#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mm4 n ASN 2 N 0.00 1.96 0.32 6.12 5.15 -1.26 -3.82 115.26 123.73 1mm4 n ASN 2 Ca 0.00 0.29 0.19 0.00 -0.60 0.00 0.00 54.58 54.46 1mm4 n ASN 2 Cb 0.00 -0.84 1.06 0.00 -0.53 0.00 0.00 39.78 39.48 1mm4 n ASN 2 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1mm4 h ALA 3 N -0.46 1.20 0.11 5.20 0.00 -2.04 0.63 119.26 123.89 1mm4 h ALA 3 Ca -0.49 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 1mm4 h ALA 3 Cb 1.61 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1mm4 h ALA 3 CO -0.20 0.01 -0.05 0.22 0.00 0.00 0.00 179.25 179.23 1mm4 h ASP 4 N 0.00 -0.12 0.84 0.00 -0.00 -2.00 -2.06 116.42 113.08 1mm4 h ASP 4 Ca -0.00 -0.25 -0.08 0.00 -0.00 0.00 0.00 57.03 56.71 1mm4 h ASP 4 Cb 0.05 0.03 -0.01 0.00 -0.00 0.00 0.00 39.33 39.40 1mm4 h ASP 4 CO 0.00 0.47 -0.36 -0.33 -0.00 0.00 0.00 179.24 179.02 1mm4 h GLU 5 N -1.00 0.00 0.01 0.28 5.08 -1.61 -2.97 114.58 114.37 1mm4 h GLU 5 Ca -0.01 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.16 1mm4 h GLU 5 Cb 0.36 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1mm4 h GLU 5 CO 0.02 0.36 -0.87 2.35 -1.00 0.00 0.00 179.01 179.87 1mm4 h TRP 6 N 0.00 0.10 -0.75 4.33 2.91 0.16 -3.26 115.95 119.44 1mm4 h TRP 6 Ca -0.00 -0.06 -0.00 0.00 1.13 0.00 0.00 58.89 59.96 1mm4 h TRP 6 Cb 0.88 -0.01 -0.04 0.00 -0.51 0.00 0.00 29.16 29.48 1mm4 h TRP 6 CO 0.00 0.90 0.46 0.52 -1.03 0.00 0.00 178.44 179.29 1mm4 h MET 7 N 0.03 1.01 -0.21 2.65 2.86 -1.19 -1.89 114.93 118.19 1mm4 h MET 7 Ca -0.02 -0.09 0.03 0.00 -2.06 0.00 0.00 59.70 57.57 1mm4 h MET 7 Cb 1.52 -0.22 -0.01 0.00 0.06 0.00 0.00 31.60 32.95 1mm4 h MET 7 CO 0.12 0.71 0.15 1.79 1.06 0.00 0.00 176.91 180.73 1mm4 h THR 8 N 1.02 0.97 -0.19 2.22 1.35 -1.60 0.29 112.91 116.97 1mm4 h THR 8 Ca 0.27 -0.05 -0.04 0.00 -0.55 0.00 0.00 66.41 66.04 1mm4 h THR 8 Cb -0.05 0.82 -0.01 0.00 -1.73 0.00 0.00 68.15 67.18 1mm4 h THR 8 CO -0.05 0.03 -0.03 0.74 -0.25 0.00 0.00 175.52 175.95 1mm4 h THR 9 N 0.14 1.28 -0.05 6.82 2.02 -1.44 -2.57 112.91 119.10 1mm4 h THR 9 Ca 0.09 -0.98 -0.23 0.00 0.77 0.00 0.00 66.41 66.07 1mm4 h THR 9 Cb 0.20 1.53 0.01 0.00 -1.74 0.00 0.00 68.15 68.15 1mm4 h THR 9 CO -0.01 0.29 -0.90 -0.26 0.37 0.00 0.00 175.52 175.01 1mm4 h PHE 10 N 0.09 0.84 -0.25 3.16 -1.00 -1.24 -3.16 116.94 115.38 1mm4 h PHE 10 Ca 0.05 -0.42 0.05 0.00 2.81 0.00 0.00 57.97 60.46 1mm4 h PHE 10 Cb 0.46 -0.11 -0.01 0.00 3.61 0.00 0.00 35.95 39.90 1mm4 h PHE 10 CO 0.05 1.24 0.18 -0.09 -1.61 0.00 0.00 178.31 178.08 1mm4 h ARG 11 N 0.36 0.10 -0.01 1.51 1.12 -0.44 -0.19 114.38 116.83 1mm4 h ARG 11 Ca -0.08 -0.01 -0.14 0.00 -1.11 0.00 0.00 59.98 58.64 1mm4 h ARG 11 Cb 1.54 -0.02 -0.02 0.00 -0.01 0.00 0.00 29.97 31.45 1mm4 h ARG 11 CO 0.17 0.07 -0.66 1.49 -3.11 0.00 0.00 179.97 177.93 1mm4 h GLU 12 N 0.11 0.05 -0.07 0.20 4.57 -1.42 -2.45 114.58 115.57 1mm4 h GLU 12 Ca 0.11 -0.04 -0.17 0.00 -1.18 0.00 0.00 59.36 58.08 1mm4 h GLU 12 Cb 0.32 0.01 0.01 0.00 -0.16 0.00 0.00 28.75 28.93 1mm4 h GLU 12 CO -0.01 0.69 -0.62 -0.91 -1.18 0.00 0.00 179.01 176.98 1mm4 h ASN 13 N 0.04 0.66 0.27 1.04 4.21 -1.09 -2.82 115.58 117.88 1mm4 h ASN 13 Ca -0.01 -0.69 -0.08 0.00 1.21 0.00 0.00 56.30 56.74 1mm4 h ASN 13 Cb 1.17 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 38.16 1mm4 h ASN 13 CO 0.09 1.24 -0.33 0.40 -1.29 0.00 0.00 177.43 177.55 1mm4 h ILE 14 N 0.12 1.25 -0.34 2.81 1.08 -1.34 -2.08 117.51 119.01 1mm4 h ILE 14 Ca -0.06 -1.20 -0.17 0.00 -0.39 0.00 0.00 64.86 63.04 1mm4 h ILE 14 Cb 1.28 1.58 -0.00 0.00 -3.07 0.00 0.00 36.82 36.61 1mm4 h ILE 14 CO 0.12 0.35 -0.44 0.00 -0.69 0.00 0.00 178.15 177.49 1mm4 h ALA 15 N 1.59 0.51 -0.04 1.87 0.00 -1.45 -1.98 119.26 119.76 1mm4 h ALA 15 Ca 0.01 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.43 1mm4 h ALA 15 Cb 0.62 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.31 1mm4 h ALA 15 CO 0.05 0.66 -0.02 0.37 0.00 0.00 0.00 179.25 180.31 1mm4 h GLN 16 N 0.71 0.09 -0.62 0.00 4.15 -1.29 -2.81 115.11 115.33 1mm4 h GLN 16 Ca 0.04 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.43 1mm4 h GLN 16 Cb 1.05 -0.00 -0.03 0.00 0.21 0.00 0.00 27.48 28.70 1mm4 h GLN 16 CO 0.10 0.47 0.40 0.00 -1.93 0.00 0.00 178.83 177.88 1mm4 h THR 17 N -0.30 1.16 -0.58 2.39 1.03 -1.43 -0.25 112.91 114.93 1mm4 h THR 17 Ca 0.01 -0.30 -0.03 0.00 -0.01 0.00 0.00 66.41 66.07 1mm4 h THR 17 Cb 0.44 0.26 -0.03 0.00 -1.07 0.00 0.00 68.15 67.75 1mm4 h THR 17 CO 0.01 0.16 0.22 -0.25 -0.01 0.00 0.00 175.52 175.64 1mm4 h TRP 18 N 0.84 0.85 0.00 0.00 2.91 -1.29 -2.44 115.95 116.82 1mm4 h TRP 18 Ca 0.23 -0.05 -0.17 0.00 1.13 0.00 0.00 58.89 60.02 1mm4 h TRP 18 Cb -0.09 -0.26 -0.02 0.00 -0.51 0.00 0.00 29.16 28.28 1mm4 h TRP 18 CO 0.00 0.66 -0.82 1.96 -1.03 0.00 0.00 178.44 179.21 1mm4 h GLN 19 N 0.83 0.00 -3.36 2.65 4.20 -1.07 -3.50 115.11 114.85 1mm4 h GLN 19 Ca 0.20 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.91 1mm4 h GLN 19 Cb 0.18 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.96 1mm4 h GLN 19 CO -0.02 0.82 -0.87 1.04 -0.67 0.00 0.00 178.83 179.13 1mm4 n GLN 20 N -3.30 -3.75 -0.25 1.46 6.02 -0.19 -4.93 117.38 112.45 1mm4 n GLN 20 Ca 0.01 2.90 -0.11 0.00 -0.01 0.00 0.00 57.00 59.78 1mm4 n GLN 20 Cb 0.87 -3.59 0.11 0.00 1.02 0.00 0.00 30.24 28.64 1mm4 n GLN 20 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1mm4 n PRO 21 N -2.36 -1.60 -3.19 -1.09 -0.02 -1.26 -5.00 135.00 120.49 1mm4 n PRO 21 Ca 0.00 -0.55 -0.21 0.00 -2.02 0.00 0.00 63.50 60.73 1mm4 n PRO 21 Cb 0.40 -0.93 -0.05 0.00 -0.02 0.00 0.00 33.50 32.90 1mm4 n PRO 21 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1mm4 n GLU 22 N -2.03 1.00 -3.64 -0.52 0.28 -1.26 -5.08 120.64 109.39 1mm4 n GLU 