0.00 0.42 0.22 0.00 0.00 176.86 177.50 1mm5 s ILE 121 N 0.03 1.54 0.83 2.97 1.01 -1.26 -5.12 121.20 121.19 1mm5 s ILE 121 Ca 0.02 -2.41 -0.11 0.00 0.00 0.00 0.00 60.65 58.15 1mm5 s ILE 121 Cb 0.10 -2.10 0.09 0.00 0.01 0.00 0.00 42.46 40.56 1mm5 s ILE 121 CO -0.03 -0.81 1.09 -2.16 0.00 0.00 0.00 174.94 173.03 1mm5 s PRO 122 N 0.57 1.81 -0.63 2.79 0.04 -1.26 -4.51 135.00 133.81 1mm5 s PRO 122 Ca 0.15 0.92 -0.02 0.00 0.04 0.00 0.00 61.00 62.09 1mm5 s PRO 122 Cb -0.23 -1.86 0.16 0.00 0.04 0.00 0.00 34.50 32.61 1mm5 s PRO 122 CO -0.05 -1.89 0.44 -0.51 0.04 0.00 0.00 177.00 175.03 1mm5 s LEU 123 N -6.02 5.19 0.32 -3.56 1.43 -1.06 -4.91 118.68 110.08 1mm5 s LEU 123 Ca 0.62 -2.90 -0.27 0.00 -1.03 0.00 0.00 54.13 50.55 1mm5 s LEU 123 Cb -0.17 -1.84 -0.13 0.00 0.03 0.00 0.00 46.19 44.07 1mm5 s LEU 123 CO 0.56 -0.35 0.98 -2.65 0.23 0.00 0.00 176.35 175.11 1mm5 n PRO 124 N 3.42 1.29 -3.67 1.29 -0.02 -1.26 -2.42 135.00 133.64 1mm5 n PRO 124 Ca 0.08 0.46 -0.11 0.00 -2.02 0.00 0.00 63.50 61.91 1mm5 n PRO 124 Cb 0.37 -1.85 -0.11 0.00 -0.02 0.00 0.00 33.50 31.90 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 -0.49 -0.14 -1.45 -7.23 0.23 -4.92 120.40 105.28 1mm5 s VAL 125 Ca 0.60 0.21 0.01 0.00 -1.81 0.00 0.00 61.98 60.99 1mm5 s VAL 125 Cb -0.67 -0.56 0.02 0.00 0.56 0.00 0.00 36.38 35.72 1mm5 s VAL 125 CO 0.59 0.09 -0.17 -1.48 -0.31 0.00 0.00 175.10 173.82 1mm5 s LEU 126 N 2.40 1.86 -0.13 1.32 2.34 -1.26 -1.30 118.68 123.92 1mm5 s LEU 126 Ca -0.01 -0.52 -0.07 0.00 0.06 0.00 0.00 54.13 53.59 1mm5 s LEU 126 Cb -0.12 -1.25 0.05 0.00 -0.56 0.00 0.00 46.19 44.31 1mm5 s LEU 126 CO -0.11 0.01 0.31 -0.76 -1.06 0.00 0.00 176.35 174.74 1mm5 s LEU 127 N 1.10 0.19 0.49 1.48 1.02 -0.47 -5.01 118.68 117.49 1mm5 s LEU 127 Ca -0.02 0.67 -0.20 0.00 0.02 0.00 0.00 54.13 54.59 1mm5 s LEU 127 Cb -0.14 0.96 -0.08 0.00 0.02 0.00 0.00 46.19 46.95 1mm5 s LEU 127 CO -0.05 -0.18 1.04 -2.16 0.02 0.00 0.00 176.35 175.02 1mm5 s PRO 128 N 1.37 3.76 0.21 1.29 0.04 -1.26 -2.37 135.00 138.03 1mm5 s PRO 128 Ca -0.09 1.37 -0.23 0.00 0.04 0.00 0.00 61.00 62.09 1mm5 s PRO 128 Cb -0.10 -2.09 0.06 0.00 0.04 0.00 0.00 34.50 32.42 1mm5 s PRO 128 CO -0.10 -0.47 0.94 -0.48 0.04 