#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 3.38 0.02 7.83 3.02 -1.26 -4.63 115.26 123.62 1mm5 n ASN 2 Ca 0.00 -3.75 -0.08 0.00 -0.03 0.00 0.00 54.58 50.72 1mm5 n ASN 2 Cb 0.00 -0.69 -0.06 0.00 -0.61 0.00 0.00 39.78 38.42 1mm5 n ASN 2 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mm5 h ALA 3 N 1.18 -0.17 0.00 5.41 0.00 -2.06 -2.81 119.26 120.81 1mm5 h ALA 3 Ca 0.37 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.93 1mm5 h ALA 3 Cb 1.86 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 19.69 1mm5 h ALA 3 CO 0.69 -0.19 -0.72 -0.44 0.00 0.00 0.00 179.25 178.59 1mm5 h ASP 4 N -0.97 0.00 -0.60 0.00 3.32 -2.01 -3.21 116.42 112.95 1mm5 h ASP 4 Ca -0.02 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.96 1mm5 h ASP 4 Cb 0.44 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.96 1mm5 h ASP 4 CO 0.03 0.72 0.08 -0.33 -1.72 0.00 0.00 179.24 178.02 1mm5 h GLU 5 N 0.00 1.03 -0.78 3.56 4.39 -1.82 -2.49 114.58 118.46 1mm5 h GLU 5 Ca -0.01 -0.27 -0.03 0.00 0.34 0.00 0.00 59.36 59.39 1mm5 h GLU 5 Cb 1.36 -0.12 -0.04 0.00 -0.10 0.00 0.00 28.75 29.85 1mm5 h GLU 5 CO 0.09 0.96 0.37 2.35 -1.16 0.00 0.00 179.01 181.62 1mm5 h TRP 6 N 0.96 1.13 -0.66 4.33 2.91 -1.50 -2.53 115.95 120.61 1mm5 h TRP 6 Ca 0.19 -0.06 -0.07 0.00 1.13 0.00 0.00 58.89 60.08 1mm5 h TRP 6 Cb 0.44 -0.35 -0.03 0.00 -0.51 0.00 0.00 29.16 28.71 1mm5 h TRP 6 CO 0.03 0.83 0.15 0.52 -1.03 0.00 0.00 178.44 178.94 1mm5 h MET 7 N 1.11 1.04 -0.16 2.65 0.00 -1.55 -2.41 114.93 115.62 1mm5 h MET 7 Ca 0.27 -0.25 -0.03 0.00 0.00 0.00 0.00 59.70 59.69 1mm5 h MET 7 Cb 0.13 -0.14 -0.01 0.00 0.00 0.00 0.00 31.60 31.58 1mm5 h MET 7 CO -0.03 0.93 -0.06 1.15 0.00 0.00 0.00 176.91 178.90 1mm5 h THR 8 N 0.99 1.14 -0.19 2.22 2.02 -1.08 0.40 112.91 118.41 1mm5 h THR 8 Ca 0.21 -0.59 -0.19 0.00 0.77 0.00 0.00 66.41 66.61 1mm5 h THR 8 Cb 0.37 1.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.87 1mm5 h THR 8 CO 0.00 0.19 -0.64 0.74 0.37 0.00 0.00 175.52 176.18 1mm5 h THR 9 N 0.23 1.30 -0.08 3.16 2.02 -1.04 -2.73 112.91 115.77 1mm5 h THR 9 Ca 0.05 -1.88 -0.16 0.00 0.77 0.00 0.00 66.41 65.18 1mm5 h THR 9 Cb 0.26 1.84 0.01 0.00 -1.74 0.00 0.00 68.15 68.52 1mm5 h THR 9 CO 0.01 0.59 -0.59 -0.26 0.37 0.00 0.00 175.52 175.64 1mm5 h PHE 10 N 0.50 0.75 -0.12 3.16 -1.00 -1.03 -3.11 116.94 116.09 1mm5 h PHE 10 Ca -0.01 -0.35 0.01 0.00 2.81 0.00 0.00 57.97 60.43 1mm5 h PHE 10 Cb 1.23 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 40.68 1mm5 h PHE 10 CO 0.06 1.15 0.08 0.00 -1.61 0.00 0.00 178.31 178.00 1mm5 h ARG 11 N 0.14 0.13 -0.04 1.51 2.47 -0.98 -0.60 114.38 117.00 1mm5 h ARG 11 Ca -0.05 -0.01 -0.13 0.00 -1.26 0.00 0.00 59.98 58.53 1mm5 h ARG 11 Cb 1.25 -0.03 -0.01 0.00 -1.65 0.00 0.00 29.97 29.53 1mm5 h ARG 11 CO 0.12 0.08 -0.56 1.49 0.56 0.00 0.00 179.97 181.66 1mm5 h GLU 12 N 0.13 0.12 0.05 0.04 4.57 -1.46 0.12 114.58 118.15 1mm5 h GLU 12 Ca 0.05 -0.08 -0.10 0.00 -1.18 0.00 0.00 59.36 58.05 1mm5 h GLU 12 Cb 0.04 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 28.65 1mm5 h GLU 12 CO -0.01 0.65 -0.44 -0.97 -1.18 0.00 0.00 179.01 177.06 1mm5 h ASN 13 N 0.09 0.30 -0.15 1.04 -1.24 -1.10 -2.83 115.58 111.69 1mm5 h ASN 13 Ca -0.00 -0.89 -0.17 0.00 0.71 0.00 0.00 56.30 55.96 1mm5 h ASN 13 Cb 1.02 -0.10 -0.00 0.00 0.73 0.00 0.00 38.32 39.97 1mm5 h ASN 13 CO 0.08 1.16 -0.50 0.40 -1.29 0.00 0.00 177.43 177.27 1mm5 h ILE 14 N -0.51 1.30 -0.57 2.57 1.08 -1.21 -2.28 117.51 117.88 1mm5 h ILE 14 Ca -0.07 -1.71 -0.04 0.00 -0.39 0.00 0.00 64.86 62.66 1mm5 h ILE 14 Cb 1.27 1.63 -0.02 0.00 -3.07 0.00 0.00 36.82 36.63 1mm5 h ILE 14 CO 0.08 0.55 0.21 0.00 -0.69 0.00 0.00 178.15 178.30 1mm5 h ALA 15 N 0.87 0.74 -0.43 1.87 0.00 -0.88 -1.00 119.26 120.42 1mm5 h ALA 15 Ca 0.02 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.66 1mm5 h ALA 15 Cb 1.07 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1mm5 h ALA 15 CO 0.10 0.37 -0.10 1.96 0.00 0.00 0.00 179.25 181.58 1mm5 h GLN 16 N 0.78 0.83 -0.33 0.00 1.08 -1.48 -1.28 115.11 114.72 1mm5 h GLN 16 Ca 0.19 -0.32 -0.01 0.00 -1.45 0.00 0.00 58.65 57.06 1mm5 h GLN 16 Cb 0.23 -0.05 -0.02 0.00 -0.05 0.00 0.00 27.48 27.60 1mm5 h GLN 16 CO -0.01 0.95 0.16 1.79 -0.95 0.00 0.00 178.83 180.76 1mm5 h THR 17 N 0.66 1.16 -0.22 -0.54 1.35 -1.24 0.14 112.91 114.22 1mm5 h THR 17 Ca 0.11 -0.45 -0.08 0.00 -0.55 0.00 0.00 66.41 65.44 1mm5 h THR 17 Cb 0.64 0.85 -0.01 0.00 -1.73 0.00 0.00 68.15 67.89 1mm5 h THR 17 CO 0.04 0.16 -0.21 -0.25 -0.25 0.00 0.00 175.52 175.02 1mm5 h TRP 18 N 0.40 0.42 0.00 4.73 7.01 -1.14 -2.66 115.95 124.71 1mm5 h TRP 18 Ca 0.11 -0.07 -0.15 0.00 2.11 0.00 0.00 58.89 60.89 1mm5 h TRP 18 Cb 0.12 -0.11 -0.02 0.00 -2.10 0.00 0.00 29.16 27.05 1mm5 h TRP 18 CO -0.02 0.57 -0.73 0.37 -2.79 0.00 0.00 178.44 175.85 1mm5 h GLN 19 N 0.35 0.00 -6.19 2.65 4.15 -0.88 -3.43 115.11 111.76 1mm5 h GLN 19 Ca 0.06 0.00 -0.57 0.00 0.77 0.00 0.00 58.65 58.90 1mm5 h GLN 19 Cb 0.56 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.24 1mm5 h GLN 19 CO 0.04 0.73 1.31 -1.14 -1.93 0.00 0.00 178.83 177.84 1mm5 s GLN 20 N -3.18 3.44 1.12 1.69 0.74 0.44 -4.96 119.66 118.96 1mm5 s GLN 20 Ca 0.00 1.80 -0.18 0.00 0.05 0.00 0.00 55.36 57.03 1mm5 s GLN 20 Cb 0.11 -4.22 0.11 0.00 1.10 0.00 0.00 33.01 30.11 1mm5 s GLN 20 CO 0.77 -1.73 0.05 -2.30 -0.55 0.00 0.00 175.29 171.53 1mm5 n PRO 21 N 8.29 -1.65 -0.13 1.67 -0.02 -1.26 -4.97 135.00 136.93 1mm5 n PRO 21 Ca 0.24 -0.46 -0.25 0.00 -2.02 0.00 0.00 63.50 61.01 1mm5 n PRO 21 Cb 0.45 -1.72 -0.11 0.00 -0.02 0.00 0.00 33.50 32.10 1mm5 n PRO 21 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1mm5 n GLU 22 N -2.21 0.62 -4.25 -0.52 