22 Ca 0.05 -3.41 -0.08 0.00 -0.16 0.00 0.00 57.16 53.56 1mm4 n GLU 22 Cb 0.22 -1.55 -0.07 0.00 1.43 0.00 0.00 31.44 31.47 1mm4 n GLU 22 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 177.13 175.39 1mm4 s HIS 23 N -1.99 -0.90 -0.26 -1.84 2.46 -1.26 -4.73 115.29 106.76 1mm4 s HIS 23 Ca 0.38 1.91 0.01 0.00 0.47 0.00 0.00 55.06 57.83 1mm4 s HIS 23 Cb 0.27 0.50 0.07 0.00 -0.13 0.00 0.00 32.58 33.29 1mm4 s HIS 23 CO -0.09 -0.45 -0.00 -0.47 -2.47 0.00 0.00 174.74 171.26 1mm4 s TYR 24 N 1.22 2.41 -0.08 3.88 5.04 0.13 -4.59 117.35 125.34 1mm4 s TYR 24 Ca -0.07 -1.90 -0.05 0.00 -2.44 0.00 0.00 57.07 52.61 1mm4 s TYR 24 Cb -0.05 -1.79 -0.04 0.00 0.35 0.00 0.00 41.96 40.44 1mm4 s TYR 24 CO -0.14 -0.81 0.14 -0.51 -1.34 0.00 0.00 175.55 172.90 1mm4 s ASP 25 N 1.39 6.31 -0.11 4.32 1.01 -0.94 -0.43 116.67 128.22 1mm4 s ASP 25 Ca 0.00 0.41 -0.01 0.00 0.71 0.00 0.00 52.55 53.66 1mm4 s ASP 25 Cb -0.18 -2.01 0.03 0.00 1.01 0.00 0.00 42.92 41.77 1mm4 s ASP 25 CO -0.10 0.36 -0.02 -0.76 0.21 0.00 0.00 175.17 174.86 1mm4 s LEU 26 N -1.29 0.96 -0.39 1.23 1.02 -1.01 -1.68 118.68 117.52 1mm4 s LEU 26 Ca 0.19 -0.31 -0.22 0.00 0.02 0.00 0.00 54.13 53.81 1mm4 s LEU 26 Cb -0.12 -0.64 0.01 0.00 0.02 0.00 0.00 46.19 45.46 1mm4 s LEU 26 CO 0.08 -0.18 0.70 -0.47 0.02 0.00 0.00 176.35 176.50 1mm4 s TYR 27 N 1.84 3.10 -0.04 0.29 6.14 -0.83 -1.95 117.35 125.89 1mm4 s TYR 27 Ca 0.04 0.29 0.05 0.00 0.64 0.00 0.00 57.07 58.09 1mm4 s TYR 27 Cb -0.13 -3.33 -0.01 0.00 0.42 0.00 0.00 41.96 38.91 1mm4 s TYR 27 CO -0.07 -0.76 -0.20 0.96 0.64 0.00 0.00 175.55 176.13 1mm4 s ILE 28 N 2.92 1.63 0.65 3.14 -4.36 -0.59 -1.13 121.20 123.46 1mm4 s ILE 28 Ca 0.27 -0.84 -0.17 0.00 -0.26 0.00 0.00 60.65 59.64 1mm4 s ILE 28 Cb -0.14 -1.39 -0.04 0.00 1.25 0.00 0.00 42.46 42.15 1mm4 s ILE 28 CO 0.17 0.46 0.82 -2.65 0.24 0.00 0.00 174.94 173.98 1mm4 n PRO 29 N 2.97 0.63 -2.89 0.37 -0.02 -1.26 -2.02 135.00 132.78 1mm4 n PRO 29 Ca -0.17 0.26 -0.43 0.00 -2.02 0.00 0.00 63.50 61.14 1mm4 n PRO 29 Cb 0.53 -2.05 -0.05 0.00 -0.02 0.00 0.00 33.50 31.91 1mm4 n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mm4 s ALA 30 N -1.69 3.27 0.33 3.55 0.00 -1.26 -4.46 121.76 121.51 1mm4 s ALA 30 Ca 0.73 -0.88 0.07 0.00 0.00 0.00 0.00 51.96 51.88 1mm4 s ALA 30 Cb -0.39 -3.55 -0.07 0.00 0.00 0.00 0.00 23.12 19.11 1mm4 s ALA 30 CO 0.50 -1.97 -0.04 0.96 0.00 0.00 0.00 175.76 175.21 1mm4 s ILE 31 N 3.51 1.87 -0.30 0.00 -4.36 -1.26 -4.97 121.20 115.69 1mm4 s ILE 31 Ca 0.33 -2.11 -0.02 0.00 -0.26 0.00 0.00 60.65 58.59 1mm4 s ILE 31 Cb -0.11 -2.67 0.19 0.00 1.25 0.00 0.00 42.46 41.11 1mm4 s ILE 31 CO 0.24 -0.17 0.69 -0.89 0.24 0.00 0.00 174.94 175.05 1mm4 s THR 32 N -2.84 -0.86 0.00 8.37 2.01 -1.26 -5.09 115.64 115.96 1mm4 s THR 32 Ca 0.33 0.00 0.00 0.00 0.31 0.00 0.00 61.69 62.33 1mm4 s THR 32 Cb 0.05 -0.97 0.00 0.00 0.01 0.00 0.00 72.50 71.59 1mm4 s THR 32 CO 0.15 0.00 0.45 0.79 -0.69 0.00 0.00 174.62 175.32 1mm4 n TRP 33 N 5.42 0.00 0.00 4.92 7.02 -1.26 -4.77 117.44 128.77 1mm4 n TRP 33 Ca -0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.48 1mm4 n TRP 33 Cb 0.52 -0.10 0.00 0.00 -2.42 0.00 0.00 31.31 29.31 1mm4 n TRP 33 CO 0.00 0.00 0.00 0.72 -2.02 0.00 0.00 177.69 176.39 1mm4 n HIS 34 N -0.81 0.00 -1.51 -5.99 8.25 -1.26 -4.90 115.22 109.00 1mm4 n HIS 34 Ca 0.00 0.00 0.15 0.00 -0.26 0.00 0.00 57.72 57.61 1mm4 n HIS 34 Cb 0.00 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.03 1mm4 n HIS 34 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1mm4 n ALA 35 N 1.24 -3.55 -0.09 -1.41 0.00 -1.26 -4.64 120.51 110.79 1mm4 n ALA 35 Ca 0.00 0.89 -0.15 0.00 0.00 0.00 0.00 53.44 54.18 1mm4 n ALA 35 Cb 0.00 -1.61 -0.04 0.00 0.00 0.00 0.00 19.45 17.80 1mm4 n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1mm4 h ARG 36 N -1.16 0.89 -3.58 0.00 2.47 -2.04 -3.44 114.38 107.53 1mm4 h ARG 36 Ca -0.17 -0.55 -0.35 0.00 -1.26 0.00 0.00 59.98 57.65 1mm4 h ARG 36 Cb 1.35 0.06 -0.36 0.00 -1.65 0.00 0.00 29.97 29.37 1mm4 h ARG 36 CO 0.06 1.19 -0.74 0.12 0.56 0.00 0.00 179.97 181.16 1mm4 s PHE 37 N -4.18 0.25 -0.77 3.04 5.36 -1.26 -5.07 117.98 115.35 1mm4 s PHE 37 Ca -0.11 0.06 -0.26 0.00 -0.96 0.00 0.00 56.93 55.67 1mm4 s PHE 37 Cb 0.10 -0.45 -0.14 0.00 -0.34 0.00 0.00 43.02 42.19 1mm4 s PHE 37 CO 0.89 -0.16 2.41 0.00 -1.46 0.00 0.00 175.22 176.90 1mm4 n ALA 38 N 4.57 0.40 -2.48 11.12 0.00 -1.26 -4.90 120.51 127.96 1mm4 n ALA 38 Ca -0.18 -1.33 -0.42 0.00 0.00 0.00 0.00 53.44 51.50 1mm4 n ALA 38 Cb 0.50 -3.25 -0.03 0.00 0.00 0.00 0.00 19.45 16.67 1mm4 n ALA 38 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1mm4 s TYR 39 N 14.23 3.51 0.48 0.00 -0.85 -1.26 -5.04 117.35 128.42 1mm4 s TYR 39 Ca 0.95 1.43 -0.00 0.00 -0.52 0.00 0.00 57.07 58.92 1mm4 s TYR 39 Cb -0.16 -3.33 0.00 0.00 0.38 0.00 0.00 41.96 38.85 1mm4 s TYR 39 CO 0.11 -0.90 0.71 0.34 -1.52 0.00 0.00 175.55 174.29 1mm4 s ASP 40 N 0.97 5.72 -0.10 -0.18 2.15 -1.26 -5.10 116.67 118.87 1mm4 s ASP 40 Ca 0.56 0.27 0.04 0.00 0.43 0.00 0.00 52.55 53.85 1mm4 s ASP 40 Cb -0.27 -1.44 0.00 0.00 -0.30 0.00 0.00 42.92 40.91 1mm4 s ASP 40 CO 0.29 -0.80 -0.23 -0.54 -0.17 0.00 0.00 175.17 173.72 1mm4 s LYS 41 N -4.62 2.91 0.17 4.34 -0.14 -1.26 -5.12 119.74 116.02 1mm4 s LYS 41 Ca 0.50 -0.83 -0.22 0.00 -1.36 0.00 0.00 55.97 54.06 1mm4 s LYS 41 Cb -0.10 -2.21 -0.08 0.00 -1.68 0.00 0.00 37.83 33.76 1mm4 s LYS 41 CO 0.39 0.16 0.73 -2.00 -0.76 0.00 0.00 175.35 173.86 1mm4 s GLU 42 N 0.38 4.40 0.50 1.68 -6.30 -1.26 -4.91 118.70 113.20 1mm4 s GLU 42 Ca -0.18 1.00 0.00 0.00 -2.50 0.00 0.00 54.97 53.28 1mm4 s GLU 42 Cb -0.18 -3.12 0.00 0.00 0.00 0.00 0.00 34.13 30.84 1mm4 s GLU 42 CO 0.08 0.52 0.00 1.17 0.02 0.00 0.00 175.26 177.05 1mm4 n LYS 