0.00 0.00 177.00 176.93 1mm5 s LEU 129 N -3.54 -0.11 0.18 -3.56 0.05 -0.86 -2.52 118.68 108.31 1mm5 s LEU 129 Ca 0.67 -0.60 -0.08 0.00 0.05 0.00 0.00 54.13 54.17 1mm5 s LEU 129 Cb -0.17 2.29 -0.01 0.00 -2.05 0.00 0.00 46.19 46.25 1mm5 s LEU 129 CO 0.21 -1.08 0.28 0.00 -0.55 0.00 0.00 176.35 175.21 1mm5 s ALA 130 N -2.90 0.12 -0.11 1.48 0.00 -0.66 -2.28 121.76 117.41 1mm5 s ALA 130 Ca 0.15 -0.99 0.01 0.00 0.00 0.00 0.00 51.96 51.13 1mm5 s ALA 130 Cb -0.03 0.94 0.02 0.00 0.00 0.00 0.00 23.12 24.05 1mm5 s ALA 130 CO 0.05 -0.66 -0.12 0.45 0.00 0.00 0.00 175.76 175.48 1mm5 s SER 131 N -3.00 2.24 -0.09 0.00 0.15 -0.01 -2.57 113.70 110.42 1mm5 s SER 131 Ca 0.20 -0.36 -0.04 0.00 0.70 0.00 0.00 55.95 56.45 1mm5 s SER 131 Cb 0.03 -0.95 0.05 0.00 -1.71 0.00 0.00 66.02 63.44 1mm5 s SER 131 CO 0.02 -0.04 0.20 0.68 1.20 0.00 0.00 173.24 175.30 1mm5 s VAL 132 N 1.28 -0.13 0.00 4.45 -7.23 0.37 -1.54 120.40 117.60 1mm5 s VAL 132 Ca -0.02 0.21 0.00 0.00 -1.81 0.00 0.00 61.98 60.36 1mm5 s VAL 132 Cb -0.14 -0.33 0.00 0.00 0.56 0.00 0.00 36.38 36.47 1mm5 s VAL 132 CO -0.05 0.09 0.00 0.61 -0.31 0.00 0.00 175.10 175.44 1mm5 n GLY 133 N 4.54 1.70 3.59 2.32 0.00 -1.05 -0.44 105.19 115.85 1mm5 n GLY 133 Ca -0.20 -0.27 -0.01 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.76 -0.51 0.00 1.61 1.13 0.45 -1.26 117.35 118.01 1mm5 s TYR 134 Ca 0.00 0.98 0.00 0.00 -1.41 0.00 0.00 57.07 56.64 1mm5 s TYR 134 Cb 0.00 0.30 0.00 0.00 -1.10 0.00 0.00 41.96 41.16 1mm5 s TYR 134 CO 0.00 -0.25 0.00 0.41 -2.51 0.00 0.00 175.55 173.20 1mm5 n GLY 135 N 3.86 2.21 0.22 5.49 0.00 -1.25 -2.60 105.19 113.13 1mm5 n GLY 135 Ca -0.16 -0.39 0.03 0.00 0.00 0.00 0.00 46.02 45.50 1mm5 n GLY 135 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mm5 n PRO 136 N 13.19 1.28 -4.00 1.61 -0.04 -1.26 -4.67 135.00 141.12 1mm5 n PRO 136 Ca 0.00 -0.44 -0.31 0.00 -0.04 0.00 0.00 63.50 62.71 1mm5 n PRO 136 Cb 0.00 -1.12 -0.15 0.00 -0.04 0.00 0.00 33.50 32.19 1mm5 n PRO 136 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1mm5 s VAL 137 N -1.85 1.93 -0.21 0.52 -7.23 -1.07 -4.69 120.40 107.80 1mm5 s VAL 137 Ca 0.11 -1.69 0.00 0.00 -1.81 0.00 0.00 61.98 58.59 1mm5 s VAL 137 Cb 0.05 -2.21 