#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mm4 s ASN 2 N 0.00 1.79 0.64 7.83 2.47 -1.26 -5.00 114.94 121.41 1mm4 s ASN 2 Ca 0.00 -1.17 0.36 0.00 0.42 0.00 0.00 52.86 52.47 1mm4 s ASN 2 Cb 0.00 0.01 2.00 0.00 -1.45 0.00 0.00 41.25 41.81 1mm4 s ASN 2 CO 0.00 -0.47 2.19 0.00 -3.72 0.00 0.00 177.10 175.10 1mm4 h ALA 3 N 2.55 1.33 0.10 1.71 0.00 -2.05 0.54 119.26 123.44 1mm4 h ALA 3 Ca -0.38 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.53 1mm4 h ALA 3 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1mm4 h ALA 3 CO 0.64 -0.15 -0.05 0.22 0.00 0.00 0.00 179.25 179.91 1mm4 h ASP 4 N 0.00 -0.12 0.70 0.00 1.82 -2.01 -3.06 116.42 113.75 1mm4 h ASP 4 Ca 0.02 -0.25 -0.06 0.00 -0.39 0.00 0.00 57.03 56.35 1mm4 h ASP 4 Cb 0.28 0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.31 1mm4 h ASP 4 CO -0.00 0.47 -0.29 -0.33 -1.61 0.00 0.00 179.24 177.48 1mm4 h GLU 5 N -1.00 0.00 -0.53 0.28 5.08 -1.87 -3.00 114.58 113.54 1mm4 h GLU 5 Ca -0.01 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.30 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 0.29 0.14 -1.49 -1.00 0.00 0.00 179.01 176.98 1mm4 h TRP 6 N 0.00 0.88 -0.29 4.33 -0.00 -0.04 -1.35 115.95 119.48 1mm4 h TRP 6 Ca -0.00 -0.10 -0.02 0.00 -0.00 0.00 0.00 58.89 58.77 1mm4 h TRP 6 Cb 0.72 -0.25 -0.01 0.00 -0.00 0.00 0.00 29.16 29.61 1mm4 h TRP 6 CO 0.00 0.77 0.11 1.98 -0.00 0.00 0.00 178.44 181.30 1mm4 h MET 7 N 0.75 0.43 -0.12 0.49 4.05 -1.42 -0.70 114.93 118.41 1mm4 h MET 7 Ca 0.17 -0.08 0.00 0.00 -0.28 0.00 0.00 59.70 59.51 1mm4 h MET 7 Cb 0.31 -0.07 -0.01 0.00 -0.80 0.00 0.00 31.60 31.04 1mm4 h MET 7 CO -0.00 0.46 0.08 1.79 0.23 0.00 0.00 176.91 179.46 1mm4 h THR 8 N 0.32 1.05 -0.88 -0.77 1.35 -1.48 0.30 112.91 112.78 1mm4 h THR 8 Ca 0.10 -0.10 0.00 0.00 -0.55 0.00 0.00 66.41 65.85 1mm4 h THR 8 Cb 0.19 0.90 -0.04 0.00 -1.73 0.00 0.00 68.15 67.47 1mm4 h THR 8 CO -0.01 0.04 0.55 0.74 -0.25 0.00 0.00 175.52 176.60 1mm4 h THR 9 N 0.14 1.24 -0.10 6.82 2.02 -1.16 -2.17 112.91 119.70 1mm4 h THR 9 Ca 0.04 -0.48 -0.14 0.00 0.77 0.00 0.00 66.41 66.60 1mm4 h THR 9 Cb 0.00 -0.03 -0.01 0.00 -1.74 0.00 0.00 68.15 66.37 1mm4 h THR 9 CO -0.01 0.24 -0.56 -0.26 0.37 0.00 0.00 175.52 175.31 1mm4 h PHE 10 N 1.21 0.36 -0.46 3.16 -1.00 -0.81 -3.03 116.94 116.37 1mm4 h PHE 10 Ca 0.32 -0.13 -0.02 0.00 2.81 0.00 0.00 57.97 60.95 1mm4 h PHE 10 Cb -0.09 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 39.38 1mm4 h PHE 10 CO -0.00 0.78 0.18 -0.09 -1.61 0.00 0.00 178.31 177.57 1mm4 h ARG 11 N 0.22 0.65 -0.10 1.51 2.43 0.21 -1.72 114.38 117.58 1mm4 h ARG 11 Ca 0.00 -0.09 -0.06 0.00 -0.81 0.00 0.00 59.98 59.02 1mm4 h ARG 11 Cb 1.05 -0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 1mm4 h ARG 11 CO 0.09 0.54 -0.21 1.49 -1.51 0.00 0.00 179.97 180.37 1mm4 h GLU 12 N 0.65 0.17 0.06 0.20 4.81 -1.33 -0.18 114.58 118.96 1mm4 h GLU 12 Ca 0.16 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.34 1mm4 h GLU 12 Cb 0.13 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.50 1mm4 h GLU 12 CO -0.02 0.38 -0.03 -0.97 -0.73 0.00 0.00 179.01 177.64 1mm4 h ASN 13 N 0.16 -0.07 -0.53 1.04 -0.73 -1.39 -2.25 115.58 111.81 1mm4 h