1.02 -1.26 -5.05 120.64 108.98 1mm5 n GLU 22 Ca 0.01 0.23 -0.14 0.00 -0.02 0.00 0.00 57.16 57.24 1mm5 n GLU 22 Cb 0.62 -1.51 -0.10 0.00 -0.02 0.00 0.00 31.44 30.42 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 -2.51 1.29 -0.28 -0.32 3.76 -1.26 -4.87 115.29 111.10 1mm5 s HIS 23 Ca -0.37 -1.22 0.02 0.00 -0.15 0.00 0.00 55.06 53.34 1mm5 s HIS 23 Cb 0.12 -0.71 0.06 0.00 1.11 0.00 0.00 32.58 33.16 1mm5 s HIS 23 CO 0.54 -0.43 -0.06 -0.47 -0.85 0.00 0.00 174.74 173.48 1mm5 s TYR 24 N -3.89 3.33 0.04 1.40 6.14 -0.99 -4.87 117.35 118.50 1mm5 s TYR 24 Ca 0.34 -2.27 0.03 0.00 0.64 0.00 0.00 57.07 55.81 1mm5 s TYR 24 Cb 0.07 -2.11 -0.04 0.00 0.42 0.00 0.00 41.96 40.30 1mm5 s TYR 24 CO 0.10 -0.87 -0.01 -0.51 0.64 0.00 0.00 175.55 174.91 1mm5 s ASP 25 N 1.14 5.03 0.08 4.32 1.11 -1.07 -2.25 116.67 125.03 1mm5 s ASP 25 Ca -0.06 -0.10 0.09 0.00 0.18 0.00 0.00 52.55 52.66 1mm5 s ASP 25 Cb -0.20 -1.25 -0.04 0.00 1.07 0.00 0.00 42.92 42.51 1mm5 s ASP 25 CO -0.04 0.23 -0.21 -0.76 1.18 0.00 0.00 175.17 175.57 1mm5 s LEU 26 N -1.88 2.52 -0.14 1.23 1.02 -1.07 -0.44 118.68 119.92 1mm5 s LEU 26 Ca 0.22 -0.54 -0.00 0.00 0.02 0.00 0.00 54.13 53.83 1mm5 s LEU 26 Cb -0.12 -1.44 0.03 0.00 0.02 0.00 0.00 46.19 44.68 1mm5 s LEU 26 CO 0.14 0.22 -0.07 -0.31 0.02 0.00 0.00 176.35 176.35 1mm5 s TYR 27 N -0.99 1.66 -0.01 0.29 1.51 -0.96 -2.60 117.35 116.25 1mm5 s TYR 27 Ca 0.15 -0.95 -0.00 0.00 -1.01 0.00 0.00 57.07 55.25 1mm5 s TYR 27 Cb -0.10 -1.31 0.00 0.00 -0.11 0.00 0.00 41.96 40.44 1mm5 s TYR 27 CO 0.06 -0.58 0.01 0.42 -1.11 0.00 0.00 175.55 174.36 1mm5 s ILE 28 N 1.65 -0.01 0.57 2.71 -1.09 -0.99 -1.93 121.20 122.11 1mm5 s ILE 28 Ca 0.03 0.03 -0.19 0.00 -2.23 0.00 0.00 60.65 58.29 1mm5 s ILE 28 Cb -0.14 -0.03 -0.07 0.00 -1.58 0.00 0.00 42.46 40.64 1mm5 s ILE 28 CO -0.08 0.01 0.78 -2.65 -1.23 0.00 0.00 174.94 171.77 1mm5 n PRO 29 N 3.21 0.77 0.01 2.79 -0.02 -1.26 -2.06 135.00 138.43 1mm5 n PRO 29 Ca -0.14 0.29 0.00 0.00 -2.02 0.00 0.00 63.50 61.64 1mm5 n PRO 29 Cb 0.59 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 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 -1.59 3.00 -3.72 3.55 0.00 -1.26 -4.67 120.51 115.81 1mm5 n ALA 30 Ca 0.12 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.49 1mm5 n ALA 30 Cb 0.46 0.02 -0.02 0.00 0.00 0.00 0.00 19.45 19.91 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 -1.10 0.00 -0.07 0.00 -4.36 -1.26 -5.05 121.20 109.36 1mm5 s ILE 31 Ca 0.00 -1.08 -0.22 0.00 -0.26 0.00 0.00 60.65 59.08 1mm5 s ILE 31 Cb 0.00 -2.12 0.05 0.00 1.25 0.00 0.00 42.46 41.64 1mm5 s ILE 31 CO 0.00 0.00 0.51 0.28 0.24 0.00 0.00 174.94 175.97 1mm5 s THR 32 N -3.79 0.02 -0.25 8.37 -1.32 -1.26 -2.32 115.64 115.09 1mm5 s THR 32 Ca 0.14 -0.17 -0.14 0.00 -1.21 0.00 0.00 61.69 60.30 1mm5 s THR 32 Cb -0.05 -0.80 -0.04 0.00 -1.51 0.00 0.00 72.50 70.10 1mm5 s THR 32 CO 0.08 -0.10 0.34 0.86 -2.21 0.00 0.00 174.62 173.59 1mm5 s TRP 33 N -0.91 3.29 -0.03 9.09 -0.00 -1.25 -5.05 118.94 124.08 1mm5 s TRP 33 Ca -0.09 0.42 0.04 0.00 -0.00 0.00 0.00 56.10 56.47 1mm5 s TRP 33 Cb -0.03 -2.51 -0.03 0.00 -0.00 0.00 0.00 33.47 30.91 1mm5 s TRP 33 CO 0.06 -0.13 -0.16 -1.01 -0.00 0.00 0.00 176.95 175.71 1mm5 s HIS 34 N 1.73 2.66 0.17 5.86 3.76 -1.26 -4.85 115.29 123.35 1mm5 s HIS 34 Ca 0.15 -0.19 -0.21 0.00 -0.15 0.00 0.00 55.06 54.66 1mm5 s HIS 34 Cb -0.15 -1.59 0.05 0.00 1.11 0.00 0.00 32.58 32.00 1mm5 s HIS 34 CO 0.09 0.18 0.57 0.00 -0.85 0.00 0.00 174.74 174.73 1mm5 s ALA 35 N -0.76 -1.37 0.21 -1.40 0.00 -1.26 -4.98 121.76 112.21 1mm5 s ALA 35 Ca 0.12 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.32 1mm5 s ALA 35 Cb -0.11 0.85 0.00 0.00 0.00 0.00 0.00 23.12 23.86 1mm5 s ALA 35 CO 0.01 -0.78 0.00 0.54 0.00 0.00 0.00 175.76 175.54 1mm5 n ARG 36 N -0.36 0.00 0.01 0.00 3.00 -1.26 -5.08 116.66 112.98 1mm5 n ARG 36 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.69 1mm5 n ARG 36 Cb 0.64 -0.12 0.00 0.00 0.00 0.00 0.00 32.46 32.98 1mm5 n ARG 36 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1mm5 n PHE 37 N -3.36 -2.38 -3.77 -1.55 7.35 -1.26 -5.14 117.46 107.35 1mm5 n PHE 37 Ca 0.00 0.07 -0.29 0.00 -0.76 0.00 0.00 57.45 56.46 1mm5 n PHE 37 Cb 0.02 0.60 -0.04 0.00 0.35 0.00 0.00 39.48 40.41 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 -2.00 3.88 -0.91 3.13 0.00 -1.26 -4.99 121.76 119.61 1mm5 s ALA 38 Ca 0.00 -0.79 -0.25 0.00 0.00 0.00 0.00 51.96 50.92 1mm5 s ALA 38 Cb 0.00 -1.96 -0.11 0.00 0.00 0.00 0.00 23.12 21.05 1mm5 s ALA 38 CO 0.00 0.60 2.16 0.71 0.00 0.00 0.00 175.76 179.23 1mm5 s TYR 39 N -1.72 1.47 0.47 0.00 2.02 -1.26 -4.92 117.35 113.42 1mm5 s TYR 39 Ca 0.38 1.38 0.01 0.00 -0.37 0.00 0.00 57.07 58.47 1mm5 s TYR 39 Cb -0.12 -3.70 0.01 0.00 -0.40 0.00 0.00 41.96 37.75 1mm5 s TYR 39 CO 0.28 -1.48 0.69 -0.51 -1.57 0.00 0.00 175.55 172.95 1mm5 s ASP 40 N 9.11 5.68 0.12 2.29 1.11 -1.26 -5.05 116.67 128.67 1mm5 s ASP 40 Ca 0.81 0.18 0.00 0.00 0.18 0.00 0.00 52.55 53.72 1mm5 s ASP 40 Cb -0.08 -1.33 0.00 0.00 1.07 0.00 0.00 42.92 42.58 1mm5 s ASP 40 CO 0.06 -0.82 0.00 0.29 1.18 0.00 0.00 175.17 175.89 1mm5 n LYS 41 N -2.14 0.00 0.00 8.23 5.02 -1.26 -5.08 118.16 122.93 1mm5 n LYS 41 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1mm5 n LYS 41 Cb 0.58 -0.04 0.00 0.00 -0.02 0.00 0.00 35.03 35.55 1mm5 n LYS 41 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1mm5 n GLU 42 N -2.95 0.00 -2.20 1.97 0.28 -1.26 -5.01 120.64 111.47 1mm5 n GLU 42 Ca 0.00 0.00 -0.20 0.00 -0.16 0.00 0.00 57.16 56.80 1mm5 n GLU 42 Cb 0.00 0.00 -0.03 0.00 1.43 0.00 0.00 31.44 32.84 1mm5 n GLU 42 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 177.13 178.14 1mm5 