0.03 0.00 0.56 0.00 0.00 36.38 34.81 1mm5 s VAL 137 CO 0.08 -0.25 -0.14 -0.89 -0.31 0.00 0.00 175.10 173.59 1mm5 s THR 138 N 1.17 2.35 0.10 5.32 2.01 -0.90 -0.42 115.64 125.27 1mm5 s THR 138 Ca -0.01 -1.05 -0.15 0.00 0.31 0.00 0.00 61.69 60.78 1mm5 s THR 138 Cb -0.19 -2.12 -0.07 0.00 0.01 0.00 0.00 72.50 70.14 1mm5 s THR 138 CO -0.08 0.35 0.52 -0.36 -0.69 0.00 0.00 174.62 174.37 1mm5 s PHE 139 N 1.28 3.68 0.01 4.92 0.08 0.42 -0.50 117.98 127.88 1mm5 s PHE 139 Ca 0.01 1.09 0.05 0.00 0.12 0.00 0.00 56.93 58.20 1mm5 s PHE 139 Cb -0.15 -2.38 -0.02 0.00 -0.57 0.00 0.00 43.02 39.90 1mm5 s PHE 139 CO -0.09 0.52 -0.14 -1.14 -0.10 0.00 0.00 175.22 174.27 1mm5 s GLN 140 N -1.57 1.04 0.03 0.44 0.74 0.13 -0.48 119.66 120.00 1mm5 s GLN 140 Ca 0.33 -0.62 0.03 0.00 0.05 0.00 0.00 55.36 55.14 1mm5 s GLN 140 Cb -0.16 -1.03 -0.02 0.00 1.10 0.00 0.00 33.01 32.90 1mm5 s GLN 140 CO 0.18 0.27 -0.09 0.00 -0.55 0.00 0.00 175.29 175.10 1mm5 s MET 141 N -0.71 0.63 0.02 1.67 0.23 -1.06 -0.47 119.30 119.61 1mm5 s MET 141 Ca 0.04 -0.66 0.01 0.00 -1.03 0.00 0.00 55.69 54.05 1mm5 s MET 141 Cb -0.06 -0.53 -0.01 0.00 -1.53 0.00 0.00 34.83 32.69 1mm5 s MET 141 CO 0.00 0.12 -0.04 0.99 -2.03 0.00 0.00 175.02 174.06 1mm5 s THR 142 N -0.98 0.25 0.08 3.16 2.01 0.23 -1.65 115.64 118.73 1mm5 s THR 142 Ca -0.04 -0.67 0.04 0.00 0.31 0.00 0.00 61.69 61.34 1mm5 s THR 142 Cb -0.08 -0.31 -0.04 0.00 0.01 0.00 0.00 72.50 72.08 1mm5 s THR 142 CO 0.01 -0.27 -0.01 -0.47 -0.69 0.00 0.00 174.62 173.18 1mm5 s TYR 143 N -0.94 2.98 -0.41 4.92 6.14 -1.05 -1.73 117.35 127.26 1mm5 s TYR 143 Ca -0.08 -0.02 0.02 0.00 0.64 0.00 0.00 57.07 57.62 1mm5 s TYR 143 Cb -0.07 -1.55 0.13 0.00 0.42 0.00 0.00 41.96 40.89 1mm5 s TYR 143 CO -0.00 0.47 0.21 0.42 0.64 0.00 0.00 175.55 177.28 1mm5 s ILE 144 N -1.27 1.29 0.31 3.14 1.09 -0.90 -4.39 121.20 120.47 1mm5 s ILE 144 Ca 0.24 -2.31 -0.29 0.00 -1.10 0.00 0.00 60.65 57.19 1mm5 s ILE 144 Cb -0.12 -1.91 -0.10 0.00 -1.06 0.00 0.00 42.46 39.27 1mm5 s ILE 144 CO 0.17 -0.85 1.22 -2.16 -0.10 0.00 0.00 174.94 173.22 1mm5 s PRO 145 N 0.62 4.47 0.00 2.79 0.04 -1.26 -0.37 135.00 141.29 1mm5 s PRO 145 Ca 0.16 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.24 