ASN 13 Ca 0.03 -0.54 0.01 0.00 1.87 0.00 0.00 56.30 57.67 1mm4 h ASN 13 Cb 0.46 0.02 -0.03 0.00 0.27 0.00 0.00 38.32 39.04 1mm4 h ASN 13 CO 0.03 0.63 0.35 -0.29 -0.37 0.00 0.00 177.43 177.78 1mm4 h ILE 14 N -0.91 1.13 -0.13 2.57 2.10 -1.31 -1.07 117.51 119.90 1mm4 h ILE 14 Ca -0.01 -0.24 -0.18 0.00 1.08 0.00 0.00 64.86 65.51 1mm4 h ILE 14 Cb 0.60 0.36 -0.00 0.00 -1.09 0.00 0.00 36.82 36.69 1mm4 h ILE 14 CO 0.01 0.13 -0.66 0.00 -1.08 0.00 0.00 178.15 176.56 1mm4 h ALA 15 N 1.67 0.62 -0.28 0.18 0.00 -1.11 -1.65 119.26 118.69 1mm4 h ALA 15 Ca 0.19 -0.57 -0.14 0.00 0.00 0.00 0.00 54.91 54.40 1mm4 h ALA 15 Cb -0.08 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1mm4 h ALA 15 CO -0.04 0.72 -0.40 0.37 0.00 0.00 0.00 179.25 179.90 1mm4 h GLN 16 N 0.35 0.68 -0.09 0.00 4.15 -0.73 -2.58 115.11 116.89 1mm4 h GLN 16 Ca -0.02 -0.35 -0.22 0.00 0.77 0.00 0.00 58.65 58.83 1mm4 h GLN 16 Cb 1.22 0.01 0.01 0.00 0.21 0.00 0.00 27.48 28.93 1mm4 h GLN 16 CO 0.12 0.96 -0.82 1.79 -1.93 0.00 0.00 178.83 178.95 1mm4 h THR 17 N 0.56 1.32 0.39 2.39 1.35 -1.20 -0.65 112.91 117.07 1mm4 h THR 17 Ca 0.05 -2.11 -0.02 0.00 -0.55 0.00 0.00 66.41 63.77 1mm4 h THR 17 Cb 0.93 2.12 0.00 0.00 -1.73 0.00 0.00 68.15 69.48 1mm4 h THR 17 CO 0.08 0.65 -0.19 -0.50 -0.25 0.00 0.00 175.52 175.32 1mm4 h TRP 18 N 0.41 -0.49 0.08 4.73 4.06 -1.25 -3.34 115.95 120.14 1mm4 h TRP 18 Ca -0.06 -0.01 -0.00 0.00 2.06 0.00 0.00 58.89 60.88 1mm4 h TRP 18 Cb 1.43 0.16 0.00 0.00 -1.00 0.00 0.00 29.16 29.76 1mm4 h TRP 18 CO 0.07 -0.29 -0.04 1.96 -3.56 0.00 0.00 178.44 176.58 1mm4 h GLN 19 N -0.55 -0.10 -5.18 0.49 4.20 -1.54 -3.50 115.11 108.92 1mm4 h GLN 19 Ca -0.05 0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.66 1mm4 h GLN 19 Cb 0.42 0.02 0.00 0.00 0.30 0.00 0.00 27.48 28.22 1mm4 h GLN 19 CO 0.09 -0.07 -0.86 0.94 -0.67 0.00 0.00 178.83 178.26 1mm4 n GLN 20 N -2.71 -3.21 -2.22 1.46 0.00 -0.25 -4.96 117.38 105.49 1mm4 n GLN 20 Ca -0.01 2.62 -0.35 0.00 -0.00 0.00 0.00 57.00 59.26 1mm4 n GLN 20 Cb 0.04 -5.48 0.00 0.00 0.00 0.00 0.00 30.24 24.80 1mm4 n GLN 20 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.06 175.81 1mm4 s PRO 21 N -1.91 3.32 0.00 3.69 0.04 -1.26 -4.97 135.00 133.90 1mm4 s PRO 21 Ca 0.07 1.58 0.00 0.00 0.04 0.00 0.00 61.00 62.69 1mm4 s PRO 21 Cb -0.02 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1mm4 s PRO 21 CO 0.78 -0.87 0.00 0.39 0.04 0.00 0.00 177.00 177.34 1mm4 n GLU 22 N -1.40 0.00 -4.45 4.56 1.02 -1.26 -5.07 120.64 114.04 1mm4 n GLU 22 Ca 0.11 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 57.05 1mm4 n GLU 22 Cb 0.51 0.00 -0.14 0.00 -0.02 0.00 0.00 31.44 31.79 1mm4 n GLU 22 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1mm4 s HIS 23 N -0.78 1.14 -0.30 -0.32 3.76 -1.26 -4.53 115.29 113.00 1mm4 s HIS 23 Ca 0.00 -0.27 -0.05 0.00 -0.15 0.00 0.00 55.06 54.58 1mm4 s HIS 23 Cb 0.00 -0.71 0.02 0.00 1.11 0.00 0.00 32.58 33.01 1mm4 s HIS 23 CO 0.00 0.00 0.05 -0.47 -0.85 0.00 0.00 174.74 173.47 1mm4 s TYR 24 N -0.55 3.17 -0.19 1.40 6.14 -0.68 -3.84 117.35 122.80 1mm4 s TYR 24 Ca 0.03 -1.30 -0.08 0.00 0.64 0.00 0.00 57.07 56.37 1mm4 s TYR 24 Cb -0.06 -2.20 -0.04 0.00 0.42 0.00 