n LYS 43 N -0.73 -1.57 -3.72 3.44 4.81 -1.26 -1.93 118.16 117.20 1mm5 n LYS 43 Ca 0.00 1.04 -0.26 0.00 -0.87 0.00 0.00 58.31 58.21 1mm5 n LYS 43 Cb 0.00 -5.60 0.06 0.00 0.02 0.00 0.00 35.03 29.51 1mm5 n LYS 43 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1mm5 n THR 44 N -3.65 -2.77 0.03 3.15 -1.04 -1.26 -4.90 114.28 103.84 1mm5 n THR 44 Ca -0.23 -0.03 -0.11 0.00 -2.04 0.00 0.00 64.05 61.63 1mm5 n THR 44 Cb 0.68 -3.59 -0.06 0.00 -1.82 0.00 0.00 70.33 65.53 1mm5 n THR 44 CO 0.00 0.00 0.00 -0.78 -0.64 0.00 0.00 175.07 173.65 1mm5 h ASP 45 N -2.44 -0.04 -1.81 8.00 1.82 -1.82 -3.48 116.42 116.66 1mm5 h ASP 45 Ca -0.58 0.01 0.13 0.00 -0.39 0.00 0.00 57.03 56.21 1mm5 h ASP 45 Cb 1.37 0.02 -0.03 0.00 0.68 0.00 0.00 39.33 41.37 1mm5 h ASP 45 CO 0.60 -0.01 -0.17 0.54 -1.61 0.00 0.00 179.24 178.58 1mm5 n ARG 46 N -5.11 -0.98 -3.27 0.28 3.00 -1.26 -4.95 116.66 104.37 1mm5 n ARG 46 Ca -0.06 0.64 -0.16 0.00 -0.01 0.00 0.00 57.85 58.26 1mm5 n ARG 46 Cb 0.05 -1.19 0.07 0.00 0.00 0.00 0.00 32.46 31.39 1mm5 n ARG 46 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.63 178.29 1mm5 n TYR 47 N -2.72 -2.44 -4.17 -1.55 4.01 -1.26 -5.03 117.16 104.00 1mm5 n TYR 47 Ca 0.00 0.85 -0.24 0.00 -0.16 0.00 0.00 57.90 58.36 1mm5 n TYR 47 Cb 0.22 -4.17 -0.07 0.00 -0.31 0.00 0.00 39.34 35.01 1mm5 n TYR 47 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 1mm5 s ASN 48 N -3.45 4.47 -0.09 7.72 0.01 -1.26 -5.14 114.94 117.21 1mm5 s ASN 48 Ca 0.43 -0.91 0.00 0.00 -0.71 0.00 0.00 52.86 51.68 1mm5 s ASN 48 Cb -0.06 -0.61 -0.03 0.00 0.41 0.00 0.00 41.25 40.96 1mm5 s ASN 48 CO 0.74 -0.34 -0.09 -1.83 -1.51 0.00 0.00 177.10 174.08 1mm5 s GLU 49 N -3.82 3.01 -0.77 -0.60 -1.05 -1.26 -5.08 118.70 109.13 1mm5 s GLU 49 Ca 0.38 -0.59 -0.07 0.00 -0.15 0.00 0.00 54.97 54.53 1mm5 s GLU 49 Cb -0.00 -2.63 0.20 0.00 -0.44 0.00 0.00 34.13 31.26 1mm5 s GLU 49 CO 0.22 0.49 0.65 0.50 0.95 0.00 0.00 175.26 178.07 1mm5 s ARG 50 N -0.35 3.17 -0.56 -4.83 3.52 -1.26 -5.03 118.95 113.60 1mm5 s ARG 50 Ca 0.05 -2.65 -0.27 0.00 -0.13 0.00 0.00 55.73 52.73 1mm5 s ARG 50 Cb -0.12 -4.08 -0.02 0.00 -1.56 0.00 0.00 34.95 29.16 1mm5 s ARG 50 CO 0.02 -1.23 1.88 -1.25 -0.81 0.00 0.00 175.30 173.91 1mm5 s PRO 51 N -0.23 2.70 0.19 5.12 0.04 -1.26 -4.96 135.00 136.60 1mm5 s PRO 51 Ca 0.20 0.79 -0.30 0.00 0.04 0.00 0.00 61.00 61.72 1mm5 s PRO 51 Cb -0.14 -4.37 -0.08 0.00 0.04 0.00 0.00 34.50 29.95 1mm5 s PRO 51 CO -0.07 -2.63 1.25 1.67 0.04 0.00 0.00 177.00 177.26 1mm5 s TRP 52 N 8.94 3.34 0.13 0.56 -2.14 -1.26 -4.94 118.94 123.57 1mm5 s TRP 52 Ca 0.71 1.33 -0.21 0.00 2.66 0.00 0.00 56.10 60.58 1mm5 s TRP 52 Cb -0.14 -3.51 0.07 0.00 -3.10 0.00 0.00 33.47 26.79 1mm5 s TRP 52 CO 0.23 -1.52 1.01 0.41 -2.66 0.00 0.00 176.95 174.42 1mm5 n GLY 53 N 2.27 0.55 0.00 3.67 0.00 -1.26 -4.22 105.19 106.20 1mm5 n GLY 53 Ca 0.05 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.72 0.84 0.00 -0.02 0.00 -1.07 -4.68 105.19 99.54 1mm5 n GLY 54 Ca -0.01 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 -0.94 3.44 -0.02 0.00 -0.81 -1.59 105.19 105.26 1mm5 n GLY 55 Ca 0.00 -0.09 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 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 1.78 0.16 1.61 0.08 -0.95 -2.27 117.98 114.40 1mm5 s PHE 56 Ca 0.00 -1.18 -0.11 0.00 0.12 0.00 0.00 56.93 55.76 1mm5 s PHE 56 Cb 0.00 -1.12 0.00 0.00 -0.57 0.00 0.00 43.02 41.33 1mm5 s PHE 56 CO 0.00 -0.24 0.33 0.20 -0.10 0.00 0.00 175.22 175.41 1mm5 s GLY 57 N -3.49 0.31 0.22 4.36 0.00 0.42 -0.74 107.32 108.39 1mm5 s GLY 57 Ca 0.31 -0.70 0.01 0.00 0.00 0.00 0.00 44.72 44.34 1mm5 s GLY 57 CO 0.15 -0.70 0.07 1.08 0.00 0.00 0.00 173.10 173.70 1mm5 s LEU 58 N -2.94 1.75 0.20 0.66 1.43 -0.68 -2.60 118.68 116.51 1mm5 s LEU 58 Ca 0.14 -1.31 -0.03 0.00 -1.03 0.00 0.00 54.13 51.90 1mm5 s LEU 58 Cb 0.02 0.04 -0.03 0.00 0.03 0.00 0.00 46.19 46.25 1mm5 s LEU 58 CO -0.02 -0.69 0.18 -0.44 0.23 0.00 0.00 176.35 175.62 1mm5 s SER 59 N -3.25 0.12 -0.10 2.29 0.01 -1.26 -1.09 113.70 110.42 1mm5 s SER 59 Ca 0.33 -1.28 -0.17 0.00 1.31 0.00 0.00 55.95 56.14 1mm5 s SER 59 Cb 0.07 0.41 0.04 0.00 0.21 0.00 0.00 66.02 66.75 1mm5 s SER 59 CO 0.10 -0.88 0.43 -0.60 0.41 0.00 0.00 173.24 172.70 1mm5 s ARG 60 N -4.12 0.63 -0.23 12.44 6.06 -0.49 -4.90 118.95 128.34 1mm5 s ARG 60 Ca 0.34 0.32 -0.04 0.00 -2.50 0.00 0.00 55.73 53.85 1mm5 s ARG 60 Cb 0.06 0.30 -0.01 0.00 0.06 0.00 0.00 34.95 35.35 1mm5 s ARG 60 CO 0.10 -0.13 -0.02 -0.46 -2.50 0.00 0.00 175.30 172.29 1mm5 s TRP 61 N -0.43 2.98 -0.14 5.12 -0.00 -1.26 -0.95 118.94 124.26 1mm5 s TRP 61 Ca -0.06 -0.85 -0.08 0.00 -0.00 0.00 0.00 56.10 55.11 1mm5 s TRP 61 Cb -0.03 -2.13 -0.04 0.00 -0.00 0.00 0.00 33.47 31.26 1mm5 s TRP 61 CO 0.03 -0.52 0.14 -0.51 -0.00 0.00 0.00 176.95 176.09 1mm5 s ASP 62 N 1.50 6.32 0.63 5.86 -0.00 0.45 -4.97 116.67 126.47 1mm5 s ASP 62 Ca 0.06 0.40 0.29 0.00 -0.00 0.00 0.00 52.55 53.29 1mm5 s ASP 62 Cb -0.14 -2.07 1.55 0.00 -0.00 0.00 0.00 42.92 42.26 1mm5 s ASP 62 CO -0.02 0.34 1.91 1.05 -0.00 0.00 0.00 175.17 178.45 1mm5 h GLU 63 N 5.48 0.00 -1.22 8.23 4.11 -1.99 -0.07 114.58 129.12 1mm5 h GLU 63 Ca -0.51 0.00 -0.34 0.00 0.07 0.00 0.00 59.36 58.58 1mm5 h GLU 63 Cb 1.21 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.29 1mm5 h GLU 63 CO 0.63 0.00 0.43 0.36 0.07 0.00 0.00 179.01 180.51 1mm5 n LYS 64 N -3.29 1.83 -3.73 1.06 0.00 -1.26 -4.84 118.16 107.92 1mm5 n LYS 64 Ca 0.03 -1.77 -0.23 0.00 -0.00 0.00 0.00 58.31 56.33 1mm5 n LYS 64 Cb 0.50 -1.69 0.04 0.00 -0.00 0.00 0.00 35.03 33.87 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 -0.14 -0.35 3.03 2.58 0.00 -0.06 -4.98 105.19 105.28 