1mm5 s PRO 145 Cb -0.23 -3.12 0.00 0.00 0.04 0.00 0.00 34.50 31.19 1mm5 s PRO 145 CO -0.04 -0.03 0.00 0.41 0.04 0.00 0.00 177.00 177.38 1mm5 n GLY 146 N 1.00 2.01 3.50 0.56 0.00 -1.26 -4.67 105.19 106.33 1mm5 n GLY 146 Ca -0.00 0.07 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.22 4.14 -3.70 2.61 -1.04 -1.26 -3.63 114.28 111.18 1mm5 n THR 147 Ca 0.00 -4.50 -0.04 0.00 -2.04 0.00 0.00 64.05 57.47 1mm5 n THR 147 Cb 0.00 -2.42 -0.01 0.00 -1.82 0.00 0.00 70.33 66.07 1mm5 n THR 147 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1mm5 s TYR 148 N 2.50 -0.15 0.16 -1.42 2.02 -1.26 -4.97 117.35 114.23 1mm5 s TYR 148 Ca 0.47 -0.10 -0.15 0.00 -0.37 0.00 0.00 57.07 56.92 1mm5 s TYR 148 Cb -0.00 0.61 0.05 0.00 -0.40 0.00 0.00 41.96 42.22 1mm5 s TYR 148 CO 0.03 -0.72 1.81 -0.91 -1.57 0.00 0.00 175.55 174.19 1mm5 h ASN 149 N 2.00 0.58 1.29 2.29 4.21 -2.01 -2.44 115.58 121.51 1mm5 h ASN 149 Ca -0.24 -0.04 -0.09 0.00 1.21 0.00 0.00 56.30 57.13 1mm5 h ASN 149 Cb 1.23 -0.15 -0.01 0.00 -1.12 0.00 0.00 38.32 38.27 1mm5 h ASN 149 CO 0.26 0.45 -0.44 0.78 -1.29 0.00 0.00 177.43 177.20 1mm5 h ASN 150 N 0.66 0.00 -3.65 5.81 2.35 -1.94 -3.46 115.58 115.35 1mm5 h ASN 150 Ca 0.18 0.00 -0.44 0.00 -0.55 0.00 0.00 56.30 55.49 1mm5 h ASN 150 Cb -0.03 0.00 0.18 0.00 0.05 0.00 0.00 38.32 38.52 1mm5 h ASN 150 CO -0.04 0.44 0.13 -0.83 -1.65 0.00 0.00 177.43 175.49 1mm5 s GLY 151 N -4.42 1.55 -0.62 2.83 0.00 -0.92 -4.49 107.32 101.25 1mm5 s GLY 151 Ca 0.03 -0.39 -0.06 0.00 0.00 0.00 0.00 44.72 44.30 1mm5 s GLY 151 CO 0.72 0.29 0.66 -2.01 0.00 0.00 0.00 173.10 172.77 1mm5 n ASN 152 N -4.47 -7.84 -4.15 1.64 2.85 0.50 -4.77 115.26 99.02 1mm5 n ASN 152 Ca 0.05 0.15 -0.11 0.00 -0.11 0.00 0.00 54.58 54.56 1mm5 n ASN 152 Cb 0.57 -5.31 -0.10 0.00 1.24 0.00 0.00 39.78 36.17 1mm5 n ASN 152 CO 0.00 0.00 0.00 -0.69 -2.11 0.00 0.00 177.26 174.46 1mm5 s VAL 153 N -2.85 0.66 -0.21 3.44 1.01 -1.18 -4.97 120.40 116.29 1mm5 s VAL 153 Ca 0.10 -1.83 0.00 0.00 0.00 0.00 0.00 61.98 60.25 1mm5 s VAL 153 Cb -0.03 -1.55 0.03 0.00 0.00 0.00 0.00 36.38 34.83 1mm5 s VAL 153 CO 0.76 -0.82 -0.14 -0.47 0.00 0.00 0.00 175.10 174.43 1mm5 s TYR 154 N -3.37 2.95 -0.12 5.22 6.14 -1.26 -2.11 117.35 124.79 1mm5 s TYR 154 Ca 0.09 -1.70 -0.03 0.00 0.64 0.00 0.00 57.07 56.07 1mm5 s TYR 154 Cb 0.04 -1.97 -0.03 0.00 0.42 0.00 0.00 41.96 40.42 1mm5 s TYR 154 CO -0.04 -0.79 -0.01 -0.06 0.64 0.00 0.00 175.55 175.29 1mm5 s PHE 155 N 1.28 3.10 -0.00 4.97 0.40 -0.70 -4.37 117.98 122.65 1mm5 s PHE 155 Ca 0.01 -0.03 0.04 0.00 -0.60 0.00 0.00 56.93 56.35 1mm5 s PHE 155 Cb -0.15 -1.88 -0.03 0.00 0.51 0.00 0.00 43.02 41.46 1mm5 s PHE 155 CO -0.09 0.22 -0.09 0.00 0.70 0.00 0.00 175.22 175.96 1mm5 s ALA 156 N -0.23 2.93 0.01 5.36 0.00 -0.74 -0.60 121.76 128.49 1mm5 s ALA 156 Ca 0.05 -1.03 0.01 0.00 0.00 0.00 0.00 51.96 50.99 1mm5 s ALA 156 Cb -0.13 -1.08 -0.01 0.00 0.00 0.00 0.00 23.12 21.91 1mm5 s ALA 156 CO 0.02 0.60 -0.04 -1.58 0.00 0.00 0.00 175.76 174.76 1mm5 s TRP 157 N -0.95 0.37 0.02 0.00 0.52 0.37 -2.67 118.94 116.61 1mm5 s TRP 157 Ca 0.16 -0.24 -0.20 0.00 0.02 0.00 0.00 56.10 55.83 1mm5 s TRP 157 Cb -0.11 -0.24 -0.06 0.00 -1.15 0.00 0.00 33.47 31.92 1mm5 s TRP 157 CO 0.06 -0.06 0.59 -1.64 0.02 0.00 0.00 176.95 175.92 1mm5 s MET 158 N -0.68 4.28 0.02 4.98 -1.94 0.39 -0.70 119.30 125.65 1mm5 s MET 158 Ca -0.04 0.73 0.05 0.00 -1.71 0.00 0.00 55.69 54.72 1mm5 s MET 158 Cb -0.05 -3.31 -0.02 0.00 2.01 0.00 0.00 34.83 33.46 1mm5 s MET 158 CO -0.00 0.46 -0.15 0.50 -0.01 0.00 0.00 175.02 175.81 1mm5 s ARG 159 N -0.49 1.09 0.07 2.03 3.52 0.35 -2.25 118.95 123.27 1mm5 s ARG 159 Ca 0.30 -0.71 0.09 0.00 -0.13 0.00 0.00 55.73 55.28 1mm5 s ARG 159 Cb -0.19 -1.10 -0.03 0.00 -1.56 0.00 0.00 34.95 32.07 1mm5 s ARG 159 CO 0.18 0.28 -0.24 0.12 -0.81 0.00 0.00 175.30 174.83 1mm5 s PHE 160 N -0.67 2.06 -0.16 5.12 2.19 -1.07 -2.12 117.98 123.33 1mm5 s PHE 160 Ca 0.04 -0.39 -0.01 0.00 0.33 0.00 0.00 56.93 56.89 1mm5 s PHE 160 Cb -0.07 -1.19 -0.01 0.00 -1.31 0.00 0.00 43.02 40.44 1mm5 s PHE 160 CO 0.01 0.17 -0.12 -1.14 1.83 0.00 0.00 175.22 175.97 1mm5 s GLN 161 N -1.49 3.33 -0.13 10.12 0.74 -1.26 -1.50 119.66 129.47 1mm5 s GLN 161 Ca 0.10 -0.69 -0.02 0.00 0.05 0.00 0.00 55.36 54.80 1mm5 s GLN 161 Cb -0.10 -2.72 0.04 0.00 1.10 0.00 0.00 33.01 31.34 1mm5 s GLN 161 CO 0.03 0.05 0.02 -0.06 -0.55 0.00 0.00 175.29 174.78 1mm5 s PHE 162 N 