0.00 41.96 40.07 1mm4 s TYR 24 CO 0.00 -0.67 0.07 -0.51 0.64 0.00 0.00 175.55 175.08 1mm4 s ASP 25 N 1.41 5.62 -0.21 4.32 -0.00 -0.72 -1.24 116.67 125.84 1mm4 s ASP 25 Ca 0.00 0.06 -0.06 0.00 -0.00 0.00 0.00 52.55 52.56 1mm4 s ASP 25 Cb -0.18 -1.97 -0.03 0.00 -0.00 0.00 0.00 42.92 40.75 1mm4 s ASP 25 CO 0.01 0.16 0.03 -0.22 -0.00 0.00 0.00 175.17 175.14 1mm4 s LEU 26 N 0.48 3.38 -0.37 1.23 2.96 0.36 -2.25 118.68 124.47 1mm4 s LEU 26 Ca 0.03 -0.16 -0.14 0.00 -0.22 0.00 0.00 54.13 53.64 1mm4 s LEU 26 Cb -0.13 -1.87 -0.00 0.00 0.50 0.00 0.00 46.19 44.69 1mm4 s LEU 26 CO 0.01 0.05 0.26 -0.47 -1.32 0.00 0.00 176.35 174.88 1mm4 s TYR 27 N 1.07 3.23 -0.01 5.38 5.04 -0.97 -1.69 117.35 129.40 1mm4 s TYR 27 Ca 0.03 -0.36 0.01 0.00 -2.44 0.00 0.00 57.07 54.30 1mm4 s TYR 27 Cb -0.14 -2.52 0.01 0.00 0.35 0.00 0.00 41.96 39.66 1mm4 s TYR 27 CO 0.02 -0.45 -0.01 0.42 -1.34 0.00 0.00 175.55 174.19 1mm4 s ILE 28 N 1.70 0.16 1.20 3.14 1.01 -1.03 -1.98 121.20 125.41 1mm4 s ILE 28 Ca 0.06 -0.01 -0.20 0.00 0.00 0.00 0.00 60.65 60.50 1mm4 s ILE 28 Cb -0.18 -0.19 0.29 0.00 0.01 0.00 0.00 42.46 42.39 1mm4 s ILE 28 CO 0.10 0.09 1.16 -2.16 0.00 0.00 0.00 174.94 174.13 1mm4 s PRO 29 N 0.41 -1.26 0.40 2.79 0.04 -1.26 -2.07 135.00 134.05 1mm4 s PRO 29 Ca -0.04 -0.26 -0.25 0.00 0.04 0.00 0.00 61.00 60.49 1mm4 s PRO 29 Cb -0.06 -1.61 -0.09 0.00 0.04 0.00 0.00 34.50 32.78 1mm4 s PRO 29 CO -0.01 -3.70 1.10 0.00 0.04 0.00 0.00 177.00 174.43 1mm4 s ALA 30 N -3.18 3.12 -0.02 8.56 0.00 -1.26 -4.58 121.76 124.39 1mm4 s ALA 30 Ca 0.73 0.81 -0.07 0.00 0.00 0.00 0.00 51.96 53.43 1mm4 s ALA 30 Cb -0.07 -3.32 0.01 0.00 0.00 0.00 0.00 23.12 19.75 1mm4 s ALA 30 CO 0.55 -0.34 0.15 0.96 0.00 0.00 0.00 175.76 177.08 1mm4 s ILE 31 N -1.54 0.05 -0.04 0.00 -4.36 -1.26 -4.94 121.20 109.12 1mm4 s ILE 31 Ca 0.57 -0.43 0.15 0.00 -0.26 0.00 0.00 60.65 60.68 1mm4 s ILE 31 Cb -0.26 -0.36 0.26 0.00 1.25 0.00 0.00 42.46 43.35 1mm4 s ILE 31 CO 0.32 -0.24 1.12 0.35 0.24 0.00 0.00 174.94 176.74 1mm4 n THR 32 N 2.03 0.09 -0.07 8.37 -2.24 -1.26 -4.72 114.28 116.47 1mm4 n THR 32 Ca -0.19 -0.73 -0.10 0.00 -2.27 0.00 0.00 64.05 60.76 1mm4 n THR 32 Cb 0.57 0.82 -0.06 0.00 -2.10 0.00 0.00 70.33 69.55 1mm4 n THR 32 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1mm4 n TRP 33 N 0.11 0.00 -2.46 4.78 7.02 -1.26 -4.81 117.44 120.82 1mm4 n TRP 33 Ca -0.09 0.00 0.01 0.00 -1.02 0.00 0.00 57.50 56.40 1mm4 n TRP 33 Cb 0.93 -0.55 0.01 0.00 -2.42 0.00 0.00 31.31 29.28 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 -2.98 0.08 -2.09 -5.99 8.25 -1.26 -5.03 115.22 106.20 1mm4 n HIS 34 Ca -0.26 -0.79 -0.28 0.00 -0.26 0.00 0.00 57.72 56.13 1mm4 n HIS 34 Cb 0.76 0.05 -0.05 0.00 1.12 0.00 0.00 29.99 31.87 1mm4 n HIS 34 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1mm4 s ALA 35 N -0.54 1.80 -0.45 -1.41 0.00 -1.26 -4.07 121.76 115.82 1mm4 s ALA 35 Ca 0.25 -1.75 -0.14 0.00 0.00 0.00 0.00 51.96 50.32 1mm4 s ALA 35 Cb 0.31 -4.59 0.02 0.00 0.00 0.00 0.00 23.12 18.85 1mm4 s ALA 35 CO -0.12 -4.82 0.59 0.54 0.00 0.00 0.00 175.76 171.95 1mm4 n ARG 36 N 8.70 -2.18 -3.31 0.00 1.74 -1.26 -5.04 116.66 115.31 1mm4 n ARG 36 Ca 0.41 2.00 -0.10 0.00 -0.77 0.00 0.00 57.85 59.39 1mm4 n ARG 36 Cb 0.47 -5.56 -0.05 0.00 -1.02 0.00 0.00 32.46 26.29 1mm4 n ARG 36 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 1mm4 s PHE 37 N -2.61 -0.82 0.50 -1.55 0.08 -1.26 -5.15 117.98 107.17 1mm4 s PHE 37 Ca 0.21 -0.42 -0.20 0.00 0.12 0.00 0.00 56.93 56.64 1mm4 s PHE 37 Cb -0.06 -0.15 -0.08 0.00 -0.57 0.00 0.00 43.02 42.17 1mm4 s PHE 37 CO 0.74 -1.04 1.07 0.00 -0.10 0.00 0.00 175.22 175.88 1mm4 s ALA 38 N 1.60 2.84 -0.08 5.36 0.00 -1.26 -5.05 121.76 125.17 1mm4 s ALA 38 Ca 0.16 0.68 0.01 0.00 0.00 0.00 0.00 51.96 52.81 1mm4 s ALA 38 Cb -0.11 -3.29 0.02 0.00 0.00 0.00 0.00 23.12 19.74 1mm4 s ALA 38 CO -0.05 -0.43 -0.08 -0.47 0.00 0.00 0.00 175.76 174.73 1mm4 s TYR 39 N -1.90 1.29 0.11 0.00 5.04 -1.26 -5.11 117.35 115.53 1mm4 s TYR 39 Ca 0.68 -0.54 -0.31 0.00 -2.44 0.00 0.00 57.07 54.46 1mm4 s TYR 39 Cb -0.19 -1.05 -0.10 0.00 0.35 0.00 0.00 41.96 40.97 1mm4 s TYR 39 CO 0.22 -0.37 1.88 -0.51 -1.34 0.00 0.00 175.55 175.44 1mm4 s ASP 40 N 1.25 6.41 0.38 4.32 1.01 -1.26 -4.40 116.67 124.39 1mm4 s ASP 40 Ca -0.04 2.76 0.00 0.00 0.71 0.00 0.00 52.55 55.98 1mm4 s ASP 40 Cb -0.14 -2.56 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1mm4 s ASP 40 CO -0.03 -1.03 0.00 0.29 0.21 0.00 0.00 175.17 174.62 1mm4 n LYS 41 N 6.14 -4.56 -2.88 8.23 4.01 -1.26 -4.90 118.16 122.94 1mm4 n LYS 41 Ca 0.18 3.32 -0.07 0.00 -0.51 0.00 0.00 58.31 61.23 1mm4 n LYS 41 Cb 0.39 -3.68 0.01 0.00 -0.51 0.00 0.00 35.03 31.24 1mm4 n LYS 41 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 1mm4 n GLU 42 N 0.05 -2.25 -0.04 1.97 4.71 -1.26 -4.98 120.64 118.84 1mm4 n GLU 42 Ca 0.00 2.04 -0.02 0.00 -0.01 0.00 0.00 57.16 59.17 1mm4 n GLU 42 Cb 0.00 -5.68 -0.09 0.00 -1.01 0.00 0.00 31.44 24.65 1mm4 n GLU 42 CO 0.00 0.00 0.00 1.17 0.09 0.00 0.00 177.13 178.39 1mm4 n LYS 43 N -0.49 1.59 0.10 3.49 4.81 -1.26 -4.49 118.16 121.91 1mm4 n LYS 43 Ca 0.10 -0.04 0.18 0.00 -0.87 0.00 0.00 58.31 57.69 1mm4 n LYS 43 Cb 0.47 -1.30 0.74 0.00 0.02 0.00 0.00 35.03 34.96 1mm4 n LYS 43 CO 0.00 0.00 0.00 1.79 1.17 0.00 0.00 177.40 180.36 1mm4 h THR 44 N 0.00 0.60 -1.87 3.15 1.35 -1.95 -3.48 112.91 110.71 1mm4 h THR 44 Ca -0.23 0.00 0.03 0.00 -0.55 0.00 0.00 66.41 65.66 1mm4 h THR 44 Cb 1.40 0.77 -0.01 0.00 -1.73 0.00 0.00 68.15 68.58 1mm4 h THR 44 CO 0.01 0.00 -0.04 -0.67 -0.25 0.00 0.00 175.52 174.57 1mm4 n ASP 45 N -4.08 -5.52 -0.01 5.36 4.64 -1.26 -4.84 116.55 110.84 1mm4 n ASP 45 Ca 0.06 0.12 -0.02 0.00 -1.38 0.00 0.00 54.79 53.57 1mm4 n ASP 45 Cb 0.48 -0.33 -0.01 0.00 -1.04 0.00 0.00 41.12 40.23 1mm4 n ASP 45 CO 0.00 0.00 0.00 -1.14 -0.82 0.00 0.00 177.20 175.24 1mm4 n ARG 46 N -1.95 0.11 -3.93 -0.67 3.00 -1.26 -5.07 116.66 106.88 1mm4 n ARG 46 Ca 0.00 0.04 -0.21 0.00 -0.00 0.00 0.00 57.85 57.68 1mm4 n ARG 46 Cb 0.05 -0.55 -0.04 0.00 0.00 0.00 0.00 32.46 31.92 1mm4 n ARG 46 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1mm4 s TYR 47 N -1.59 3.00 0.35 -0.14 2.02 -1.26 -5.14 117.35 114.60 1mm4 s TYR 47 Ca -0.06 -0.22 0.08 0.00 -0.37 0.00 0.00 57.07 56.50 1mm4 s TYR 47 Cb 0.01 -1.64 -0.04 0.00 -0.40 0.00 0.00 41.96 39.90 1mm4 s TYR 47 CO 0.09 0.32 0.22 0.54 -1.57 0.00 