1mm5 n GLY 65 Ca 0.35 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 46.19 1mm5 n GLY 65 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1mm5 s ASN 66 N -4.11 4.07 -0.76 1.61 2.47 -1.09 -4.84 114.94 112.29 1mm5 s ASN 66 Ca 0.16 -1.22 -0.16 0.00 0.42 0.00 0.00 52.86 52.06 1mm5 s ASN 66 Cb -0.08 -1.41 0.18 0.00 -1.45 0.00 0.00 41.25 38.49 1mm5 s ASN 66 CO 0.81 -0.18 0.76 0.86 -3.72 0.00 0.00 177.10 175.62 1mm5 s TRP 67 N 1.23 3.49 0.69 0.43 -0.11 -1.07 -0.41 118.94 123.19 1mm5 s TRP 67 Ca -0.06 -1.66 -0.11 0.00 1.22 0.00 0.00 56.10 55.48 1mm5 s TRP 67 Cb -0.19 -3.90 0.01 0.00 -1.50 0.00 0.00 33.47 27.89 1mm5 s TRP 67 CO -0.06 -1.10 1.07 -1.01 -4.62 0.00 0.00 176.95 171.23 1mm5 s HIS 68 N 1.06 3.32 -0.27 5.86 3.76 -0.13 -1.52 115.29 127.38 1mm5 s HIS 68 Ca 0.16 1.17 -0.26 0.00 -0.15 0.00 0.00 55.06 55.98 1mm5 s HIS 68 Cb -0.15 -2.96 0.15 0.00 1.11 0.00 0.00 32.58 30.73 1mm5 s HIS 68 CO -0.05 -1.13 1.17 0.20 -0.85 0.00 0.00 174.74 174.07 1mm5 s GLY 69 N -4.19 -0.00 0.23 -2.22 0.00 -0.47 -1.40 107.32 99.26 1mm5 s GLY 69 Ca 0.58 2.87 0.03 0.00 0.00 0.00 0.00 44.72 48.19 1mm5 s GLY 69 CO 0.53 1.74 0.02 0.48 0.00 0.00 0.00 173.10 175.87 1mm5 s LEU 70 N -0.04 2.08 -0.20 0.66 2.34 -0.25 -1.81 118.68 121.46 1mm5 s LEU 70 Ca 0.04 -1.24 -0.06 0.00 0.06 0.00 0.00 54.13 52.93 1mm5 s LEU 70 Cb -0.04 -0.18 0.10 0.00 -0.56 0.00 0.00 46.19 45.51 1mm5 s LEU 70 CO -0.08 -0.56 0.41 -0.72 -1.06 0.00 0.00 176.35 174.34 1mm5 s TYR 71 N -3.52 -0.81 -0.40 3.48 1.13 -1.08 -1.69 117.35 114.46 1mm5 s TYR 71 Ca 0.29 1.43 -0.13 0.00 -1.41 0.00 0.00 57.07 57.25 1mm5 s TYR 71 Cb 0.06 0.27 0.02 0.00 -1.10 0.00 0.00 41.96 41.21 1mm5 s TYR 71 CO 0.09 -0.52 0.26 0.00 -2.51 0.00 0.00 175.55 172.87 1mm5 s ALA 72 N 2.61 3.39 0.22 9.51 0.00 0.08 -1.92 121.76 135.65 1mm5 s ALA 72 Ca 0.01 -1.73 0.12 0.00 0.00 0.00 0.00 51.96 50.35 1mm5 s ALA 72 Cb -0.13 -2.76 -0.05 0.00 0.00 0.00 0.00 23.12 20.19 1mm5 s ALA 72 CO -0.13 -1.44 -0.22 -1.64 0.00 0.00 0.00 175.76 172.33 1mm5 s MET 73 N 1.62 1.59 -0.09 0.00 -1.94 -0.12 -2.23 119.30 118.13 1mm5 s MET 73 Ca 0.04 -1.60 0.04 0.00 -1.71 0.00 0.00 55.69 52.45 1mm5 s MET 73 Cb -0.19 -1.83 0.00 0.00 2.01 0.00 0.00 34.83 34.82 1mm5 s MET 73 CO 0.08 0.38 -0.22 0.00 -0.01 0.00 0.00 175.02 175.25 1mm5 s ALA 74 N -1.95 1.99 -0.14 3.03 0.00 -0.62 -0.41 121.76 123.66 1mm5 s ALA 74 Ca 0.24 -0.86 -0.03 0.00 0.00 0.00 0.00 51.96 51.31 1mm5 s ALA 74 Cb -0.07 -0.75 -0.03 0.00 0.00 0.00 0.00 23.12 22.27 1mm5 s ALA 74 CO 0.12 0.26 -0.05 -0.06 0.00 0.00 0.00 175.76 176.03 1mm5 s PHE 75 N 0.38 3.00 -0.24 0.00 0.40 -1.03 -2.58 117.98 117.91 1mm5 s PHE 75 Ca -0.17 -0.27 -0.04 0.00 -0.60 0.00 0.00 56.93 55.85 1mm5 s PHE 75 Cb -0.17 -1.91 -0.00 0.00 0.51 0.00 0.00 43.02 41.45 1mm5 s PHE 75 CO 0.08 0.02 -0.02 0.21 0.70 0.00 0.00 175.22 176.21 1mm5 s LYS 76 N 0.16 3.25 0.75 0.44 2.20 -1.26 -2.59 119.74 122.69 1mm5 s LYS 76 Ca -0.02 -0.72 -0.13 0.00 -0.36 0.00 0.00 55.97 54.75 1mm5 s LYS 76 Cb -0.14 -3.08 0.20 0.00 -1.51 0.00 0.00 37.83 33.30 1mm5 s LYS 76 CO 0.03 -0.27 0.44 -3.47 -0.36 0.00 0.00 175.35 171.72 1mm5 n ASP 77 N 4.79 -3.11 0.02 1.43 4.64 -1.22 -4.76 116.55 118.34 1mm5 n ASP 77 Ca -0.17 -0.45 -0.06 0.00 -1.38 0.00 0.00 54.79 52.73 1mm5 n ASP 77 Cb 0.50 -0.51 0.13 0.00 -1.04 0.00 0.00 41.12 40.20 1mm5 n ASP 77 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 1mm5 h SER 78 N -2.84 0.49 0.00 1.67 0.02 -1.99 -3.41 113.55 107.50 1mm5 h SER 78 Ca -0.20 -0.22 0.00 0.00 -0.84 0.00 0.00 61.79 60.53 1mm5 h SER 78 Cb 0.68 -0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.08 1mm5 h SER 78 CO 0.12 0.86 0.00 0.79 -1.14 0.00 0.00 176.83 177.46 1mm5 n TRP 79 N -4.02 0.00 -3.15 3.45 5.03 -1.26 -5.07 117.44 112.43 1mm5 n TRP 79 Ca -0.02 0.00 0.05 0.00 3.03 0.00 0.00 57.50 60.56 1mm5 n TRP 79 Cb 0.52 0.00 -0.01 0.00 -1.03 0.00 0.00 31.31 30.79 1mm5 n TRP 79 CO 0.00 0.00 0.00 1.21 -0.03 0.00 0.00 177.69 178.87 1mm5 s ASN 80 N -2.78 -1.00 -0.41 -0.99 3.84 -1.26 -5.11 114.94 107.22 1mm5 s ASN 80 Ca 0.00 0.40 0.06 0.00 0.21 0.00 0.00 52.86 53.53 1mm5 s ASN 80 Cb 0.00 1.75 0.18 0.00 -0.55 0.00 0.00 41.25 42.63 1mm5 s ASN 80 CO 0.00 -0.19 0.70 -0.75 -2.79 0.00 0.00 177.10 174.07 1mm5 s LYS 81 N 2.90 0.75 0.08 0.43 2.20 -1.26 -4.90 119.74 119.94 1mm5 s LYS 81 Ca 0.13 -0.31 -0.31 0.00 -0.36 0.00 0.00 55.97 55.13 1mm5 s LYS 81 Cb -0.10 0.07 -0.06 0.00 -1.51 0.00 0.00 37.83 36.23 1mm5 s LYS 81 CO -0.20 -1.07 1.24 -0.46 -0.36 0.00 0.00 175.35 174.50 1mm5 s TRP 82 N 1.76 3.40 -0.30 4.03 -0.00 -1.26 -3.39 118.94 123.18 1mm5 s TRP 82 Ca 0.17 1.24 -0.00 0.00 -0.00 0.00 0.00 56.10 57.51 1mm5 s TRP 82 Cb -0.02 -3.47 0.13 0.00 -0.00 0.00 0.00 33.47 30.10 1mm5 s TRP 82 CO -0.08 -1.50 0.28 -2.00 -0.00 0.00 0.00 176.95 173.65 1mm5 s GLU 83 N 0.97 0.35 0.70 5.86 2.56 -1.07 -4.99 118.70 123.07 1mm5 s GLU 83 Ca 0.59 -0.29 -0.11 0.00 0.00 0.00 0.00 54.97 55.16 1mm5 s GLU 83 Cb -0.31 -0.74 0.01 0.00 2.00 0.00 0.00 34.13 35.09 1mm5 s GLU 83 CO 0.30 -1.05 1.06 -1.25 -0.56 0.00 0.00 175.26 173.76 1mm5 s PRO 84 N 2.20 2.94 -0.17 4.30 0.04 -1.26 -2.47 135.00 140.59 1mm5 s PRO 84 Ca 0.10 0.95 -0.06 0.00 0.04 0.00 0.00 61.00 62.03 1mm5 s PRO 84 Cb -0.15 -1.99 0.08 0.00 0.04 0.00 0.00 34.50 32.48 1mm5 s PRO 84 CO -0.30 -1.10 0.35 0.96 0.04 0.00 0.00 177.00 176.95 1mm5 s ILE 85 N -3.05 -0.54 -0.18 0.56 -5.25 0.45 -2.34 121.20 110.86 1mm5 s ILE 85 Ca 0.58 0.22 -0.01 0.00 -0.99 0.00 0.00 60.65 60.45 1mm5 s ILE 85 Cb -0.14 -0.56 0.00 0.00 2.95 0.00 0.00 42.46 44.71 1mm5 s ILE 85 CO 0.55 0.09 -0.13 0.00 -1.79 0.00 0.00 174.94 173.66 1mm5 s ALA 86 N 2.52 2.55 0.32 2.27 0.00 -0.88 -0.95 121.76 127.59 