43 N 1.29 -3.15 -2.28 4.30 4.81 -1.26 -5.01 118.16 116.86 1mm4 n LYS 43 Ca -0.05 2.38 0.00 0.00 -0.87 0.00 0.00 58.31 59.77 1mm4 n LYS 43 Cb 0.50 -3.76 0.00 0.00 0.02 0.00 0.00 35.03 31.78 1mm4 n LYS 43 CO 0.00 0.00 0.00 2.41 1.17 0.00 0.00 177.40 180.98 1mm4 n THR 44 N -4.31-13.02 -2.73 3.15 -1.04 -1.26 -5.04 114.28 90.02 1mm4 n THR 44 Ca -0.04 3.06 -0.17 0.00 -2.04 0.00 0.00 64.05 64.86 1mm4 n THR 44 Cb 0.69 -5.96 0.08 0.00 -1.82 0.00 0.00 70.33 63.31 1mm4 n THR 44 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1mm4 n ASP 45 N 1.76 1.32 -1.11 8.00 9.92 -1.26 -5.00 116.55 130.18 1mm4 n ASP 45 Ca 0.00 -2.03 0.05 0.00 -0.53 0.00 0.00 54.79 52.27 1mm4 n ASP 45 Cb 0.00 -0.44 -0.01 0.00 -0.64 0.00 0.00 41.12 40.02 1mm4 n ASP 45 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 1mm4 n ARG 46 N -2.29 -0.67 -2.41 -1.24 1.74 -1.26 -4.80 116.66 105.73 1mm4 n ARG 46 Ca 0.13 0.44 -0.30 0.00 -0.77 0.00 0.00 57.85 57.35 1mm4 n ARG 46 Cb 0.47 -0.82 -0.01 0.00 -1.02 0.00 0.00 32.46 31.08 1mm4 n ARG 46 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1mm4 s TYR 47 N -0.51 3.53 0.48 -1.55 -0.85 -1.26 -5.06 117.35 112.13 1mm4 s TYR 47 Ca 0.00 1.18 -0.16 0.00 -0.52 0.00 0.00 57.07 57.57 1mm4 s TYR 47 Cb 0.00 -2.59 -0.08 0.00 0.38 0.00 0.00 41.96 39.67 1mm4 s TYR 47 CO 0.00 -0.38 0.93 0.54 -1.52 0.00 0.00 175.55 175.13 1mm4 s ASN 48 N -3.62 6.65 -0.31 -0.18 2.20 -1.26 -5.03 114.94 113.40 1mm4 s ASN 48 Ca 0.54 1.50 -0.18 0.00 -0.94 0.00 0.00 52.86 53.78 1mm4 s ASN 48 Cb -0.10 -2.48 -0.02 0.00 -2.00 0.00 0.00 41.25 36.65 1mm4 s ASN 48 CO 0.41 -0.51 0.52 -1.83 -2.94 0.00 0.00 177.10 172.74 1mm4 s GLU 49 N -3.88 3.86 -0.38 3.55 4.04 -1.26 -4.99 118.70 119.63 1mm4 s GLU 49 Ca 0.58 0.09 0.07 0.00 0.04 0.00 0.00 54.97 55.75 1mm4 s GLU 49 Cb -0.10 -3.73 0.18 0.00 0.02 0.00 0.00 34.13 30.50 1mm4 s GLU 49 CO 0.28 -0.50 0.58 1.03 -1.84 0.00 0.00 175.26 174.82 1mm4 s ARG 50 N 2.37 0.75 -0.32 -4.83 1.81 -1.26 -5.12 118.95 112.35 1mm4 s ARG 50 Ca 0.20 -0.23 -0.36 0.00 -1.72 0.00 0.00 55.73 53.62 1mm4 s ARG 50 Cb -0.15 -0.01 -0.12 0.00 -0.45 0.00 0.00 34.95 34.21 1mm4 s ARG 50 CO 0.11 -1.17 2.10 -2.30 -0.68 0.00 0.00 175.30 173.37 1mm4 n PRO 51 N 4.56 1.13 -0.12 3.54 -0.02 -1.26 -4.83 135.00 138.00 1mm4 n PRO 51 Ca 0.10 0.34 -0.25 0.00 -2.02 0.00 0.00 63.50 61.67 1mm4 n PRO 51 Cb 0.55 -2.39 -0.08 0.00 -0.02 0.00 0.00 33.50 31.55 1mm4 n PRO 51 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1mm4 n TRP 52 N 8.89 0.00 0.00 6.00 7.02 -1.26 -4.86 117.44 133.23 1mm4 n TRP 52 Ca 0.38 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.86 1mm4 n TRP 52 Cb 0.21 -0.83 0.00 0.00 -2.42 0.00 0.00 31.31 28.27 1mm4 n TRP 52 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1mm4 n GLY 53 N 1.57 0.82 0.00 6.99 0.00 -1.26 -4.32 105.19 108.98 1mm4 n GLY 53 Ca -0.45 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 43.76 1mm4 n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mm4 n GLY 54 N 0.00 2.94 3.15 -0.02 0.00 -1.07 -5.01 105.19 105.18 1mm4 n GLY 54 Ca 0.00 -1.45 -0.09 0.00 0.00 0.00 0.00 46.02 44.47 1mm4 n GLY 54 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1mm4 s GLY 55 N 0.00 0.82 -0.08 -0.02 0.00 -0.29 -0.45 107.32 107.29 1mm4 s GLY 55 Ca 0.00 -1.38 -0.11 0.00 0.00 0.00 0.00 44.72 43.22 1mm4 s GLY 55 CO 0.00 -1.39 0.29 -0.11 0.00 0.00 0.00 173.10 171.90 1mm4 s PHE 56 N -3.88 -0.27 0.00 1.90 -0.71 0.38 -1.97 117.98 113.42 1mm4 s PHE 56 Ca 0.16 0.63 0.00 0.00 -1.04 0.00 0.00 56.93 56.69 1mm4 s PHE 56 Cb 0.07 0.10 0.00 0.00 -1.21 0.00 0.00 43.02 41.98 1mm4 s PHE 56 CO -0.03 -0.22 0.00 0.41 -1.34 0.00 0.00 175.22 174.04 1mm4 n GLY 57 N 2.46 2.04 3.30 1.99 0.00 -0.68 -1.31 105.19 112.98 1mm4 n GLY 57 Ca -0.15 -0.76 -0.17 0.00 0.00 0.00 0.00 46.02 44.94 1mm4 n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mm4 s LEU 58 N 0.00 1.50 0.20 0.99 1.02 -0.39 -2.21 118.68 119.78 1mm4 s LEU 58 Ca 0.00 -1.63 0.08 0.00 0.02 0.00 0.00 54.13 52.61 1mm4 s LEU 58 Cb 0.00 0.65 -0.05 0.00 0.02 0.00 0.00 46.19 46.81 1mm4 s LEU 58 CO 0.00 -1.04 -0.16 -0.44 0.02 0.00 0.00 176.35 174.73 1mm4 s SER 59 N -3.30 2.70 0.00 2.29 0.01 -1.26 -2.59 113.70 111.55 1mm4 s SER 59 Ca 0.39 -0.97 0.00 0.00 1.31 0.00 0.00 55.95 56.68 1mm4 s SER 59 Cb 0.03 -0.16 -0.00 0.00 0.21 0.00 0.00 66.02 66.10 1mm4 s SER 59 CO 0.23 -0.11 -0.02 -0.13 0.41 0.00 0.00 173.24 173.62 1mm4 s ARG 60 N -3.35 0.15 -0.06 12.44 0.52 -1.05 -4.95 118.95 122.65 1mm4 s ARG 60 Ca 0.21 -0.16 -0.02 0.00 -0.52 0.00 0.00 55.73 55.24 1mm4 s ARG 60 Cb -0.03 -0.07 -0.04 0.00 0.52 0.00 0.00 34.95 35.33 1mm4 s ARG 60 CO 0.08 0.02 0.06 1.67 0.02 0.00 0.00 175.30 177.14 1mm4 s TRP 61 N -0.30 3.30 -0.15 -0.53 1.48 -1.26 -1.96 118.94 119.53 1mm4 s TRP 61 Ca -0.02 0.27 0.02 0.00 -1.06 0.00 0.00 56.10 55.31 1mm4 s TRP 61 Cb -0.02 -1.80 0.01 0.00 -1.16 0.00 0.00 33.47 30.50 1mm4 s TRP 61 CO -0.00 0.56 -0.21 0.34 -4.06 0.00 0.00 176.95 173.58 1mm4 s ASP 62 N -1.26 3.07 0.65 -2.66 2.15 0.44 -4.97 116.67 114.09 1mm4 s ASP 62 Ca 0.17 -0.60 0.35 0.00 0.43 0.00 0.00 52.55 52.90 1mm4 s ASP 62 Cb -0.12 -1.43 1.92 0.00 -0.30 0.00 0.00 42.92 43.00 1mm4 s ASP 62 CO 0.07 0.06 2.11 -0.33 -0.17 0.00 0.00 175.17 176.92 1mm4 h GLU 63 N 7.45 0.00 -0.91 4.34 5.08 -1.99 0.33 114.58 128.88 1mm4 h GLU 63 Ca -0.35 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.84 1mm4 h GLU 63 Cb 1.18 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.33 1mm4 h GLU 63 CO 0.57 0.00 0.22 1.17 -1.00 0.00 0.00 179.01 179.96 1mm4 n LYS 64 N -3.13 2.30 -2.96 2.33 4.81 -1.26 -4.87 118.16 115.38 1mm4 n LYS 64 Ca -0.02 -1.71 -0.12 0.00 -0.87 0.00 0.00 58.31 55.59 1mm4 n LYS 64 Cb 0.27 -1.77 0.06 0.00 0.02 0.00 0.00 