0.00 175.55 175.15 1mm4 s ASN 48 N -3.94 4.88 0.03 2.29 4.22 -1.26 -5.13 114.94 116.03 1mm4 s ASN 48 Ca 0.38 -0.72 -0.01 0.00 -2.14 0.00 0.00 52.86 50.37 1mm4 s ASN 48 Cb -0.07 -0.76 -0.04 0.00 1.28 0.00 0.00 41.25 41.66 1mm4 s ASN 48 CO 0.26 -0.38 0.17 -0.70 -2.04 0.00 0.00 177.10 174.41 1mm4 s GLU 49 N -3.93 3.32 -0.40 3.55 2.56 -1.26 -5.08 118.70 117.47 1mm4 s GLU 49 Ca 0.40 -0.43 0.03 0.00 0.00 0.00 0.00 54.97 54.97 1mm4 s GLU 49 Cb -0.03 -3.00 0.16 0.00 2.00 0.00 0.00 34.13 33.26 1mm4 s GLU 49 CO 0.24 0.64 0.30 1.03 -0.56 0.00 0.00 175.26 176.91 1mm4 s ARG 50 N -2.16 0.86 0.05 4.30 0.52 -1.26 -5.03 118.95 116.24 1mm4 s ARG 50 Ca 0.30 -1.89 -0.24 0.00 -0.52 0.00 0.00 55.73 53.38 1mm4 s ARG 50 Cb -0.13 -1.49 -0.12 0.00 0.52 0.00 0.00 34.95 33.73 1mm4 s ARG 50 CO 0.22 -1.31 1.37 -1.35 0.02 0.00 0.00 175.30 174.24 1mm4 h PRO 51 N 6.15 -0.67 -0.00 3.54 0.11 -1.98 -3.42 132.00 135.73 1mm4 h PRO 51 Ca 0.18 0.05 -0.14 0.00 0.11 0.00 0.00 66.00 66.20 1mm4 h PRO 51 Cb 0.93 0.15 -0.16 0.00 0.11 0.00 0.00 31.00 32.03 1mm4 h PRO 51 CO 0.35 -0.45 -0.37 0.91 -0.21 0.00 0.00 178.00 178.24 1mm4 n TRP 52 N -4.41 -0.09 -0.46 0.65 8.01 -1.26 -4.93 117.44 114.95 1mm4 n TRP 52 Ca -0.08 -0.56 0.00 0.00 -1.31 0.00 0.00 57.50 55.54 1mm4 n TRP 52 Cb 0.31 0.48 0.00 0.00 -2.01 0.00 0.00 31.31 30.09 1mm4 n TRP 52 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1mm4 n GLY 53 N -0.02 0.59 0.00 6.99 0.00 -1.26 -3.98 105.19 107.50 1mm4 n GLY 53 Ca -0.24 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.11 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 -1.60 2.34 -0.02 0.00 -1.07 -4.72 105.19 100.11 1mm4 n GLY 54 Ca 0.00 -1.07 -0.02 0.00 0.00 0.00 0.00 46.02 44.93 1mm4 n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mm4 n GLY 55 N -0.23 0.92 3.57 -0.02 0.00 -0.84 -1.60 105.19 107.00 1mm4 n GLY 55 Ca 0.00 -1.07 -0.11 0.00 0.00 0.00 0.00 46.02 44.84 1mm4 n GLY 55 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mm4 s PHE 56 N -3.76 0.58 -1.58 1.61 0.08 -0.97 -2.28 117.98 111.66 1mm4 s PHE 56 Ca 0.14 -0.93 0.00 0.00 0.12 0.00 0.00 56.93 56.25 1mm4 s PHE 56 Cb -0.02 0.16 0.00 0.00 -0.57 0.00 0.00 43.02 42.59 1mm4 s PHE 56 CO 0.04 -1.10 0.00 0.41 -0.10 0.00 0.00 175.22 174.47 1mm4 n GLY 57 N -0.46 -1.66 3.46 4.36 0.00 -0.96 -1.07 105.19 108.87 1mm4 n GLY 57 Ca -0.01 -1.11 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 1mm4 n GLY 57 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 1mm4 s LEU 58 N 0.00 2.55 0.03 0.99 0.05 -0.47 -1.76 118.68 120.08 1mm4 s LEU 58 Ca 0.00 -0.87 0.05 0.00 0.05 0.00 0.00 54.13 53.36 1mm4 s LEU 58 Cb 0.00 -1.22 -0.02 0.00 -2.05 0.00 0.00 46.19 42.90 1mm4 s LEU 58 CO 0.00 0.09 -0.16 -0.44 -0.55 0.00 0.00 176.35 175.30 1mm4 s SER 59 N -2.94 1.86 0.19 1.48 0.01 -1.25 -2.37 113.70 110.69 1mm4 s SER 59 Ca 0.24 -0.45 0.07 0.00 1.31 0.00 0.00 55.95 57.13 1mm4 s SER 59 Cb -0.07 -0.14 -0.04 0.00 0.21 0.00 0.00 66.02 65.98 1mm4 s SER 59 CO 0.12 0.08 0.03 -0.60 0.41 0.00 0.00 173.24 173.28 1mm4 s ARG 60 N -1.04 2.48 -0.19 12.44 3.52 -0.83 -4.42 118.95 130.91 1mm4 s ARG 60 Ca 0.04 -1.13 -0.03 0.00 -0.13 0.00 0.00 55.73 54.48 1mm4 s ARG 60 Cb -0.08 -2.37 -0.01 0.00 -1.56 0.00 0.00 34.95 30.93 1mm4 s ARG 60 CO 0.01 0.44 -0.07 -0.46 -0.81 0.00 0.00 175.30 174.41 1mm4 s TRP 61 N -1.86 2.92 -0.30 5.12 -0.00 -1.26 -1.37 118.94 122.19 1mm4 s TRP 61 Ca 0.29 -0.86 -0.14 0.00 -0.00 0.00 0.00 56.10 55.39 1mm4 s TRP 61 Cb -0.09 -2.02 -0.03 0.00 -0.00 0.00 0.00 33.47 31.33 1mm4 s TRP 61 CO 0.20 -0.45 0.30 0.34 -0.00 0.00 0.00 176.95 177.34 1mm4 s ASP 62 N 1.12 6.14 0.63 5.86 3.68 -0.21 -4.94 116.67 128.95 1mm4 s ASP 62 Ca 0.01 -0.01 0.32 0.00 2.13 0.00 0.00 52.55 55.01 1mm4 s ASP 62 Cb -0.15 -2.17 1.79 0.00 -1.45 0.00 0.00 42.92 40.94 1mm4 s ASP 62 CO -0.01 -0.19 2.08 1.05 0.13 0.00 0.00 175.17 178.23 1mm4 h GLU 63 N 8.34 0.00 0.00 4.34 9.09 -1.99 0.17 114.58 134.54 1mm4 h GLU 63 Ca -0.32 0.00 -0.06 0.00 0.05 0.00 0.00 59.36 59.03 1mm4 h GLU 63 Cb 1.17 0.00 -0.01 0.00 -1.65 0.00 0.00 28.75 28.26 1mm4 h GLU 63 CO 0.63 0.00 -0.27 0.87 0.05 0.00 0.00 179.01 180.29 1mm4 h LYS 64 N 0.00 0.00 0.00 1.06 1.57 -2.05 -3.46 116.57 113.69 1mm4 h LYS 64 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.84 1mm4 h LYS 64 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.82 1mm4 h LYS 64 CO -0.00 0.27 0.00 0.41 -0.57 0.00 0.00 179.45 179.56 1mm4 n GLY 65 N 0.06 0.96 3.20 3.86 0.00 0.59 -5.16 105.19 108.71 1mm4 n GLY 65 Ca -0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1mm4 n GLY 65 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mm4 s ASN 66 N -1.55 1.63 -0.36 1.61 0.01 -1.08 -4.83 114.94 110.36 1mm4 s ASN 66 Ca 0.00 -0.85 0.02 0.00 -0.71 0.00 0.00 52.86 51.32 1mm4 s ASN 66 Cb 0.00 -0.01 0.11 0.00 0.41 0.00 0.00 41.25 41.76 1mm4 s ASN 66 CO 0.00 -0.25 0.13 0.86 -1.51 0.00 0.00 177.10 176.33 1mm4 s TRP 67 N -2.55 2.46 0.21 2.20 -0.00 -0.30 -1.04 118.94 119.92 1mm4 s TRP 67 Ca 0.08 -2.37 -0.30 0.00 -0.00 0.00 0.00 56.10 53.52 1mm4 s TRP 67 Cb -0.02 -2.18 -0.09 0.00 -0.00 0.00 0.00 33.47 31.17 1mm4 s TRP 67 CO 0.01 -0.87 1.36 -1.58 -0.00 0.00 0.00 176.95 175.87 1mm4 s HIS 68 N 0.97 3.18 -0.19 5.86 5.65 -0.47 -2.00 115.29 128.29 1mm4 s HIS 68 Ca 0.12 1.14 -0.02 0.00 0.25 0.00 0.00 55.06 56.56 1mm4 s HIS 68 Cb -0.20 -3.68 0.05 0.00 -1.18 0.00 0.00 32.58 27.57 1mm4 s HIS 68 CO -0.13 -2.17 0.01 0.20 -0.65 0.00 0.00 174.74 172.00 1mm4 s GLY 69 N 0.37 0.81 -0.10 1.59 0.00 -0.28 -1.96 107.32 107.74 1mm4 s GLY 69 Ca 0.58 -0.76 -0.00 0.00 0.00 0.00 0.00 44.72 44.53 1mm4 s GLY 69 CO 0.40 1.26 -0.07 -2.27 0.00 0.00 0.00 173.10 172.41 1mm4 s LEU 70 N 1.77 1.17 0.13 0.66 0.20 -1.00 -1.20 118.68 120.42 1mm4 s LEU 70 Ca -0.01 -0.28 -0.19 0.00 0.69 0.00 0.00 54.13 54.34 1mm4 s LEU 70 Cb -0.17 -0.80 0.05 0.00 -0.43 0.00 0.00 46.19 44.85 1mm4 s LEU 70 CO -0.07 -0.11 0.49 -0.72 -0.29 0.00 0.00 176.35 175.64 1mm4 s TYR 71 N 1.63 -0.36 -0.12 5.38 -0.85 -0.78 -1.37 117.35 120.89 1mm4 s TYR 71 Ca 0.03 0.11 0.03 0.00 -0.52 0.00 0.00 57.07 56.72 1mm4 s TYR 71 Cb -0.13 0.39 0.01 0.00 0.38 0.00 0.00 41.96 42.61 1mm4 s TYR 71 CO -0.07 -0.76 -0.21 0.00 -1.52 0.00 0.00 175.55 172.99 1mm4 s ALA 72 N -3.68 2.09 0.05 9.51 0.00 -0.23 -1.56 121.76 127.94 1mm4 s ALA 72 Ca 0.02 -0.96 0.09 0.00 0.00 0.00 0.00 51.96 51.10 1mm4 s ALA 72 Cb 0.01 -0.89 -0.03 0.00 0.00 0.00 0.00 23.12 22.21 1mm4 s ALA 72 CO -0.12 0.08 -0.24 1.41 0.00 0.00 0.00 175.76 176.89 1mm4 s MET 73 N 0.67 1.87 -0.04 0.00 0.00 -0.81 -2.30 119.30 118.70 1mm4 s MET 73 Ca -0.11 -1.08 0.07 0.00 0.00 0.00 0.00 55.69 54.57 1mm4 s MET 73 Cb -0.16 -2.03 -0.02 0.00 0.00 0.00 0.00 34.83 32.62 1mm4 s MET 73 CO 0.02 0.52 -0.25 0.00 0.00 0.00 0.00 175.02 175.31 1mm4 s ALA 74 N -0.84 2.13 -0.08 4.11 0.00 -0.63 -0.47 121.76 125.98 1mm4 s ALA 74 Ca 0.13 -1.07 -0.03 0.00 0.00 0.00 0.00 51.96 50.98 1mm4 s ALA 74 Cb -0.10 -0.59 -0.04 0.00 0.00 0.00 0.00 23.12 22.39 1mm4 s ALA 74 CO 0.03 0.48 0.07 -0.59 0.00 0.00 0.00 175.76 175.75 1mm4 s PHE 75 N -0.41 3.35 -0.25 0.00 -0.12 -1.07 -2.58 117.98 116.89 1mm4 s PHE 75 Ca 0.04 0.31 -0.26 0.00 -0.05 0.00 0.00 56.93 56.97 1mm4 s PHE 75 Cb -0.11 -1.83 0.00 0.00 -0.63 0.00 0.00 43.02 40.45 1mm4 s PHE 75 CO 0.01 0.58 0.92 0.21 -0.05 0.00 0.00 175.22 176.89 1mm4 s LYS 76 N -1.16 4.17 0.00 1.99 2.36 -1.26 -1.92 119.74 123.92 1mm4 s LYS 76 Ca 0.17 1.06 0.00 0.00 -2.55 0.00 0.00 55.97 54.64 1mm4 s LYS 76 Cb -0.12 -3.66 0.00 0.00 -1.05 0.00 0.00 37.83 33.00 1mm4 s LYS 76 CO 0.06 -0.61 0.00 -3.47 1.55 0.00 0.00 175.35 172.88 1mm4 n ASP 77 N 6.22 -1.27 0.11 1.43 2.03 -1.24 -4.94 116.55 118.89 1mm4 n ASP 77 Ca 0.08 -0.08 0.05 0.00 0.52 0.00 0.00 54.79 55.36 1mm4 n ASP 77 Cb 0.47 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.87 1mm4 n ASP 77 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 1mm4 h SER 78 N -1.27 0.00 0.00 1.67 4.64 -1.96 -3.44 113.55 113.19 1mm4 h SER 78 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1mm4 h SER 78 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1mm4 h SER 78 CO 0.00 0.36 0.00 1.87 -0.87 0.00 0.00 176.83 178.19 1mm4 n TRP 79 N -2.98 -1.30 -0.53 4.77 -0.00 -1.26 -5.13 117.44 111.01 1mm4 n TRP 79 Ca -0.02 0.12 -0.20 0.00 -0.00 0.00 0.00 57.50 57.40 1mm4 n TRP 79 Cb 0.71 0.69 0.18 0.00 -0.00 0.00 0.00 31.31 32.89 1mm4 n TRP 79 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 177.69 177.96 1mm4 n ASN 80 N -2.63 -2.51 -4.00 5.87 6.94 -1.26 -5.02 115.26 112.66 1mm4 n ASN 80 Ca 0.00 -0.77 -0.30 0.00 -0.02 0.00 0.00 54.58 53.49 1mm4 n ASN 80 Cb 0.00 -0.65 0.22 0.00 -2.36 0.00 0.00 39.78 36.99 1mm4 n ASN 80 CO 0.00 0.00 0.00 -0.54 -1.03 0.00 0.00 177.26 175.69 1mm4 s LYS 81 N -4.50 -0.58 0.22 -3.83 1.02 -1.26 -4.09 119.74 106.72 1mm4 s LYS 81 Ca 0.45 -0.09 -0.18 0.00 0.02 0.00 0.00 55.97 56.18 1mm4 s LYS 81 Cb -0.06 -1.67 -0.08 0.00 -0.52 0.00 0.00 37.83 35.50 1mm4 s LYS 81 CO 0.36 -3.28 0.68 1.67 -0.92 0.00 0.00 175.35 173.86 1mm4 s TRP 82 N -3.22 3.59 -0.23 3.18 -2.14 -1.26 -3.70 118.94 115.17 1mm4 s TRP 82 Ca 0.71 1.28 -0.09 0.00 2.66 0.00 0.00 56.10 60.65 1mm4 s TRP 82 Cb -0.09 -2.54 -0.05 0.00 -3.10 0.00 0.00 33.47 27.69 1mm4 s TRP 82 CO 0.55 0.32 0.13 -2.00 -2.66 0.00 0.00 176.95 173.29 1mm4 s GLU 83 N -2.13 3.99 0.84 3.25 2.12 -0.81 -4.86 118.70 121.10 1mm4 s GLU 83 Ca 0.44 -0.32 -0.10 0.00 0.36 0.00 0.00 54.97 55.34 1mm4 s GLU 83 Cb -0.15 -3.44 0.10 0.00 0.26 0.00 0.00 34.13 30.89 1mm4 s GLU 83 CO 0.20 0.07 1.11 -2.14 -0.54 0.00 0.00 175.26 173.95 1mm4 s PRO 84 N 1.01 1.70 