1mm5 s ALA 86 Ca -0.00 -1.11 0.07 0.00 0.00 0.00 0.00 51.96 50.92 1mm5 s ALA 86 Cb -0.12 -1.34 -0.02 0.00 0.00 0.00 0.00 23.12 21.64 1mm5 s ALA 86 CO -0.11 -0.20 0.35 0.20 0.00 0.00 0.00 175.76 176.01 1mm5 s GLY 87 N 1.08 1.65 -0.23 0.00 0.00 -0.81 -2.60 107.32 106.42 1mm5 s GLY 87 Ca -0.00 -1.54 -0.14 0.00 0.00 0.00 0.00 44.72 43.04 1mm5 s GLY 87 CO -0.04 -1.48 0.56 -0.19 0.00 0.00 0.00 173.10 171.96 1mm5 s TYR 88 N -2.23 -0.83 0.19 1.90 2.02 -0.75 -2.65 117.35 115.01 1mm5 s TYR 88 Ca 0.41 1.73 -0.23 0.00 -0.37 0.00 0.00 57.07 58.61 1mm5 s TYR 88 Cb -0.07 0.44 0.07 0.00 -0.40 0.00 0.00 41.96 42.00 1mm5 s TYR 88 CO 0.28 -0.43 0.98 0.20 -1.57 0.00 0.00 175.55 175.01 1mm5 s GLY 89 N 1.42 -0.02 0.05 0.71 0.00 -0.75 -0.42 107.32 108.32 1mm5 s GLY 89 Ca -0.09 -0.17 0.07 0.00 0.00 0.00 0.00 44.72 44.53 1mm5 s GLY 89 CO -0.15 1.01 -0.18 0.66 0.00 0.00 0.00 173.10 174.44 1mm5 s TRP 90 N -2.71 1.58 0.06 1.90 1.48 -0.86 -1.37 118.94 119.02 1mm5 s TRP 90 Ca 0.17 -0.38 -0.05 0.00 -1.06 0.00 0.00 56.10 54.78 1mm5 s TRP 90 Cb -0.02 -0.92 -0.02 0.00 -1.16 0.00 0.00 33.47 31.35 1mm5 s TRP 90 CO 0.05 0.09 0.09 -1.83 -4.06 0.00 0.00 176.95 171.29 1mm5 s GLU 91 N -1.33 0.67 -0.23 3.25 -1.05 -0.57 -1.96 118.70 117.48 1mm5 s GLU 91 Ca 0.05 -0.95 -0.09 0.00 -0.15 0.00 0.00 54.97 53.83 1mm5 s GLU 91 Cb -0.09 0.26 -0.04 0.00 -0.44 0.00 0.00 34.13 33.82 1mm5 s GLU 91 CO 0.02 -0.17 0.11 -1.12 0.95 0.00 0.00 175.26 175.04 1mm5 s SER 92 N -2.58 5.70 0.21 0.83 0.01 0.44 -2.60 113.70 115.72 1mm5 s SER 92 Ca 0.01 0.01 -0.29 0.00 1.31 0.00 0.00 55.95 56.99 1mm5 s SER 92 Cb 0.03 -2.01 -0.08 0.00 0.21 0.00 0.00 66.02 64.17 1mm5 s SER 92 CO -0.08 0.07 0.92 0.42 0.41 0.00 0.00 173.24 174.98 1mm5 s THR 93 N 1.02 4.17 -0.14 1.44 -4.23 -1.26 -2.61 115.64 114.02 1mm5 s THR 93 Ca 0.05 2.04 -0.02 0.00 -1.18 0.00 0.00 61.69 62.59 1mm5 s THR 93 Cb -0.14 -4.31 0.04 0.00 1.34 0.00 0.00 72.50 69.44 1mm5 s THR 93 CO 0.04 0.48 0.00 0.86 -0.54 0.00 0.00 174.62 175.46 1mm5 s TRP 94 N -1.01 1.00 0.00 3.99 -0.11 0.28 -4.99 118.94 118.11 1mm5 s TRP 94 Ca 0.41 -0.60 0.03 0.00 1.22 0.00 0.00 56.10 57.16 1mm5 s TRP 94 Cb -0.25 -0.99 -0.01 0.00 -1.50 0.00 0.00 33.47 30.72 1mm5 s TRP 94 CO 0.31 -0.49 -0.09 0.50 -4.62 0.00 0.00 176.95 172.56 1mm5 s ARG 95 N 1.87 0.67 0.99 5.86 3.52 -1.26 -2.58 118.95 128.00 1mm5 s ARG 95 Ca 0.02 -0.38 -0.12 0.00 -0.13 0.00 0.00 55.73 55.12 1mm5 s ARG 95 Cb -0.15 -0.63 0.18 0.00 -1.56 0.00 0.00 34.95 32.80 1mm5 s ARG 95 CO -0.07 0.17 1.09 -1.25 -0.81 0.00 0.00 175.30 174.43 1mm5 s PRO 96 N -0.42 0.53 0.25 5.12 0.04 -1.26 -4.89 135.00 134.35 1mm5 s PRO 96 Ca 0.02 0.63 -0.06 0.00 0.04 0.00 0.00 61.00 61.62 1mm5 s PRO 96 Cb -0.04 -1.74 0.26 0.00 0.04 0.00 0.00 34.50 33.02 1mm5 s PRO 96 CO -0.00 -2.69 1.92 1.25 0.04 0.00 0.00 177.00 177.51 1mm5 h LEU 97 N -1.87 1.10 -1.73 -3.56 5.85 -2.03 -1.55 115.31 111.51 1mm5 h LEU 97 Ca -0.54 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.13 1mm5 h LEU 97 Cb 1.32 -0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.08 1mm5 h LEU 97 CO 0.56 0.78 -0.11 0.00 -0.34 0.00 0.00 178.44 179.33 1mm5 h ALA 98 N 1.37 1.78 -5.17 1.25 0.00 -2.05 -3.47 119.26 112.97 1mm5 h ALA 98 Ca 0.36 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1mm5 h ALA 98 Cb -0.11 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1mm5 h ALA 98 CO -0.09 0.17 -0.72 -0.25 0.00 0.00 0.00 179.25 178.36 1mm5 n ASP 99 N -4.39 -7.89 -3.97 0.00 9.92 -0.58 -5.06 116.55 104.59 1mm5 n ASP 99 Ca -0.02 0.94 -0.16 0.00 -0.53 0.00 0.00 54.79 55.01 1mm5 n ASP 99 Cb 0.19 -5.30 0.01 0.00 -0.64 0.00 0.00 41.12 35.39 1mm5 n ASP 99 CO 0.00 0.00 0.00 1.21 0.13 0.00 0.00 177.20 178.54 1mm5 n GLU 100 N 0.16 0.87 0.13 -1.24 4.07 -1.26 -5.01 120.64 118.35 1mm5 n GLU 100 Ca 0.06 -2.29 0.04 0.00 -0.06 0.00 0.00 57.16 54.91 1mm5 n GLU 100 Cb 0.24 0.12 0.46 0.00 -0.06 0.00 0.00 31.44 32.21 1mm5 n GLU 100 CO 0.00 0.00 0.00 -2.95 -0.06 0.00 0.00 177.13 174.12 1mm5 h ASN 101 N 0.33 0.23 -2.58 4.31 7.08 -1.97 -3.42 115.58 119.56 1mm5 h ASN 101 Ca -0.22 -0.03 -0.53 0.00 -3.08 0.00 0.00 56.30 52.44 1mm5 h ASN 101 Cb 0.87 -0.06 0.03 0.00 -2.08 0.00 0.00 38.32 37.08 1mm5 h ASN 101 CO 0.34 0.28 1.08 0.12 -2.08 0.00 0.00 177.43 177.17 1mm5 s PHE 102 N -4.99 2.16 -0.03 4.14 2.19 -1.26 -4.36 117.98 115.83 1mm5 s PHE 102 Ca -0.06 0.08 0.06 0.00 0.33 0.00 0.00 56.93 57.33 1mm5 s PHE 102 Cb 0.16 -4.09 -0.01 0.00 -1.31 0.00 0.00 43.02 37.77 1mm5 s PHE 102 CO 0.72 -4.51 -0.21 -1.58 1.83 0.00 0.00 175.22 171.47 1mm5 s HIS 103 N 2.92 1.98 -0.04 10.12 2.46 -0.74 -4.87 115.29 127.12 1mm5 s HIS 103 Ca 0.79 -0.47 0.05 0.00 0.47 0.00 0.00 55.06 55.90 1mm5 s HIS 103 Cb -0.43 -1.29 -0.02 0.00 -0.13 0.00 0.00 32.58 30.71 1mm5 s HIS 103 CO 0.35 -0.11 -0.19 -0.51 -2.47 0.00 0.00 174.74 171.81 1mm5 s LEU 104 N -0.29 2.44 -0.21 8.88 2.01 -1.07 -0.87 118.68 129.56 1mm5 s LEU 104 Ca 0.03 -0.32 -0.09 0.00 0.01 0.00 0.00 54.13 53.75 1mm5 s LEU 104 Cb -0.10 -1.47 0.08 0.00 0.01 0.00 0.00 46.19 44.71 1mm5 s LEU 104 CO 0.01 0.32 0.48 -0.83 1.01 0.00 0.00 176.35 177.34 1mm5 s GLY 105 N -0.59 -0.42 -0.05 -3.19 0.00 -0.61 -0.55 107.32 101.90 1mm5 s GLY 105 Ca 0.09 1.73 0.03 0.00 0.00 0.00 0.00 44.72 46.57 1mm5 s GLY 105 CO 0.00 2.17 -0.14 1.08 0.00 0.00 0.00 173.10 176.22 1mm5 s LEU 106 N 2.00 1.81 -0.03 0.66 1.02 -1.07 -0.78 118.68 122.28 1mm5 s LEU 106 Ca -0.07 -0.31 -0.29 0.00 0.02 0.00 0.00 54.13 53.49 1mm5 s LEU 106 Cb -0.10 -0.85 0.10 0.00 0.02 0.00 0.00 46.19 45.36 1mm5 s LEU 106 CO -0.14 0.10 1.30 -0.83 0.02 0.00 0.00 176.35 176.79 1mm5 s GLY 107 N 0.28 -0.15 0.16 -3.19 0.00 -1.07 -0.42 107.32 102.92 1mm5 s GLY 107 Ca -0.08 0.07 0.04 0.00 0.00 0.00 0.00 44.72 44.76 1mm5 s GLY 107 CO 0.03 5.67 0.16 -1.36 0.00 0.00 0.00 173.10 177.60 1mm5 s PHE 108 N -2.03 3.22 0.01 1.90 0.40 -0.83 -0.48 117.98 120.17 1mm5 s PHE 108 Ca 0.29 0.01 0.00 0.00 -0.60 0.00 0.00 56.93 56.64 1mm5 s PHE 108 Cb -0.00 -1.55 -0.01 0.00 0.51 0.00 0.00 43.02 41.98 1mm5 s PHE 108 CO -0.01 0.52 -0.01 0.95 0.70 0.00 0.00 175.22 177.36 1mm5 s THR 109 N -1.74 0.08 -0.31 0.64 -4.23 -0.34 -2.03 115.64 107.71 1mm5 s THR 109 Ca 0.32 -0.25 -0.07 0.00 -1.18 0.00 0.00 61.69 60.50 1mm5 s THR 109 Cb -0.10 -0.12 0.01 0.00 1.34 0.00 0.00 72.50 73.63 1mm5 s THR 109 CO 0.24 -0.11 0.10 0.00 -0.54 0.00 0.00 174.62 174.31 1mm5 s ALA 110 N -0.37 3.10 -0.47 3.99 0.00 0.44 -2.18 121.76 126.27 1mm5 s ALA 110 Ca -0.04 -1.50 -0.25 0.00 0.00 0.00 0.00 51.96 50.18 1mm5 s ALA 110 Cb -0.03 -2.21 0.03 0.00 0.00 0.00 0.00 23.12 20.91 1mm5 s ALA 110 CO -0.00 -1.00 0.88 0.20 0.00 0.00 0.00 175.76 175.84 1mm5 s GLY 111 N 1.50 1.51 -0.32 0.00 0.00 -0.42 -1.81 107.32 107.78 1mm5 s GLY 111 Ca 0.02 -0.90 -0.13 0.00 0.00 0.00 0.00 44.72 43.71 1mm5 s GLY 111 CO 0.03 1.95 0.25 0.14 0.00 0.00 0.00 173.10 175.48 1mm5 s VAL 112 N 3.61 5.27 0.06 1.40 1.01 -1.07 -1.07 120.40 129.61 1mm5 s VAL 112 Ca 0.34 0.00 -0.02 0.00 0.00 0.00 0.00 61.98 62.30 1mm5 s VAL 112 Cb -0.11 -3.67 -0.04 0.00 0.00 0.00 0.00 36.38 32.56 1mm5 s VAL 112 CO 0.25 0.07 0.24 -0.89 0.00 0.00 0.00 175.10 174.77 1mm5 s THR 113 N 1.80 5.35 1.20 3.92 2.01 -1.07 -2.08 115.64 126.78 1mm5 s THR 113 Ca 0.08 -0.23 -0.18 0.00 0.31 0.00 0.00 61.69 61.66 1mm5 s THR 113 Cb -0.17 -3.61 0.28 0.00 0.01 0.00 0.00 72.50 69.02 1mm5 s THR 113 CO 0.11 0.17 1.08 0.00 -0.69 0.00 0.00 174.62 175.29 1mm5 s ALA 114 N -1.49 0.39 0.36 7.40 0.00 -0.99 -1.67 121.76 125.76 1mm5 s ALA 114 Ca 0.34 -0.77 -0.11 0.00 0.00 0.00 0.00 51.96 51.42 1mm5 s ALA 114 Cb -0.13 -2.96 -0.07 0.00 0.00 0.00 0.00 23.12 19.96 1mm5 s ALA 114 CO 0.25 -3.62 0.72 1.03 0.00 0.00 0.00 175.76 174.13 1mm5 s ARG 115 N -5.21 3.82 0.13 0.00 0.52 -1.26 -4.59 118.95 112.36 1mm5 s ARG 115 Ca 0.69 0.45 0.00 0.00 -0.52 0.00 0.00 55.73 56.35 1mm5 s ARG 115 Cb -0.13 -2.45 0.00 0.00 0.52 0.00 0.00 34.95 32.89 1mm5 s ARG 115 CO 0.57 0.07 0.00 -3.47 0.02 0.00 0.00 175.30 172.49 1mm5 n ASP 116 N -0.92 0.19 -1.65 0.23 4.64 -1.26 -4.98 116.55 112.81 1mm5 n ASP 116 Ca 0.02 0.22 0.02 0.00 -1.38 0.00 0.00 54.79 53.67 1mm5 n ASP 116 Cb 0.54 0.08 0.01 0.00 -1.04 0.00 0.00 41.12 40.71 1mm5 n ASP 116 CO 0.00 0.00 0.00 0.59 -0.82 0.00 0.00 177.20 176.97 1mm5 n ASN 117 N -3.10 0.71 0.00 1.67 3.02 -1.26 -4.96 115.26 111.34 1mm5 n ASN 117 Ca 0.00 -2.01 0.00 0.00 -0.03 0.00 0.00 54.58 52.54 1mm5 n ASN 117 Cb 0.00 -0.21 0.00 0.00 -0.61 0.00 0.00 39.78 38.96 1mm5 n ASN 117 CO 0.00 0.00 0.00 0.79 -2.62 0.00 0.00 177.26 175.43 1mm5 n TRP 118 N 0.21 0.00 0.00 3.10 7.02 -1.26 -5.10 117.44 121.41 1mm5 n TRP 118 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1mm5 n TRP 118 Cb 1.03 -0.10 0.00 0.00 -2.42 0.00 0.00 31.31 29.82 1mm5 n TRP 118 CO 0.00 0.00 0.00 0.09 -2.02 0.00 0.00 177.69 175.76 1mm5 n ASN 119 N -2.20 0.00 -1.40 -0.99 4.13 -1.26 -5.02 115.26 108.52 1mm5 n ASN 119 Ca 0.00 0.00 -0.01 0.00 1.68 0.00 0.00 54.58 56.25 1mm5 n ASN 119 Cb 0.00 0.08 0.01 0.00 -1.54 0.00 0.00 39.78 38.34 1mm5 n ASN 119 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1mm5 n TYR 120 N -1.35 -0.27 -3.76 3.10 4.19 -1.26 -5.03 117.16 112.79 1mm5 n TYR 120 Ca 0.00 -0.25 -0.24 0.00 3.31 0.00 0.00 57.90 60.72 1mm5 n TYR 120 Cb 0.00 0.61 -0.17 0.00 0.49 0.00 0.00 39.34 40.27 1mm5 n TYR 120 CO 0.00 0.00 0.00 -1.50 0.91 0.00 0.00 176.86 176.27 1mm5 s ILE 121 N 0.02 0.40 1.00 2.97 1.10 -1.26 -5.08 121.20 120.35 1mm5 s ILE 121 Ca 0.01 -0.07 -0.14 0.00 -0.51 0.00 0.00 60.65 59.94 1mm5 s ILE 121 Cb 0.06 -0.67 0.06 0.00 0.15 0.00 0.00 42.46 42.05 1mm5 s ILE 121 CO -0.02 0.12 0.28 -2.65 -2.11 0.00 0.00 174.94 170.55 1mm5 n PRO 122 N 5.13 -0.68 -3.78 3.50 -0.02 -1.26 -4.81 135.00 133.07 1mm5 n PRO 122 Ca -0.08 -0.17 -0.34 0.00 -2.02 0.00 0.00 63.50 60.90 1mm5 n PRO 122 Cb 0.49 -1.80 -0.10 0.00 -0.02 0.00 0.00 33.50 32.07 1mm5 n PRO 122 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1mm5 s LEU 123 N -1.06 5.03 0.75 2.45 0.20 -0.67 -4.91 118.68 120.47 1mm5 s LEU 123 Ca 0.56 -3.20 -0.11 0.00 0.69 0.00 0.00 54.13 52.08 1mm5 s LEU 123 Cb -0.18 -1.79 0.04 0.00 -0.43 0.00 0.00 46.19 43.83 1mm5 s LEU 123 CO 0.67 -0.26 1.08 -2.16 -0.29 0.00 0.00 176.35 175.39 1mm5 s PRO 124 N -0.56 2.45 -0.17 0.98 0.04 -1.25 -2.59 135.00 133.89 1mm5 s PRO 124 Ca 0.20 1.06 -0.04 0.00 0.04 0.00 0.00 61.00 62.26 1mm5 s PRO 124 Cb -0.17 -1.93 0.08 0.00 0.04 0.00 0.00 34.50 32.53 1mm5 s PRO 124 CO -0.06 -1.48 0.28 0.08 0.04 0.00 0.00 177.00 175.87 1mm5 s VAL 125 N -2.96 -0.44 -0.38 -0.36 1.01 -0.23 -4.90 120.40 112.14 1mm5 s VAL 125 Ca 0.60 0.12 -0.27 0.00 0.00 0.00 0.00 61.98 62.43 1mm5 s VAL 125 Cb -0.16 -0.58 0.02 0.00 0.00 0.00 0.00 36.38 35.66 1mm5 s VAL 125 CO 0.56 -0.00 0.97 -0.22 0.00 0.00 0.00 175.10 176.41 1mm5 s LEU 126 N 2.43 3.95 -0.08 3.92 0.20 -1.26 -1.31 118.68 126.53 1mm5 s LEU 126 Ca 0.04 0.63 -0.14 0.00 0.69 0.00 0.00 54.13 55.35 1mm5 s LEU 126 Cb -0.13 -3.34 0.03 0.00 -0.43 0.00 0.00 46.19 42.32 1mm5 s LEU 126 CO -0.11 -0.91 0.35 -1.48 -0.29 0.00 0.00 176.35 173.91 1mm5 s LEU 127 N 3.62 0.69 0.38 -0.68 2.34 -0.93 -4.99 118.68 119.12 1mm5 s LEU 127 Ca 0.40 0.45 -0.26 0.00 0.06 0.00 0.00 54.13 54.78 1mm5 s LEU 127 Cb -0.11 1.28 -0.09 0.00 -0.56 0.00 0.00 46.19 46.71 1mm5 s LEU 127 CO 0.20 -0.27 1.21 -2.16 -1.06 0.00 0.00 176.35 174.26 1mm5 s PRO 128 N -0.49 4.13 -0.04 1.48 0.04 -1.25 -1.20 135.00 