35.03 33.61 1mm4 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mm4 n GLY 65 N -0.11 -0.24 2.99 3.14 0.00 0.09 -5.04 105.19 106.02 1mm4 n GLY 65 Ca 0.26 0.03 -0.21 0.00 0.00 0.00 0.00 46.02 46.10 1mm4 n GLY 65 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1mm4 s ASN 66 N -3.81 1.25 -0.37 1.61 3.04 -1.08 -4.92 114.94 110.67 1mm4 s ASN 66 Ca 0.08 -0.19 -0.01 0.00 0.04 0.00 0.00 52.86 52.78 1mm4 s ASN 66 Cb -0.01 -0.42 0.10 0.00 -1.54 0.00 0.00 41.25 39.37 1mm4 s ASN 66 CO 0.52 0.04 0.12 0.86 -3.04 0.00 0.00 177.10 175.60 1mm4 s TRP 67 N 0.39 3.57 0.04 0.43 -0.11 -1.00 -0.42 118.94 121.85 1mm4 s TRP 67 Ca -0.06 -2.48 -0.30 0.00 1.22 0.00 0.00 56.10 54.48 1mm4 s TRP 67 Cb -0.11 -2.92 -0.04 0.00 -1.50 0.00 0.00 33.47 28.90 1mm4 s TRP 67 CO 0.01 -0.93 1.06 -1.01 -4.62 0.00 0.00 176.95 171.45 1mm4 s HIS 68 N 1.10 3.59 -0.28 5.86 3.76 -0.83 -1.36 115.29 127.13 1mm4 s HIS 68 Ca 0.06 1.57 0.00 0.00 -0.15 0.00 0.00 55.06 56.54 1mm4 s HIS 68 Cb -0.21 -3.23 0.05 0.00 1.11 0.00 0.00 32.58 30.31 1mm4 s HIS 68 CO -0.05 -0.46 -0.05 0.20 -0.85 0.00 0.00 174.74 173.53 1mm4 s GLY 69 N 0.87 1.71 -0.20 -2.22 0.00 -0.14 -2.53 107.32 104.81 1mm4 s GLY 69 Ca 0.54 -1.76 -0.02 0.00 0.00 0.00 0.00 44.72 43.48 1mm4 s GLY 69 CO 0.29 0.65 -0.12 -2.27 0.00 0.00 0.00 173.10 171.66 1mm4 s LEU 70 N 1.18 2.54 -0.02 0.66 0.20 -1.07 -1.91 118.68 120.27 1mm4 s LEU 70 Ca -0.07 -0.51 -0.06 0.00 0.69 0.00 0.00 54.13 54.18 1mm4 s LEU 70 Cb -0.20 -1.62 0.00 0.00 -0.43 0.00 0.00 46.19 43.95 1mm4 s LEU 70 CO -0.03 -0.01 0.14 -0.31 -0.29 0.00 0.00 176.35 175.85 1mm4 s TYR 71 N 1.38 -0.02 -0.22 5.38 2.02 -0.47 -1.27 117.35 124.16 1mm4 s TYR 71 Ca 0.05 0.02 -0.01 0.00 -0.37 0.00 0.00 57.07 56.77 1mm4 s TYR 71 Cb -0.14 -0.02 0.06 0.00 -0.40 0.00 0.00 41.96 41.46 1mm4 s TYR 71 CO -0.08 -0.22 -0.01 0.00 -1.57 0.00 0.00 175.55 173.67 1mm4 s ALA 72 N -0.93 1.50 -0.09 3.71 0.00 -0.43 -1.39 121.76 124.13 1mm4 s ALA 72 Ca -0.10 -1.04 -0.04 0.00 0.00 0.00 0.00 51.96 50.78 1mm4 s ALA 72 Cb -0.06 -1.31 -0.04 0.00 0.00 0.00 0.00 23.12 21.71 1mm4 s ALA 72 CO 0.01 -1.19 0.09 1.41 0.00 0.00 0.00 175.76 176.08 1mm4 s MET 73 N 1.62 3.25 -0.02 0.00 1.75 -0.35 -0.47 119.30 125.08 1mm4 s MET 73 Ca -0.03 -0.27 0.05 0.00 -1.25 0.00 0.00 55.69 54.19 1mm4 s MET 73 Cb -0.18 -3.02 -0.01 0.00 2.84 0.00 0.00 34.83 34.46 1mm4 s MET 73 CO -0.07 0.74 -0.18 0.00 -0.65 0.00 0.00 175.02 174.86 1mm4 s ALA 74 N -1.01 1.53 -0.14 4.11 0.00 0.40 -0.43 121.76 126.21 1mm4 s ALA 74 Ca 0.16 -0.76 -0.00 0.00 0.00 0.00 0.00 51.96 51.36 1mm4 s ALA 74 Cb -0.12 -0.43 -0.01 0.00 0.00 0.00 0.00 23.12 22.56 1mm4 s ALA 74 CO 0.05 0.34 -0.14 -0.06 0.00 0.00 0.00 175.76 175.96 1mm4 s PHE 75 N -0.27 2.80 -0.27 0.00 0.08 -1.07 -2.60 117.98 116.66 1mm4 s PHE 75 Ca 0.03 -0.77 -0.01 0.00 0.12 0.00 0.00 56.93 56.30 1mm4 s PHE 75 Cb -0.09 -1.86 0.04 0.00 -0.57 0.00 0.00 43.02 40.54 1mm4 s PHE 75 CO 0.00 -0.30 -0.04 0.21 -0.10 0.00 0.00 175.22 174.99 1mm4 s LYS 76 N 0.51 2.66 1.17 0.44 2.20 -1.26 -1.51 119.74 123.95 1mm4 s LYS 76 Ca -0.09 -1.10 -0.13 0.00 -0.36 0.00 0.00 55.97 54.29 1mm4 s LYS 76 Cb -0.16 -3.05 0.29 0.00 -1.51 0.00 0.00 37.83 33.40 1mm4 s LYS 76 CO 0.04 -0.49 1.03 -0.51 -0.36 0.00 0.00 175.35 175.07 1mm4 s ASP 77 N 1.29 0.89 0.06 1.43 -0.00 -0.90 -4.73 116.67 114.71 1mm4 s ASP 77 Ca -0.02 1.60 0.04 0.00 -0.00 0.00 0.00 52.55 54.17 1mm4 s ASP 77 Cb -0.18 -2.37 -0.24 0.00 -0.00 0.00 0.00 42.92 40.13 1mm4 s ASP 77 CO -0.03 -4.27 1.08 -1.28 -0.00 0.00 0.00 175.17 170.67 1mm4 h SER 78 N -2.67 0.14 -0.69 0.27 0.87 -1.90 -3.42 113.55 106.15 1mm4 h SER 78 Ca -0.61 -0.18 -0.33 0.00 -1.23 0.00 0.00 61.79 59.44 1mm4 h SER 78 Cb 1.33 -0.05 -0.23 0.00 -0.44 0.00 0.00 62.40 63.01 1mm4 h SER 78 CO 0.49 1.14 -0.70 1.87 -0.53 0.00 0.00 176.83 179.10 1mm4 n TRP 79 N -3.35 -2.09 0.00 2.24 -0.00 -1.26 -5.01 117.44 107.96 1mm4 n TRP 79 Ca -0.07 -2.53 0.00 0.00 -0.00 0.00 0.00 57.50 54.90 1mm4 n TRP 79 Cb 0.99 0.91 0.00 0.00 -0.00 0.00 0.00 31.31 33.21 1mm4 n TRP 79 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1mm4 n ASN 80 N 1.01 0.00 0.00 5.87 4.13 -1.26 -5.18 115.26 119.82 1mm4 n ASN 80 Ca 0.13 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.39 1mm4 n ASN 80 Cb 0.64 0.03 0.00 0.00 -1.54 0.00 0.00 39.78 38.91 1mm4 n ASN 80 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 1mm4 n LYS 81 N -1.04 0.00 -4.53 3.52 4.81 -1.26 -5.02 118.16 114.64 1mm4 n LYS 81 Ca 0.00 0.00 -0.31 0.00 -0.87 0.00 0.00 58.31 57.13 1mm4 n LYS 81 Cb 0.00 0.00 -0.12 0.00 0.02 0.00 0.00 35.03 34.93 1mm4 n LYS 81 CO 0.00 0.00 0.00 1.67 1.17 0.00 0.00 177.40 180.24 1mm4 s TRP 82 N -2.00 2.62 -0.05 5.64 1.48 -1.26 -2.12 118.94 123.26 1mm4 s TRP 82 Ca 0.00 -0.21 -0.00 0.00 -1.06 0.00 0.00 56.10 54.82 1mm4 s TRP 82 Cb 0.00 -1.46 0.03 0.00 -1.16 0.00 0.00 33.47 30.87 1mm4 s TRP 82 CO 0.00 0.31 0.00 -1.21 -4.06 0.00 0.00 176.95 171.99 1mm4 s GLU 83 N -1.62 0.41 0.85 3.25 8.01 -0.57 -4.98 118.70 124.04 1mm4 s GLU 83 Ca 0.16 0.11 -0.12 0.00 0.01 0.00 0.00 54.97 55.13 1mm4 s GLU 83 Cb -0.11 -0.68 0.10 0.00 -4.31 0.00 0.00 34.13 29.13 1mm4 s GLU 83 CO 0.07 -0.21 1.12 -1.25 0.01 0.00 0.00 175.26 175.01 1mm4 s PRO 84 N 1.46 1.67 -0.15 0.39 0.04 -1.26 -2.59 135.00 134.56 1mm4 s PRO 84 Ca -0.03 0.42 -0.07 0.00 0.04 0.00 0.00 61.00 61.36 1mm4 s PRO 84 Cb -0.13 -1.89 0.06 0.00 0.04 0.00 0.00 34.50 32.58 1mm4 s PRO 84 CO -0.03 -1.86 0.34 0.42 0.04 0.00 0.00 177.00 175.91 1mm4 s ILE 85 N -3.26 -0.16 0.06 0.56 1.01 0.42 -4.57 121.20 115.26 1mm4 s ILE 85 Ca 0.62 0.14 0.00 0.00 0.00 0.00 0.00 60.65 61.42 1mm4 s ILE 85 Cb -0.14 -0.53 -0.04 0.00 0.01 0.00 0.00 42.46 41.76 1mm4 s ILE 85 CO 0.53 0.06 0.17 0.00 0.00 0.00 0.00 174.94 