0.77 0.80 0.07 1.67 0.08 0.45 -4.94 117.98 116.87 1mm5 s PHE 162 Ca -0.05 -0.48 0.04 0.00 0.12 0.00 0.00 56.93 56.56 1mm5 s PHE 162 Cb -0.15 -0.90 -0.04 0.00 -0.57 0.00 0.00 43.02 41.36 1mm5 s PHE 162 CO 0.01 -0.46 -0.01 -0.51 -0.10 0.00 0.00 175.22 174.15 1mm5 s LEU 163 N 1.93 3.45 0.26 -0.37 1.02 -1.26 -1.01 118.68 122.69 1mm5 s LEU 163 Ca 0.02 -0.14 -0.03 0.00 0.02 0.00 0.00 54.13 54.00 1mm5 s LEU 163 Cb -0.15 -2.13 0.33 0.00 0.02 0.00 0.00 46.19 44.26 1mm5 s LEU 163 CO -0.07 0.20 1.77 -0.08 0.02 0.00 0.00 176.35 178.20 1mm5 h GLU 164 N 3.70 0.85 -7.09 1.70 4.22 -1.98 -3.44 114.58 112.54 1mm5 h GLU 164 Ca -0.48 -0.21 -0.55 0.00 0.08 0.00 0.00 59.36 58.20 1mm5 h GLU 164 Cb 1.17 -0.11 0.15 0.00 0.50 0.00 0.00 28.75 30.45 1mm5 h GLU 164 CO 0.59 0.81 0.55 -1.58 -2.18 0.00 0.00 179.01 177.19 1mm5 s HIS 165 N -5.10 2.17 0.46 0.92 2.46 -1.26 -4.76 115.29 110.18 1mm5 s HIS 165 Ca -0.10 1.45 0.00 0.00 0.47 0.00 0.00 55.06 56.88 1mm5 s HIS 165 Cb 0.15 -3.72 0.00 0.00 -0.13 0.00 0.00 32.58 28.88 1mm5 s HIS 165 CO 0.81 -2.88 0.00 1.58 -2.47 0.00 0.00 174.74 171.79 1mm5 n HIS 166 N -1.58 -3.68 -2.57 3.88 -0.00 -1.26 -4.92 115.22 105.10 1mm5 n HIS 166 Ca 0.14 1.92 -0.03 0.00 -0.00 0.00 0.00 57.72 59.75 1mm5 n HIS 166 Cb 0.47 -3.35 0.10 0.00 -0.00 0.00 0.00 29.99 27.21 1mm5 n HIS 166 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1mm5 n HIS 167 N -4.27 -1.70 -1.74 1.57 -0.00 -1.26 -5.03 115.22 102.78 1mm5 n HIS 167 Ca -0.03 -1.48 -0.42 0.00 0.46 0.00 0.00 57.72 56.25 1mm5 n HIS 167 Cb 0.66 1.38 -0.03 0.00 -0.12 0.00 0.00 29.99 31.88 1mm5 n HIS 167 CO 0.00 0.00 0.00 -3.38 0.46 0.00 0.00 176.34 173.42 1mm5 s HIS 168 N 0.11 2.34 0.14 1.57 -3.43 -1.26 -4.72 115.29 110.04 1mm5 s HIS 168 Ca 0.07 0.10 0.00 0.00 -0.80 0.00 0.00 55.06 54.43 1mm5 s HIS 168 Cb 0.37 -4.15 0.00 0.00 -1.43 0.00 0.00 32.58 27.37 1mm5 s HIS 168 CO -0.11 -4.63 0.00 1.58 -2.00 0.00 0.00 174.74 169.58 1mm5 n HIS 169 N 5.29 -2.64 1.59 0.38 -0.00 -1.26 -5.24 115.22 113.35 1mm5 n HIS 169 Ca 0.17 0.73 0.14 0.00 -0.00 0.00 0.00 57.72 58.77 1mm5 n HIS 169 Cb 0.38 -1.20 0.61 0.00 -0.00 0.00 0.00 29.99 29.78 1mm5 n HIS 169 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92