137.67 1mm5 s PRO 128 Ca -0.06 1.96 -0.01 0.00 0.04 0.00 0.00 61.00 62.92 1mm5 s PRO 128 Cb -0.04 -2.79 0.03 0.00 0.04 0.00 0.00 34.50 31.74 1mm5 s PRO 128 CO 0.02 -0.29 0.08 -1.17 0.04 0.00 0.00 177.00 175.68 1mm5 s LEU 129 N -2.29 1.02 0.31 -3.56 0.20 0.37 -2.59 118.68 112.13 1mm5 s LEU 129 Ca 0.55 0.16 0.07 0.00 0.69 0.00 0.00 54.13 55.60 1mm5 s LEU 129 Cb -0.34 0.15 -0.03 0.00 -0.43 0.00 0.00 46.19 45.54 1mm5 s LEU 129 CO 0.43 -0.12 0.27 0.00 -0.29 0.00 0.00 176.35 176.64 1mm5 s ALA 130 N 0.98 3.78 -0.09 5.97 0.00 0.45 -2.60 121.76 130.24 1mm5 s ALA 130 Ca -0.08 -1.56 -0.04 0.00 0.00 0.00 0.00 51.96 50.28 1mm5 s ALA 130 Cb -0.11 -1.25 0.05 0.00 0.00 0.00 0.00 23.12 21.82 1mm5 s ALA 130 CO -0.04 0.09 0.20 -1.12 0.00 0.00 0.00 175.76 174.89 1mm5 s SER 131 N -3.95 0.21 -0.10 0.00 0.01 0.04 -2.57 113.70 107.33 1mm5 s SER 131 Ca 0.38 0.43 0.04 0.00 1.31 0.00 0.00 55.95 58.11 1mm5 s SER 131 Cb -0.07 0.38 0.00 0.00 0.21 0.00 0.00 66.02 66.54 1mm5 s SER 131 CO 0.26 -0.20 -0.22 0.54 0.41 0.00 0.00 173.24 174.03 1mm5 s VAL 132 N 1.80 1.91 -0.06 3.43 0.11 0.49 -1.58 120.40 126.49 1mm5 s VAL 132 Ca -0.03 -0.93 0.00 0.00 -2.93 0.00 0.00 61.98 58.10 1mm5 s VAL 132 Cb -0.12 -1.66 -0.03 0.00 -1.53 0.00 0.00 36.38 33.04 1mm5 s VAL 132 CO -0.07 0.53 -0.04 -0.83 -3.33 0.00 0.00 175.10 171.35 1mm5 s GLY 133 N 0.44 1.76 -0.29 6.54 0.00 -0.05 -1.02 107.32 114.70 1mm5 s GLY 133 Ca -0.17 -0.88 -0.03 0.00 0.00 0.00 0.00 44.72 43.64 1mm5 s GLY 133 CO 0.07 -0.67 0.56 -2.52 0.00 0.00 0.00 173.10 170.54 1mm5 s TYR 134 N -0.88 -1.40 0.00 1.90 1.13 -0.65 -1.79 117.35 115.66 1mm5 s TYR 134 Ca 0.14 1.64 0.00 0.00 -1.41 0.00 0.00 57.07 57.44 1mm5 s TYR 134 Cb -0.11 0.49 0.00 0.00 -1.10 0.00 0.00 41.96 41.24 1mm5 s TYR 134 CO 0.03 -0.81 0.00 0.41 -2.51 0.00 0.00 175.55 172.67 1mm5 n GLY 135 N 5.42 3.03 1.60 5.49 0.00 -1.26 -1.92 105.19 117.54 1mm5 n GLY 135 Ca -0.03 -0.26 -0.12 0.00 0.00 0.00 0.00 46.02 45.61 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 14.00 1.63 -3.82 1.61 -0.04 -1.26 -4.85 135.00 142.27 1mm5 n PRO 136 Ca 0.00 -1.47 -0.13 0.00 -0.04 0.00 0.00 63.50 61.86 1mm5 n PRO 136 Cb 0.00 -1.58 -0.14 0.00 -0.04 0.00 0.00 33.50 31.74 1mm5 n PRO 136 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1mm5 s VAL 137 N -1.62 -0.02 -0.14 0.52 1.01 -0.81 -4.69 120.40 114.65 1mm5 s VAL 137 Ca 0.28 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1mm5 s VAL 137 Cb 0.23 -0.14 0.02 0.00 0.00 0.00 0.00 36.38 36.50 1mm5 s VAL 137 CO 0.05 0.02 -0.13 0.42 0.00 0.00 0.00 175.10 175.47 1mm5 s THR 138 N 0.37 1.50 -0.03 3.92 -4.23 -1.07 -1.63 115.64 114.47 1mm5 s THR 138 Ca -0.03 -0.59 -0.01 0.00 -1.18 0.00 0.00 61.69 59.87 1mm5 s THR 138 Cb -0.04 -1.43 -0.04 0.00 1.34 0.00 0.00 72.50 72.34 1mm5 s THR 138 CO -0.01 0.44 0.08 0.12 -0.54 0.00 0.00 174.62 174.71 1mm5 s PHE 139 N 1.51 3.31 -0.06 3.99 2.19 -0.19 -1.07 117.98 127.67 1mm5 s PHE 139 Ca 0.05 0.25 0.02 0.00 0.33 0.00 0.00 56.93 57.57 1mm5 s PHE 139 Cb -0.13 -1.77 0.01 0.00 -1.31 0.00 0.00 43.02 39.83 1mm5 s PHE 139 CO -0.10 0.56 -0.10 -0.65 1.83 0.00 0.00 175.22 176.76 1mm5 s GLN 140 N -1.55 1.42 -0.10 10.12 1.11 0.23 -0.38 119.66 130.51 1mm5 s GLN 140 Ca 0.21 -0.32 0.04 0.00 0.01 0.00 0.00 55.36 55.29 1mm5 s GLN 140 Cb -0.12 -1.22 0.00 0.00 -1.01 0.00 0.00 33.01 30.66 1mm5 s GLN 140 CO 0.11 0.01 -0.24 1.41 0.01 0.00 0.00 175.29 176.59 1mm5 s MET 141 N 0.69 3.01 0.15 2.91 1.75 -1.06 -0.42 119.30 126.32 1mm5 s MET 141 Ca -0.13 -0.87 0.10 0.00 -1.25 0.00 0.00 55.69 53.54 1mm5 s MET 141 Cb -0.15 -2.28 -0.04 0.00 2.84 0.00 0.00 34.83 35.20 1mm5 s MET 141 CO 0.03 0.18 -0.19 -0.08 -0.65 0.00 0.00 175.02 174.30 1mm5 s THR 142 N 0.35 2.71 -0.04 10.11 -1.32 -0.24 -0.41 115.64 126.80 1mm5 s THR 142 Ca -0.19 -1.69 0.02 0.00 -1.21 0.00 0.00 61.69 58.62 1mm5 s THR 142 Cb -0.18 -2.27 0.01 0.00 -1.51 0.00 0.00 72.50 68.55 1mm5 s THR 142 CO 0.09 0.01 -0.07 -0.31 -2.21 0.00 0.00 174.62 172.12 1mm5 s TYR 143 N -1.36 0.91 -0.44 9.09 1.51 -1.07 -1.51 117.35 124.48 1mm5 s TYR 143 Ca 0.19 -0.25 -0.10 0.00 -1.01 0.00 0.00 57.07 55.90 1mm5 s TYR 143 Cb -0.10 -0.70 0.09 0.00 -0.11 0.00 0.00 41.96 41.14 1mm5 s TYR 143 CO 0.10 -0.15 0.30 -1.50 -1.11 0.00 0.00 175.55 173.19 1mm5 s ILE 144 N 0.53 4.34 1.18 2.71 1.10 -0.95 -3.74 121.20 126.37 1mm5 s ILE 144 Ca -0.08 -1.47 -0.15 0.00 -0.51 0.00 0.00 60.65 58.43 1mm5 s ILE 144 Cb -0.12 -3.71 0.24 0.00 0.15 0.00 0.00 42.46 39.02 1mm5 s ILE 144 CO 0.01 -0.59 0.65 -2.65 -2.11 0.00 0.00 174.94 170.24 1mm5 n PRO 145 N 4.95 -2.32 -2.93 3.50 -0.02 -1.26 -3.23 135.00 133.69 1mm5 n PRO 145 Ca -0.10 -0.65 0.00 0.00 -2.02 0.00 0.00 63.50 60.73 1mm5 n PRO 145 Cb 0.42 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 31.91 1mm5 n PRO 145 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mm5 n GLY 146 N 1.42 -1.65 2.42 -1.23 0.00 -1.26 -4.59 105.19 100.30 1mm5 n GLY 146 Ca 0.02 -1.48 -0.31 0.00 0.00 0.00 0.00 46.02 44.25 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 0.92 4.07 0.00 2.61 -2.24 -1.26 -4.79 114.28 113.59 1mm5 n THR 147 Ca 0.00 -3.30 0.00 0.00 -2.27 0.00 0.00 64.05 58.48 1mm5 n THR 147 Cb 0.00 -1.89 0.00 0.00 -2.10 0.00 0.00 70.33 66.34 1mm5 n THR 147 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1mm5 n TYR 148 N 1.55 0.00 0.18 4.78 4.02 -1.26 -3.56 117.16 122.87 1mm5 n TYR 148 Ca 0.55 0.00 0.15 0.00 -0.01 0.00 0.00 57.90 58.59 1mm5 n TYR 148 Cb 0.46 0.00 0.75 0.00 -0.02 0.00 0.00 39.34 40.52 1mm5 n TYR 148 CO 0.00 0.00 0.00 -0.91 -1.01 0.00 0.00 176.86 174.94 1mm5 h ASN 149 N 0.00 0.00 -0.76 7.72 4.21 -1.99 0.53 115.58 125.29 1mm5 h ASN 149 Ca 0.00 0.00 -0.32 0.00 1.21 0.00 