175.71 1mm4 s ALA 86 N 1.64 3.90 -0.22 9.38 0.00 -1.07 -1.21 121.76 134.18 1mm4 s ALA 86 Ca -0.07 -0.87 -0.17 0.00 0.00 0.00 0.00 51.96 50.84 1mm4 s ALA 86 Cb -0.10 -1.74 0.06 0.00 0.00 0.00 0.00 23.12 21.34 1mm4 s ALA 86 CO -0.11 0.80 0.58 0.20 0.00 0.00 0.00 175.76 177.23 1mm4 s GLY 87 N -2.41 -0.46 -0.03 0.00 0.00 -0.48 -0.49 107.32 103.45 1mm4 s GLY 87 Ca 0.33 1.80 -0.09 0.00 0.00 0.00 0.00 44.72 46.75 1mm4 s GLY 87 CO 0.25 1.68 0.21 -2.52 0.00 0.00 0.00 173.10 172.72 1mm4 s TYR 88 N 0.80 -0.10 0.00 1.90 1.13 0.35 -1.36 117.35 120.07 1mm4 s TYR 88 Ca -0.04 0.18 0.00 0.00 -1.41 0.00 0.00 57.07 55.80 1mm4 s TYR 88 Cb -0.05 0.03 0.00 0.00 -1.10 0.00 0.00 41.96 40.84 1mm4 s TYR 88 CO -0.06 -0.27 0.00 0.41 -2.51 0.00 0.00 175.55 173.12 1mm4 n GLY 89 N 1.82 1.25 3.12 5.49 0.00 -0.80 -0.43 105.19 115.64 1mm4 n GLY 89 Ca -0.20 -0.86 -0.18 0.00 0.00 0.00 0.00 46.02 44.78 1mm4 n GLY 89 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1mm4 s TRP 90 N -4.88 1.06 0.01 1.61 -2.14 -0.46 -0.96 118.94 113.18 1mm4 s TRP 90 Ca 0.00 -0.39 -0.18 0.00 2.66 0.00 0.00 56.10 58.19 1mm4 s TRP 90 Cb 0.00 -0.62 0.03 0.00 -3.10 0.00 0.00 33.47 29.78 1mm4 s TRP 90 CO 0.00 0.02 0.39 -1.21 -2.66 0.00 0.00 176.95 173.48 1mm4 s GLU 91 N -1.31 0.82 -0.26 3.25 2.02 -0.46 -1.57 118.70 121.18 1mm4 s GLU 91 Ca -0.02 -0.22 -0.06 0.00 0.02 0.00 0.00 54.97 54.70 1mm4 s GLU 91 Cb -0.08 0.37 -0.00 0.00 0.10 0.00 0.00 34.13 34.51 1mm4 s GLU 91 CO 0.01 -0.25 0.03 -1.12 0.02 0.00 0.00 175.26 173.95 1mm4 s SER 92 N -1.61 4.81 -0.21 -0.19 0.01 -0.57 -2.36 113.70 113.58 1mm4 s SER 92 Ca -0.10 -0.54 -0.21 0.00 1.31 0.00 0.00 55.95 56.41 1mm4 s SER 92 Cb -0.03 -1.83 -0.02 0.00 0.21 0.00 0.00 66.02 64.35 1mm4 s SER 92 CO 0.02 -0.11 0.65 -0.89 0.41 0.00 0.00 173.24 173.32 1mm4 s THR 93 N 1.50 5.00 -0.18 1.44 2.01 -1.26 -2.59 115.64 121.55 1mm4 s THR 93 Ca 0.04 1.22 -0.04 0.00 0.31 0.00 0.00 61.69 63.21 1mm4 s THR 93 Cb -0.16 -3.96 -0.02 0.00 0.01 0.00 0.00 72.50 68.37 1mm4 s THR 93 CO 0.00 0.08 -0.02 0.26 -0.69 0.00 0.00 174.62 174.25 1mm4 s TRP 94 N 2.11 3.02 -0.09 4.92 0.51 0.27 -4.99 118.94 124.69 1mm4 s TRP 94 Ca 0.29 -0.45 -0.02 0.00 -2.12 0.00 0.00 56.10 53.80 1mm4 s TRP 94 Cb -0.16 -2.03 -0.03 0.00 -0.81 0.00 0.00 33.47 30.44 1mm4 s TRP 94 CO 0.10 -0.20 -0.01 0.50 -0.51 0.00 0.00 176.95 176.84 1mm4 s ARG 95 N 0.80 3.00 1.09 4.98 3.52 -1.26 -2.56 118.95 128.52 1mm4 s ARG 95 Ca -0.01 -0.43 -0.16 0.00 -0.13 0.00 0.00 55.73 55.01 1mm4 s ARG 95 Cb -0.14 -2.78 0.23 0.00 -1.56 0.00 0.00 34.95 30.70 1mm4 s ARG 95 CO 0.02 0.67 1.12 -1.25 -0.81 0.00 0.00 175.30 175.05 1mm4 s PRO 96 N -0.80 -0.33 -1.05 5.12 0.04 -1.26 -4.98 135.00 131.74 1mm4 s PRO 96 Ca 0.12 0.13 -0.05 0.00 0.04 0.00 0.00 61.00 61.23 1mm4 s PRO 96 Cb -0.11 -1.68 0.28 0.00 0.04 0.00 0.00 34.50 33.02 1mm4 s PRO 96 CO 0.02 -3.15 1.20 1.28 0.04 0.00 0.00 177.00 176.38 1mm4 n LEU 97 N -4.40 5.61 0.03 -3.56 4.77 -1.26 -4.55 117.00 113.64 1mm4 n LEU 97 Ca 0.10 -5.14 0.00 0.00 -0.03 0.00 0.00 56.01 50.94 1mm4 n LEU 97 Cb 0.59 -1.31 0.00 0.00 -2.33 0.00 0.00 43.42 40.37 1mm4 n LEU 97 CO 0.51 1.54 0.00 0.00 -1.33 0.00 0.00 177.39 178.11 1mm4 n ALA 98 N 2.02 0.00 -3.50 -1.18 0.00 -1.26 -5.17 120.51 111.42 1mm4 n ALA 98 Ca 0.25 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.60 1mm4 n ALA 98 Cb 0.37 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.78 1mm4 n ALA 98 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1mm4 s ASP 99 N -1.47 -0.10 -1.14 0.00 1.01 -1.26 -5.07 116.67 108.63 1mm4 s ASP 99 Ca 0.00 -0.84 -0.03 0.00 0.71 0.00 0.00 52.55 52.39 1mm4 s ASP 99 Cb 0.00 0.67 0.25 0.00 1.01 0.00 0.00 42.92 44.85 1mm4 s ASP 99 CO 0.00 -1.28 1.97 -0.62 0.21 0.00 0.00 175.17 175.45 1mm4 n GLU 100 N -0.44 4.99 -0.11 8.23 1.02 -1.26 -4.51 120.64 128.56 1mm4 n GLU 100 Ca -0.03 -4.22 -0.15 0.00 -0.02 0.00 0.00 57.16 52.74 1mm4 n GLU 100 Cb 0.61 -2.55 -0.11 0.00 -0.02 0.00 0.00 31.44 29.37 1mm4 n GLU 100 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1mm4 n ASN 101 N 0.86 2.18 -3.98 1.62 4.13 -1.26 -4.90 115.26 113.91 1mm4 n ASN 101 Ca 0.49 -0.12 -0.28 0.00 1.68 0.00 0.00 54.58 56.36 1mm4 n ASN 101 Cb 0.27 -0.30 -0.17 0.00 -1.54 0.00 0.00 39.78 38.05 1mm4 n ASN 101 CO 0.00 0.00 0.00 0.12 0.28 0.00 0.00 177.26 177.66 1mm4 s PHE 102 N -2.45 1.80 -0.01 3.10 5.36 -1.26 -3.94 117.98 120.59 1mm4 s PHE 102 Ca -0.29 -0.92 0.04 0.00 -0.96 0.00 0.00 56.93 54.79 1mm4 s PHE 102 Cb 0.08 -1.38 -0.03 0.00 -0.34 0.00 0.00 43.02 41.35 1mm4 s PHE 102 CO 0.53 -0.54 -0.11 -1.01 -1.46 0.00 0.00 175.22 172.63 1mm4 s HIS 103 N 1.42 2.78 -0.05 10.12 3.76 -0.74 -4.43 115.29 128.15 1mm4 s HIS 103 Ca 0.01 -0.10 0.00 0.00 -0.15 0.00 0.00 55.06 54.82 1mm4 s HIS 103 Cb -0.13 -1.59 0.02 0.00 1.11 0.00 0.00 32.58 31.99 1mm4 s HIS 103 CO -0.07 0.30 -0.02 -1.17 -0.85 0.00 0.00 174.74 172.93 1mm4 s LEU 104 N -1.20 1.10 0.22 0.89 2.96 -1.06 -2.26 118.68 119.33 1mm4 s LEU 104 Ca 0.15 -0.09 0.00 0.00 -0.22 0.00 0.00 54.13 53.97 1mm4 s LEU 104 Cb -0.11 -0.38 -0.04 0.00 0.50 0.00 0.00 46.19 46.17 1mm4 s LEU 104 CO 0.05 -0.10 0.15 -0.83 -1.32 0.00 0.00 176.35 174.29 1mm4 s GLY 105 N 1.20 1.57 -0.05 7.98 0.00 0.38 -0.57 107.32 117.83 1mm4 s GLY 105 Ca -0.07 -1.75 -0.31 0.00 0.00 0.00 0.00 44.72 42.59 1mm4 s GLY 105 CO -0.02 -1.42 0.70 -2.27 0.00 0.00 0.00 173.10 170.10 1mm4 s LEU 106 N -3.19 -0.63 0.00 0.66 0.20 -1.07 -2.40 118.68 112.24 1mm4 s LEU 106 Ca 0.39 0.66 0.00 0.00 0.69 0.00 0.00 54.13 55.88 1mm4 s LEU 106 Cb 0.06 2.49 0.00 0.00 -0.43 0.00 0.00 46.19 48.31 1mm4 s LEU 106 CO 0.14 -0.60 0.00 0.61 -0.29 0.00 0.00 176.35 176.21 1mm4 n GLY 107 N 0.84 -0.74 3.47 7.98 0.00 -1.02 -1.52 105.19 114.20 1mm4 n GLY 107 Ca -0.18 -0.83 -0.30 0.00 0.00 0.00 0.00 46.02 44.71 1mm4 n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mm4 s PHE 108 N -3.00 2.53 -0.02 1.61 0.40 -0.61 -2.36 117.98 116.53 1mm4 s PHE 108 Ca 0.00 -0.27 0.03 0.00 -0.60 0.00 0.00 56.93 56.09 1mm4 s PHE 108 Cb 0.00 -1.40 -0.00 0.00 0.51 0.00 0.00 43.02 42.13 1mm4 s PHE 108 CO 0.00 0.32 -0.09 0.95 0.70 0.00 0.00 175.22 177.10 1mm4 s THR 109 N -1.03 0.73 0.10 0.64 -4.23 -0.76 -1.35 115.64 109.74 1mm4 s THR 109 Ca 0.16 -0.36 0.07 0.00 -1.18 0.00 0.00 61.69 60.38 1mm4 s THR 109 Cb -0.10 -0.64 -0.04 0.00 1.34 0.00 0.00 72.50 73.06 1mm4 s THR 109 CO 0.08 0.22 -0.11 0.00 -0.54 0.00 0.00 174.62 174.27 1mm4 s ALA 110 N 0.04 2.93 -0.00 3.99 0.00 0.43 -1.52 121.76 127.63 1mm4 s ALA 110 Ca -0.00 -1.25 -0.01 0.00 0.00 0.00 0.00 51.96 50.70 1mm4 s ALA 110 Cb -0.06 -0.88 -0.00 0.00 0.00 0.00 0.00 23.12 22.18 1mm4 s ALA 110 CO 0.00 0.64 0.01 0.20 0.00 0.00 0.00 175.76 176.61 1mm4 s GLY 111 N -2.20 0.03 -0.12 0.00 0.00 0.43 -0.49 107.32 104.97 1mm4 s GLY 111 Ca 0.21 -0.06 0.02 0.00 0.00 0.00 0.00 44.72 44.89 1mm4 s GLY 111 CO 0.13 -0.08 -0.15 -1.34 0.00 0.00 0.00 173.10 171.66 1mm4 s VAL 112 N -0.25 1.53 -0.22 1.40 -7.23 0.35 -0.45 120.40 115.55 1mm4 s VAL 112 Ca -0.03 -0.66 -0.04 0.00 -1.81 0.00 0.00 61.98 59.45 1mm4 s VAL 112 Cb -0.02 -1.41 -0.01 0.00 0.56 0.00 0.00 36.38 35.51 1mm4 s VAL 112 CO -0.00 0.45 -0.05 -0.89 -0.31 0.00 0.00 175.10 174.30 1mm4 s THR 113 N 1.06 3.31 0.08 5.32 2.01 -1.07 -2.59 115.64 123.77 1mm4 s THR 113 Ca -0.05 -0.51 0.05 0.00 0.31 0.00 0.00 61.69 61.49 1mm4 s THR 113 Cb -0.15 -2.50 -0.03 0.00 0.01 0.00 0.00 72.50 69.83 1mm4 s THR 113 CO -0.03 0.43 -0.15 0.00 -0.69 0.00 0.00 174.62 174.18 1mm4 s ALA 114 N 1.44 1.25 0.27 7.40 0.00 -1.26 -0.43 121.76 130.43 1mm4 s ALA 114 Ca 0.05 -1.05 0.02 0.00 0.00 0.00 0.00 51.96 50.98 1mm4 s ALA 114 Cb -0.14 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 1mm4 s ALA 114 CO -0.04 0.17 0.31 2.89 0.00 0.00 0.00 175.76 179.10 1mm4 n ARG 115 N 1.17 0.45 0.00 0.00 0.00 -1.26 -4.76 116.66 112.26 1mm4 n ARG 115 Ca -0.20 -2.39 0.00 0.00 -0.00 0.00 0.00 57.85 55.26 1mm4 n ARG 115 Cb 0.54 2.14 0.00 0.00 -0.00 0.00 0.00 32.46 35.14 1mm4 n ARG 115 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.63 174.16 1mm4 n ASP 116 N -1.84 -5.86 -3.25 2.89 2.03 -1.26 -4.81 116.55 104.44 1mm4 n ASP 116 Ca 0.03 0.00 -0.30 0.00 0.52 0.00 0.00 54.79 55.04 1mm4 n ASP 116 Cb 0.47 0.00 0.29 0.00 -0.72 0.00 0.00 41.12 41.16 1mm4 n ASP 116 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1mm4 n ASN 117 N -2.98 -3.95 -4.43 1.67 4.13 -1.26 -4.90 115.26 103.55 1mm4 n ASN 117 Ca 0.00 -0.90 -0.44 0.00 1.68 0.00 0.00 54.58 54.91 1mm4 n ASN 117 Cb 0.00 -0.99 -0.01 0.00 -1.54 0.00 0.00 39.78 37.24 1mm4 n ASN 117 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 1mm4 s TRP 118 N -2.19 3.47 0.18 3.10 0.52 -1.26 -4.37 118.94 118.39 1mm4 s TRP 118 Ca 0.67 -1.90 0.00 0.00 0.02 0.00 0.00 56.10 54.89 1mm4 s TRP 118 Cb -0.11 -4.19 0.00 0.00 -1.15 0.00 0.00 33.47 28.02 1mm4 s TRP 118 CO 0.55 -1.33 0.00 0.09 0.02 0.00 0.00 176.95 176.28 1mm4 n ASN 119 N 5.46 -1.51 -3.42 2.95 4.13 -1.26 -5.14 115.26 116.47 1mm4 n ASN 119 Ca 0.28 0.34 -0.31 0.00 1.68 0.00 0.00 54.58 56.57 1mm4 n ASN 119 Cb 0.45 1.68 0.29 0.00 -1.54 0.00 0.00 39.78 40.66 1mm4 n ASN 119 CO 0.00 0.00 0.00 -0.31 0.28 0.00 0.00 177.26 177.23 1mm4 s TYR 120 N -2.00 -0.69 -0.01 3.10 1.51 -1.26 -5.02 117.35 112.98 1mm4 s TYR 120 Ca 0.00 0.58 -0.01 0.00 -1.01 0.00 0.00 57.07 56.63 1mm4 s TYR 120 Cb 0.00 -2.88 -0.04 0.00 -0.11 0.00 0.00 41.96 38.93 1mm4 s TYR 120 CO 0.00 -5.04 0.08 0.96 -1.11 0.00 0.00 175.55 170.44 1mm4 s ILE 121 N -2.25 4.73 0.00 2.71 -4.36 -1.26 -5.05 121.20 115.72 1mm4 s ILE 121 Ca 0.69 -0.38 0.00 0.00 -0.26 0.00 0.00 60.65 60.69 1mm4 s ILE 121 Cb -0.13 -3.15 0.00 0.00 1.25 0.00 0.00 42.46 40.42 1mm4 s ILE 121 CO 0.58 0.37 0.00 -0.81 0.24 0.00 0.00 174.94 175.32 1mm4 n PRO 122 N 1.25 -0.34 -3.80 0.37 -0.04 -1.26 -4.91 135.00 126.27 1mm4 n PRO 122 Ca -0.13 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.03 1mm4 n PRO 122 Cb 0.53 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.85 1mm4 n PRO 122 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1mm4 s LEU 123 N 0.00 3.18 0.49 1.53 1.02 0.43 -4.91 118.68 120.42 1mm4 s LEU 123 Ca 0.00 -2.52 -0.22 0.00 0.02 0.00 0.00 54.13 51.41 1mm4 s LEU 123 Cb 0.00 -1.20 -0.07 0.00 0.02 0.00 0.00 46.19 44.94 1mm4 s LEU 123 CO 0.00 -0.29 1.18 -2.16 0.02 0.00 0.00 176.35 175.10 1mm4 s PRO 124 N 0.45 3.59 -0.11 1.29 0.04 -1.26 -2.59 135.00 136.41 1mm4 s PRO 124 Ca 0.16 1.80 -0.16 0.00 0.04 0.00 0.00 61.00 62.84 1mm4 s PRO 124 Cb -0.23 -2.30 0.04 0.00 0.04 0.00 0.00 34.50 32.04 1mm4 s PRO 124 CO -0.04 -0.70 0.42 0.14 0.04 0.00 0.00 177.00 176.86 1mm4 s VAL 125 N -1.55 0.02 -0.14 -0.36 -7.23 0.41 -4.97 120.40 106.57 1mm4 s VAL 125 Ca 0.67 -0.13 -0.01 0.00 -1.81 0.00 0.00 61.98 60.70 1mm4 s VAL 125 Cb -0.29 -0.64 0.03 0.00 0.56 0.00 0.00 36.38 36.04 1mm4 s VAL 125 CO 0.35 -0.07 -0.06 -0.76 -0.31 0.00 0.00 175.10 174.25 1mm4 s LEU 126 N -0.32 1.38 0.02 1.32 1.02 -1.26 -0.43 118.68 120.41 1mm4 s LEU 126 Ca -0.05 -0.49 0.01 0.00 0.02 0.00 0.00 54.13 53.62 1mm4 s LEU 126 Cb -0.03 -0.86 -0.02 0.00 0.02 0.00 0.00 46.19 45.30 1mm4 s LEU 126 CO 0.02 -0.16 -0.05 -0.76 0.02 0.00 0.00 176.35 175.42 1mm4 s LEU 127 N 1.68 2.19 0.45 1.79 1.43 -0.57 -5.00 118.68 120.64 1mm4 s LEU 127 Ca 0.03 -0.42 -0.23 0.00 -1.03 0.00 0.00 54.13 52.48 1mm4 s LEU 127 Cb -0.14 -0.08 -0.08 0.00 0.03 0.00 0.00 46.19 45.92 1mm4 s LEU 127 CO -0.08 -0.18 1.13 -2.16 0.23 0.00 0.00 176.35 175.30 1mm4 s PRO 128 N -1.18 3.86 0.03 1.29 0.04 -1.23 -1.84 135.00 