0.00 56.30 57.19 1mm5 h ASN 149 Cb 0.00 0.00 -0.19 0.00 -1.12 0.00 0.00 38.32 37.01 1mm5 h ASN 149 CO 0.00 0.00 0.40 0.59 -1.29 0.00 0.00 177.43 177.13 1mm5 n ASN 150 N -4.18 4.10 0.00 5.81 4.13 -1.23 -4.95 115.26 118.94 1mm5 n ASN 150 Ca 0.02 -3.22 0.00 0.00 1.68 0.00 0.00 54.58 53.06 1mm5 n ASN 150 Cb 0.30 -0.76 0.00 0.00 -1.54 0.00 0.00 39.78 37.79 1mm5 n ASN 150 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mm5 n GLY 151 N -0.49 -0.43 2.70 7.41 0.00 0.17 -4.47 105.19 110.09 1mm5 n GLY 151 Ca 0.44 0.23 -0.21 0.00 0.00 0.00 0.00 46.02 46.48 1mm5 n GLY 151 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1mm5 n ASN 152 N 0.00 -5.80 -4.15 1.61 5.15 -1.20 -4.81 115.26 106.07 1mm5 n ASN 152 Ca 0.00 -0.16 -0.14 0.00 -0.60 0.00 0.00 54.58 53.68 1mm5 n ASN 152 Cb 0.00 -4.71 -0.11 0.00 -0.53 0.00 0.00 39.78 34.43 1mm5 n ASN 152 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1mm5 s VAL 153 N -3.08 0.81 0.03 3.44 0.11 -1.26 -5.06 120.40 115.40 1mm5 s VAL 153 Ca 0.16 -1.54 0.03 0.00 -2.93 0.00 0.00 61.98 57.71 1mm5 s VAL 153 Cb -0.07 -1.22 -0.02 0.00 -1.53 0.00 0.00 36.38 33.54 1mm5 s VAL 153 CO 0.20 -0.55 -0.09 -0.72 -3.33 0.00 0.00 175.10 170.61 1mm5 s TYR 154 N -2.32 0.82 0.29 1.54 -0.85 -1.26 -2.24 117.35 113.33 1mm5 s TYR 154 Ca 0.02 -0.37 0.10 0.00 -0.52 0.00 0.00 57.07 56.30 1mm5 s TYR 154 Cb -0.04 -0.49 -0.05 0.00 0.38 0.00 0.00 41.96 41.77 1mm5 s TYR 154 CO -0.01 -0.03 -0.08 -0.06 -1.52 0.00 0.00 175.55 173.86 1mm5 s PHE 155 N -0.98 2.50 0.27 -3.49 0.40 -0.57 -3.77 117.98 112.35 1mm5 s PHE 155 Ca -0.04 -0.31 0.09 0.00 -0.60 0.00 0.00 56.93 56.07 1mm5 s PHE 155 Cb -0.08 -1.17 -0.04 0.00 0.51 0.00 0.00 43.02 42.24 1mm5 s PHE 155 CO 0.01 0.63 0.01 0.00 0.70 0.00 0.00 175.22 176.57 1mm5 s ALA 156 N -2.44 3.20 -0.18 5.36 0.00 -0.98 -1.08 121.76 125.64 1mm5 s ALA 156 Ca 0.32 -1.65 -0.12 0.00 0.00 0.00 0.00 51.96 50.51 1mm5 s ALA 156 Cb -0.04 -0.79 0.06 0.00 0.00 0.00 0.00 23.12 22.34 1mm5 s ALA 156 CO 0.18 0.25 0.44 -1.58 0.00 0.00 0.00 175.76 175.05 1mm5 s TRP 157 N -2.32 -0.61 -0.13 0.00 0.23 0.44 -4.31 118.94 112.24 1mm5 s TRP 157 Ca 0.32 1.32 -0.08 0.00 -2.03 0.00 0.00 56.10 55.64 1mm5 s TRP 157 Cb -0.06 0.27 -0.04 0.00 0.03 0.00 0.00 33.47 33.66 1mm5 s TRP 157 CO 0.20 -0.33 0.15 -1.64 0.96 0.00 0.00 176.95 176.29 1mm5 s MET 158 N 1.08 3.55 -0.03 4.98 -1.94 -0.87 -0.60 119.30 125.47 1mm5 s MET 158 Ca -0.07 -0.13 0.03 0.00 -1.71 0.00 0.00 55.69 53.82 1mm5 s MET 158 Cb -0.07 -3.22 -0.00 0.00 2.01 0.00 0.00 34.83 33.55 1mm5 s MET 158 CO -0.09 0.71 -0.12 0.50 -0.01 0.00 0.00 175.02 176.01 1mm5 s ARG 159 N -0.85 1.16 -0.11 2.03 3.52 -0.24 -2.34 118.95 122.13 1mm5 s ARG 159 Ca 0.14 -0.41 -0.02 0.00 -0.13 0.00 0.00 55.73 55.32 1mm5 s ARG 159 Cb -0.12 -1.07 -0.03 0.00 -1.56 0.00 0.00 34.95 32.17 1mm5 s ARG 159 CO 0.03 0.18 -0.04 -0.06 -0.81 0.00 0.00 175.30 174.60 1mm5 s PHE 160 N 0.05 3.03 -0.25 5.12 0.40 -1.07 -2.61 117.98 122.64 1mm5 s PHE 160 Ca -0.01 -0.10 -0.16 0.00 -0.60 0.00 0.00 56.93 56.06 1mm5 s PHE 160 Cb -0.08 -1.85 -0.04 0.00 0.51 0.00 0.00 43.02 41.56 1mm5 s PHE 160 CO 0.01 0.18 0.40 -1.14 0.70 0.00 0.00 175.22 175.37 1mm5 s GLN 161 N -0.26 4.07 -0.02 0.44 0.74 -1.26 -2.60 119.66 120.78 1mm5 s GLN 161 Ca 0.04 0.13 0.01 0.00 0.05 0.00 0.00 55.36 55.60 1mm5 s GLN 161 Cb -0.13 -3.62 0.01 0.00 1.10 0.00 0.00 33.01 30.38 1mm5 s GLN 161 CO 0.02 -0.21 -0.03 0.12 -0.55 0.00 0.00 175.29 174.65 1mm5 s PHE 162 N 1.86 0.38 0.15 1.67 2.19 -0.96 -5.07 117.98 118.21 1mm5 s PHE 162 Ca 0.17 -0.06 0.07 0.00 0.33 0.00 0.00 56.93 57.45 1mm5 s PHE 162 Cb -0.15 -0.33 -0.04 0.00 -1.31 0.00 0.00 43.02 41.18 1mm5 s PHE 162 CO 0.09 -0.07 -0.16 -0.51 1.83 0.00 0.00 175.22 176.40 1mm5 s LEU 163 N 0.39 2.44 -0.16 6.12 1.02 -1.26 -2.36 118.68 124.87 1mm5 s LEU 163 Ca -0.04 -0.86 -0.21 0.00 0.02 0.00 0.00 54.13 53.05 1mm5 s LEU 163 Cb -0.07 -0.69 -0.03 0.00 0.02 0.00 0.00 46.19 45.42 1mm5 s LEU 163 CO -0.01 -0.10 0.61 -1.61 0.02 0.00 0.00 176.35 175.26 1mm5 s GLU 164 N -2.84 4.27 0.00 1.70 8.01 -1.26 -4.86 118.70 123.72 1mm5 s GLU 164 Ca 0.14 0.62 0.00 0.00 0.01 0.00 0.00 54.97 55.74 1mm5 s GLU 164 Cb -0.05 -3.53 0.00 0.00 -4.31 0.00 0.00 34.13 26.24 1mm5 s GLU 164 CO 0.05 -0.11 0.00 1.58 0.01 0.00 0.00 175.26 176.79 1mm5 n HIS 165 N 4.56 0.00 -1.40 1.61 -0.00 -1.26 -4.87 115.22 113.86 1mm5 n HIS 165 Ca -0.03 0.00 -0.16 0.00 0.46 0.00 0.00 57.72 58.00 1mm5 n HIS 165 Cb 0.50 0.33 0.17 0.00 -0.12 0.00 0.00 29.99 30.88 1mm5 n HIS 165 CO 0.00 0.00 0.00 -2.39 0.46 0.00 0.00 176.34 174.41 1mm5 n HIS 166 N -2.30 2.13 -4.17 1.57 -0.00 -1.26 -4.97 115.22 106.23 1mm5 n HIS 166 Ca 0.00 -1.89 -0.35 0.00 -0.00 0.00 0.00 57.72 55.49 1mm5 n HIS 166 Cb 0.05 -0.75 -0.10 0.00 -0.00 0.00 0.00 29.99 29.19 1mm5 n HIS 166 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 1mm5 s HIS 167 N -3.35 3.22 0.38 -1.40 4.02 -1.26 -5.09 115.29 111.81 1mm5 s HIS 167 Ca 0.52 0.10 -0.26 0.00 1.02 0.00 0.00 55.06 56.43 1mm5 s HIS 167 Cb 0.45 -1.96 -0.09 0.00 -1.02 0.00 0.00 32.58 29.96 1mm5 s HIS 167 CO 0.04 0.28 1.22 -3.38 1.02 0.00 0.00 174.74 173.92 1mm5 s HIS 168 N -0.16 3.03 0.85 1.40 -3.43 -1.26 -5.03 115.29 110.70 1mm5 s HIS 168 Ca 0.06 1.50 -0.13 0.00 -0.80 0.00 0.00 55.06 55.69 1mm5 s HIS 168 Cb -0.12 -3.51 0.11 0.00 -1.43 0.00 0.00 32.58 27.63 1mm5 s HIS 168 CO 0.02 -1.57 1.22 -1.01 -2.00 0.00 0.00 174.74 171.39 1mm5 s HIS 169 N -1.31 2.58 0.00 0.38 0.09 -1.26 -5.18 115.29 110.59 1mm5 s HIS 169 Ca 0.55 0.63 0.00 0.00 -0.00 0.00 0.00 55.06 56.24 1mm5 s HIS 169 Cb -0.34 -3.67 0.00 0.00 -0.00 0.00 0.00 32.58 28.56 1mm5 s HIS 169 CO 0.44 -2.02 0.39 0.72 -0.00 0.00 0.00 174.74 174.27