135.96 1mm4 s PRO 128 Ca -0.09 1.69 -0.04 0.00 0.04 0.00 0.00 61.00 62.60 1mm4 s PRO 128 Cb -0.08 -2.43 -0.01 0.00 0.04 0.00 0.00 34.50 32.02 1mm4 s PRO 128 CO -0.00 -0.45 0.06 -1.17 0.04 0.00 0.00 177.00 175.49 1mm4 s LEU 129 N -2.95 1.91 -0.01 -3.56 0.20 -1.00 -1.45 118.68 111.83 1mm4 s LEU 129 Ca 0.62 -0.49 0.07 0.00 0.69 0.00 0.00 54.13 55.02 1mm4 s LEU 129 Cb -0.26 0.46 -0.02 0.00 -0.43 0.00 0.00 46.19 45.94 1mm4 s LEU 129 CO 0.32 -0.43 -0.22 0.00 -0.29 0.00 0.00 176.35 175.73 1mm4 s ALA 130 N -2.16 1.83 -0.14 5.97 0.00 0.37 -2.45 121.76 125.18 1mm4 s ALA 130 Ca -0.09 -0.97 -0.06 0.00 0.00 0.00 0.00 51.96 50.84 1mm4 s ALA 130 Cb -0.04 -0.45 -0.04 0.00 0.00 0.00 0.00 23.12 22.59 1mm4 s ALA 130 CO -0.03 0.44 0.07 0.45 0.00 0.00 0.00 175.76 176.69 1mm4 s SER 131 N -0.62 5.71 -0.09 0.00 0.15 -1.01 -1.31 113.70 116.54 1mm4 s SER 131 Ca 0.08 0.20 -0.03 0.00 0.70 0.00 0.00 55.95 56.90 1mm4 s SER 131 Cb -0.09 -1.86 0.04 0.00 -1.71 0.00 0.00 66.02 62.41 1mm4 s SER 131 CO -0.00 0.29 0.06 -0.69 1.20 0.00 0.00 173.24 174.10 1mm4 s VAL 132 N -0.32 -0.02 -0.40 4.45 1.01 0.44 -0.47 120.40 125.10 1mm4 s VAL 132 Ca 0.09 0.15 -0.15 0.00 0.00 0.00 0.00 61.98 62.07 1mm4 s VAL 132 Cb -0.12 -0.37 0.01 0.00 0.00 0.00 0.00 36.38 35.90 1mm4 s VAL 132 CO 0.02 0.02 0.30 -0.83 0.00 0.00 0.00 175.10 174.60 1mm4 s GLY 133 N 2.12 2.00 -0.19 4.51 0.00 -0.96 -0.45 107.32 114.35 1mm4 s GLY 133 Ca 0.04 -1.64 0.01 0.00 0.00 0.00 0.00 44.72 43.12 1mm4 s GLY 133 CO -0.05 0.90 -0.10 -0.47 0.00 0.00 0.00 173.10 173.38 1mm4 s TYR 134 N 1.71 2.34 0.00 1.90 6.14 -1.00 -1.80 117.35 126.64 1mm4 s TYR 134 Ca 0.06 -1.53 0.00 0.00 0.64 0.00 0.00 57.07 56.24 1mm4 s TYR 134 Cb -0.19 -1.61 0.00 0.00 0.42 0.00 0.00 41.96 40.59 1mm4 s TYR 134 CO 0.10 -0.73 0.00 0.41 0.64 0.00 0.00 175.55 175.97 1mm4 n GLY 135 N 4.71 1.03 0.00 8.97 0.00 -1.25 -2.51 105.19 116.14 1mm4 n GLY 135 Ca -0.15 -0.61 0.10 0.00 0.00 0.00 0.00 46.02 45.37 1mm4 n GLY 135 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mm4 n PRO 136 N 0.00 0.23 -4.23 1.61 -0.04 -1.26 -4.77 135.00 126.54 1mm4 n PRO 136 Ca 0.00 0.11 -0.26 0.00 -0.04 0.00 0.00 63.50 63.31 1mm4 n PRO 136 Cb 0.00 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 31.88 1mm4 n PRO 136 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1mm4 s VAL 137 N -2.66 3.59 0.03 0.52 1.01 -1.04 -4.69 120.40 117.16 1mm4 s VAL 137 Ca 0.17 -1.51 0.08 0.00 0.00 0.00 0.00 61.98 60.72 1mm4 s VAL 137 Cb 0.13 -2.81 -0.03 0.00 0.00 0.00 0.00 36.38 33.68 1mm4 s VAL 137 CO 0.32 -0.13 -0.22 -0.89 0.00 0.00 0.00 175.10 174.18 1mm4 s THR 138 N -1.77 2.46 -0.05 3.92 2.01 -0.76 -2.38 115.64 119.07 1mm4 s THR 138 Ca 0.27 -1.24 0.04 0.00 0.31 0.00 0.00 61.69 61.07 1mm4 s THR 138 Cb -0.09 -1.98 0.00 0.00 0.01 0.00 0.00 72.50 70.44 1mm4 s THR 138 CO 0.18 0.39 -0.15 -0.36 -0.69 0.00 0.00 174.62 173.99 1mm4 s PHE 139 N -0.83 1.57 -0.15 4.92 0.08 0.40 -0.76 117.98 123.21 1mm4 s PHE 139 Ca 0.13 -0.49 0.00 0.00 0.12 0.00 0.00 56.93 56.69 1mm4 s PHE 139 Cb -0.10 -1.09 0.03 0.00 -0.57 0.00 0.00 43.02 41.29 1mm4 s PHE 139 CO 0.03 -0.19 -0.12 -0.65 -0.10 0.00 0.00 175.22 174.18 1mm4 s GLN 140 N 0.23 2.10 0.06 0.44 -0.21 -1.04 -0.42 119.66 120.82 1mm4 s GLN 140 Ca -0.07 -0.57 -0.11 0.00 0.02 0.00 0.00 55.36 54.63 1mm4 s GLN 140 Cb -0.12 -2.09 -0.06 0.00 1.00 0.00 0.00 33.01 31.74 1mm4 s GLN 140 CO 0.03 -0.29 0.40 -1.64 -2.12 0.00 0.00 175.29 171.67 1mm4 s MET 141 N 1.51 3.78 -0.18 2.91 -1.94 -0.42 -2.37 119.30 122.59 1mm4 s MET 141 Ca 0.04 0.22 -0.02 0.00 -1.71 0.00 0.00 55.69 54.21 1mm4 s MET 141 Cb -0.14 -3.04 -0.01 0.00 2.01 0.00 0.00 34.83 33.65 1mm4 s MET 141 CO -0.10 0.59 -0.08 0.95 -0.01 0.00 0.00 175.02 176.37 1mm4 s THR 142 N -1.33 3.20 -0.01 2.05 -4.23 -1.07 -0.48 115.64 113.77 1mm4 s THR 142 Ca 0.31 -0.58 0.00 0.00 -1.18 0.00 0.00 61.69 60.24 1mm4 s THR 142 Cb -0.14 -2.41 -0.04 0.00 1.34 0.00 0.00 72.50 71.25 1mm4 s THR 142 CO 0.17 0.47 0.05 -0.47 -0.54 0.00 0.00 174.62 174.30 1mm4 s TYR 143 N 1.00 3.22 -0.29 3.99 5.04 -0.53 -2.59 117.35 127.19 1mm4 s TYR 143 Ca -0.01 0.17 -0.04 0.00 -2.44 0.00 0.00 57.07 54.76 1mm4 s TYR 143 Cb -0.15 -1.72 0.10 0.00 0.35 0.00 0.00 41.96 40.55 1mm4 s TYR 143 CO -0.01 0.52 0.15 0.42 -1.34 0.00 0.00 175.55 175.30 1mm4 s ILE 144 N -1.15 -0.11 0.58 3.14 1.09 -1.26 -3.56 121.20 119.93 1mm4 s ILE 144 Ca 0.21 -0.73 -0.18 0.00 -1.10 0.00 0.00 60.65 58.86 1mm4 s ILE 144 Cb -0.12 -0.98 -0.04 0.00 -1.06 0.00 0.00 42.46 40.26 1mm4 s ILE 144 CO 0.12 -0.70 1.11 -2.16 -0.10 0.00 0.00 174.94 173.22 1mm4 s PRO 145 N 2.13 3.21 0.00 2.79 0.04 -1.26 -4.68 135.00 137.23 1mm4 s PRO 145 Ca 0.09 1.50 0.00 0.00 0.04 0.00 0.00 61.00 62.63 1mm4 s PRO 145 Cb -0.16 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.39 1mm4 s PRO 145 CO -0.36 -0.95 0.00 0.41 0.04 0.00 0.00 177.00 176.14 1mm4 n GLY 146 N -0.17 4.22 3.25 0.56 0.00 -1.26 -5.08 105.19 106.71 1mm4 n GLY 146 Ca 0.11 -0.74 -0.43 0.00 0.00 0.00 0.00 46.02 44.96 1mm4 n GLY 146 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1mm4 s THR 147 N -1.63 4.67 0.00 2.61 2.01 -1.26 -3.70 115.64 118.35 1mm4 s THR 147 Ca 0.00 -1.88 0.00 0.00 0.31 0.00 0.00 61.69 60.12 1mm4 s THR 147 Cb 0.00 -4.02 0.00 0.00 0.01 0.00 0.00 72.50 68.49 1mm4 s THR 147 CO 0.00 -0.85 0.00 -1.22 -0.69 0.00 0.00 174.62 171.86 1mm4 n TYR 148 N 4.78 0.00 0.02 4.92 4.01 -1.26 -5.04 117.16 124.58 1mm4 n TYR 148 Ca -0.06 0.00 -0.02 0.00 -0.16 0.00 0.00 57.90 57.67 1mm4 n TYR 148 Cb 0.41 0.39 -0.01 0.00 -0.31 0.00 0.00 39.34 39.82 1mm4 n TYR 148 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1mm4 n ASN 149 N -2.32 1.09 -0.09 7.72 3.02 -1.26 -4.96 115.26 118.44 1mm4 n ASN 149 Ca 0.00 0.15 -0.19 0.00 -0.03 0.00 0.00 54.58 54.51 1mm4 n ASN 149 Cb 0.00 -0.38 -0.06 0.00 -0.61 0.00 0.00 39.78 38.73 1mm4 n ASN 149 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 1mm4 n ASN 150 N -3.51 1.47 -1.33 6.41 4.13 -1.26 -5.02 115.26 116.16 1mm4 n ASN 150 Ca -0.03 0.25 -0.12 0.00 1.68 0.00 0.00 54.58 56.37 1mm4 n ASN 150 Cb 0.10 -0.60 -0.01 0.00 -1.54 0.00 0.00 39.78 37.72 1mm4 n ASN 150 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1mm4 n GLY 151 N 1.77 0.08 1.40 7.41 0.00 -1.24 -4.82 105.19 109.78 1mm4 n GLY 151 Ca -0.35 -0.39 -0.02 0.00 0.00 0.00 0.00 46.02 45.26 1mm4 n GLY 151 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1mm4 n ASN 152 N -0.28 -0.50 -4.74 1.61 6.94 -1.26 -4.66 115.26 112.37 1mm4 n ASN 152 Ca -0.14 -1.18 -0.40 0.00 -0.02 0.00 0.00 54.58 52.84 1mm4 n ASN 152 Cb 0.58 0.21 -0.05 0.00 -2.36 0.00 0.00 39.78 38.16 1mm4 n ASN 152 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 1mm4 s VAL 153 N 0.03 4.86 -0.14 3.53 -7.23 -1.26 -5.06 120.40 115.13 1mm4 s VAL 153 Ca 0.02 1.49 -0.01 0.00 -1.81 0.00 0.00 61.98 61.67 1mm4 s VAL 153 Cb 0.10 -4.05 -0.02 0.00 0.56 0.00 0.00 36.38 32.97 1mm4 s VAL 153 CO -0.03 0.34 -0.11 -0.31 -0.31 0.00 0.00 175.10 174.69 1mm4 s TYR 154 N 0.16 2.86 0.28 2.82 1.51 -1.26 -4.33 117.35 119.40 1mm4 s TYR 154 Ca 0.37 -0.59 0.07 0.00 -1.01 0.00 0.00 57.07 55.90 1mm4 s TYR 154 Cb -0.19 -1.88 -0.03 0.00 -0.11 0.00 0.00 41.96 39.75 1mm4 s TYR 154 CO 0.20 -0.19 0.30 0.12 -1.11 0.00 0.00 175.55 174.87 1mm4 s PHE 155 N 0.40 3.12 -0.04 2.71 5.36 -1.07 -4.96 117.98 123.50 1mm4 s PHE 155 Ca -0.09 -0.16 -0.03 0.00 -0.96 0.00 0.00 56.93 55.69 1mm4 s PHE 155 Cb -0.15 -1.63 0.01 0.00 -0.34 0.00 0.00 43.02 40.90 1mm4 s PHE 155 CO 0.05 0.33 0.10 0.00 -1.46 0.00 0.00 175.22 174.24 1mm4 s ALA 156 N -2.16 -0.24 0.04 11.12 0.00 -1.26 -2.59 121.76 126.67 1mm4 s ALA 156 Ca 0.37 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.63 1mm4 s ALA 156 Cb -0.08 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.85 1mm4 s ALA 156 CO 0.27 -0.05 -0.06 -1.58 0.00 0.00 0.00 175.76 174.34 1mm4 s TRP 157 N 0.08 0.56 -0.00 0.00 0.51 -1.00 -4.58 118.94 114.51 1mm4 s TRP 157 Ca -0.00 -0.59 -0.13 0.00 -2.12 0.00 0.00 56.10 53.25 1mm4 s TRP 157 Cb -0.01 -0.35 -0.06 0.00 -0.81 0.00 0.00 33.47 32.24 1mm4 s TRP 157 CO 0.00 -0.14 0.38 1.41 -0.51 0.00 0.00 176.95 178.09 1mm4 s MET 158 N -1.95 3.85 -0.01 4.98 1.75 -0.86 -2.51 119.30 124.55 1mm4 s MET 158 Ca -0.08 0.33 0.01 0.00 -1.25 0.00 0.00 55.69 54.70 1mm4 s MET 158 Cb -0.07 -3.19 0.00 0.00 2.84 0.00 0.00 34.83 34.41 1mm4 s MET 158 CO -0.01 0.69 -0.03 0.50 -0.65 0.00 0.00 175.02 175.51 1mm4 s ARG 159 N -1.18 0.34 -0.20 4.11 3.52 0.06 -1.54 118.95 124.07 1mm4 s ARG 159 Ca 0.24 -0.10 -0.02 0.00 -0.13 0.00 0.00 55.73 55.73 1mm4 s ARG 159 Cb -0.16 -0.36 0.00 0.00 -1.56 0.00 0.00 34.95 32.87 1mm4 s ARG 159 CO 0.13 0.03 -0.11 0.12 -0.81 0.00 0.00 175.30 174.66 1mm4 s PHE 160 N 0.17 2.87 -0.17 5.12 2.19 -0.82 -1.83 117.98 125.51 1mm4 s PHE 160 Ca -0.01 -1.18 -0.22 0.00 0.33 0.00 0.00 56.93 55.85 1mm4 s PHE 160 Cb -0.04 -2.01 -0.03 0.00 -1.31 0.00 0.00 43.02 39.63 1mm4 s PHE 160 CO -0.00 -0.62 0.65 -0.65 1.83 0.00 0.00 175.22 176.43 1mm4 s GLN 161 N 1.31 4.26 -0.23 10.12 -0.21 -1.26 -2.39 119.66 131.25 1mm4 s GLN 161 Ca 0.04 0.69 -0.02 0.00 0.02 0.00 0.00 55.36 56.09 1mm4 s GLN 161 Cb -0.14 -3.55 0.02 0.00 1.00 0.00 0.00 33.01 30.34 1mm4 s GLN 161 CO -0.06 -0.18 -0.07 0.12 -2.12 0.00 0.00 175.29 172.97 1mm4 s PHE 162 N 1.71 3.00 -0.58 0.91 2.19 0.43 -5.03 117.98 120.61 1mm4 s PHE 162 Ca 0.31 -1.40 -0.03 0.00 0.33 0.00 0.00 56.93 56.14 1mm4 s PHE 162 Cb -0.16 -2.06 0.15 0.00 -1.31 0.00 0.00 43.02 39.65 1mm4 s PHE 162 CO 0.12 -0.69 0.39 -0.51 1.83 0.00 0.00 175.22 176.36 1mm4 s LEU 163 N 1.36 5.21 -0.12 6.12 1.02 -1.26 -0.70 118.68 130.32 1mm4 s LEU 163 Ca 0.02 -2.71 -0.02 0.00 0.02 0.00 0.00 54.13 51.44 1mm4 s LEU 163 Cb -0.16 -1.84 -0.03 0.00 0.02 0.00 0.00 46.19 44.18 1mm4 s LEU 163 CO -0.05 -0.40 -0.05 -0.70 0.02 0.00 0.00 176.35 175.17 1mm4 s GLU 164 N 0.14 3.30 -0.46 1.70 2.12 -1.26 -5.04 118.70 119.20 1mm4 s GLU 164 Ca 0.15 -0.53 0.03 0.00 0.36 0.00 0.00 54.97 54.98 1mm4 s GLU 164 Cb -0.21 -2.78 0.21 0.00 0.26 0.00 0.00 34.13 31.61 1mm4 s GLU 164 CO -0.03 0.42 0.87 1.58 -0.54 0.00 0.00 175.26 177.56 1mm4 n HIS 165 N 2.98 -2.82 -3.25 5.30 -0.00 -1.26 -4.72 115.22 111.46 1mm4 n HIS 165 Ca -0.18 -1.20 -0.21 0.00 0.46 0.00 0.00 57.72 56.60 1mm4 n HIS 165 Cb 0.53 1.38 0.04 0.00 -0.12 0.00 0.00 29.99 31.81 1mm4 n HIS 165 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 1mm4 s HIS 166 N 0.84 1.67 0.58 1.57 3.76 -1.26 -5.02 115.29 117.42 1mm4 s HIS 166 Ca 0.28 -0.70 0.00 0.00 -0.15 0.00 0.00 55.06 54.49 1mm4 s HIS 166 Cb 0.07 -2.16 0.00 0.00 1.11 0.00 0.00 32.58 31.60 1mm4 s HIS 166 CO -0.09 -0.87 0.00 1.58 -0.85 0.00 0.00 174.74 174.50 1mm4 n HIS 167 N -2.06 -3.94 -2.38 1.40 -0.00 -1.26 -4.97 115.22 102.00 1mm4 n HIS 167 Ca 0.10 2.15 -0.04 0.00 -0.00 0.00 0.00 57.72 59.94 1mm4 n HIS 167 Cb 0.62 -3.43 0.04 0.00 -0.00 0.00 0.00 29.99 27.22 1mm4 n HIS 167 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1mm4 n HIS 168 N -3.17 -1.09 -3.64 1.57 8.25 -1.26 -5.10 115.22 110.78 1mm4 n HIS 168 Ca -0.03 -1.18 -0.01 0.00 -0.26 0.00 0.00 57.72 56.23 1mm4 n HIS 168 Cb 0.53 1.05 -0.04 0.00 1.12 0.00 0.00 29.99 32.65 1mm4 n HIS 168 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1mm4 s HIS 169 N 0.00 -1.33 -2.12 4.41 5.65 -1.26 -5.37 115.29 115.28 1mm4 s HIS 169 Ca 0.06 2.28 0.31 0.00 0.25 0.00 0.00 55.06 57.96 1mm4 s HIS 169 Cb 0.25 0.78 1.70 0.00 -1.18 0.00 0.00 32.58 34.12 1mm4 s HIS 169 CO -0.07 -0.67 2.11 0.72 -0.65 0.00 0.00 174.74 176.18