0.01 4.30 0.02 -1.26 -2.59 135.00 138.19 1mm4 s PRO 84 Ca 0.06 1.25 -0.10 0.00 0.02 0.00 0.00 61.00 62.22 1mm4 s PRO 84 Cb -0.14 -1.83 0.01 0.00 0.02 0.00 0.00 34.50 32.57 1mm4 s PRO 84 CO 0.04 -2.06 0.21 0.42 -0.33 0.00 0.00 177.00 175.29 1mm4 s ILE 85 N -2.82 0.09 0.03 2.83 1.01 0.38 -4.65 121.20 118.07 1mm4 s ILE 85 Ca 0.63 -0.70 0.01 0.00 0.00 0.00 0.00 60.65 60.59 1mm4 s ILE 85 Cb -0.19 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.56 1mm4 s ILE 85 CO 0.57 -0.39 0.08 0.00 0.00 0.00 0.00 174.94 175.20 1mm4 s ALA 86 N -1.85 3.58 -0.15 9.38 0.00 -1.07 -1.92 121.76 129.73 1mm4 s ALA 86 Ca -0.11 -0.93 -0.13 0.00 0.00 0.00 0.00 51.96 50.80 1mm4 s ALA 86 Cb -0.04 -1.52 0.04 0.00 0.00 0.00 0.00 23.12 21.60 1mm4 s ALA 86 CO 0.00 0.72 0.40 0.20 0.00 0.00 0.00 175.76 177.08 1mm4 s GLY 87 N -2.01 -0.30 -0.18 0.00 0.00 -0.60 -1.71 107.32 102.52 1mm4 s GLY 87 Ca 0.26 1.22 -0.13 0.00 0.00 0.00 0.00 44.72 46.07 1mm4 s GLY 87 CO 0.17 1.14 0.45 -2.52 0.00 0.00 0.00 173.10 172.34 1mm4 s TYR 88 N 0.49 -0.58 0.09 1.90 1.13 0.41 -1.86 117.35 118.94 1mm4 s TYR 88 Ca -0.02 1.30 -0.06 0.00 -1.41 0.00 0.00 57.07 56.87 1mm4 s TYR 88 Cb -0.04 0.24 0.02 0.00 -1.10 0.00 0.00 41.96 41.08 1mm4 s TYR 88 CO -0.03 -0.30 0.32 0.41 -2.51 0.00 0.00 175.55 173.44 1mm4 n GLY 89 N 3.59 1.31 3.05 5.49 0.00 -0.34 -0.65 105.19 117.63 1mm4 n GLY 89 Ca -0.18 -1.04 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 1mm4 n GLY 89 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1mm4 s TRP 90 N -5.52 0.64 0.03 1.61 0.51 -0.54 -1.12 118.94 114.55 1mm4 s TRP 90 Ca 0.07 -0.44 -0.04 0.00 -2.12 0.00 0.00 56.10 53.57 1mm4 s TRP 90 Cb -0.01 -0.39 -0.01 0.00 -0.81 0.00 0.00 33.47 32.25 1mm4 s TRP 90 CO 0.03 -0.07 0.06 -1.21 -0.51 0.00 0.00 176.95 175.24 1mm4 s GLU 91 N -1.38 0.49 -0.26 4.98 0.41 -0.85 -2.03 118.70 120.07 1mm4 s GLU 91 Ca -0.08 -0.68 0.02 0.00 -0.41 0.00 0.00 54.97 53.81 1mm4 s GLU 91 Cb -0.09 0.19 0.07 0.00 -1.78 0.00 0.00 34.13 32.52 1mm4 s GLU 91 CO 0.00 -0.11 -0.03 0.45 -0.49 0.00 0.00 175.26 175.08 1mm4 s SER 92 N -1.86 4.13 0.16 -0.19 0.15 -0.96 -1.15 113.70 113.98 1mm4 s SER 92 Ca -0.09 -1.42 -0.23 0.00 0.70 0.00 0.00 55.95 54.91 1mm4 s SER 92 Cb -0.04 -1.29 -0.08 0.00 -1.71 0.00 0.00 66.02 62.90 1mm4 s SER 92 CO -0.03 -0.27 0.72 -0.89 1.20 0.00 0.00 173.24 173.97 1mm4 s THR 93 N 1.28 4.49 0.02 6.45 2.01 -1.26 -2.15 115.64 126.49 1mm4 s THR 93 Ca -0.02 1.50 0.07 0.00 0.31 0.00 0.00 61.69 63.55 1mm4 s THR 93 Cb -0.19 -4.02 -0.03 0.00 0.01 0.00 0.00 72.50 68.27 1mm4 s THR 93 CO -0.08 0.46 -0.21 0.26 -0.69 0.00 0.00 174.62 174.35 1mm4 s TRP 94 N -1.23 2.47 -0.30 4.92 0.52 0.44 -4.90 118.94 120.86 1mm4 s TRP 94 Ca 0.36 -0.32 0.00 0.00 0.02 0.00 0.00 56.10 56.16 1mm4 s TRP 94 Cb -0.21 -1.47 0.09 0.00 -1.15 0.00 0.00 33.47 30.74 1mm4 s TRP 94 CO 0.23 0.16 0.06 -0.98 0.02 0.00 0.00 176.95 176.45 1mm4 s ARG 95 N -1.17 0.98 1.25 4.98 1.04 -1.26 -2.60 118.95 122.16 1mm4 s ARG 95 Ca 0.13 -1.19 -0.20 0.00 -1.04 0.00 0.00 55.73 53.43 1mm4 s ARG 95 Cb -0.10 -2.33 0.30 0.00 -2.04 0.00 0.00 34.95 30.79 1mm4 s ARG 95 CO 0.03 -0.91 1.08 -1.25 -0.04 0.00 0.00 175.30 174.21 1mm4 s PRO 96 N 1.46 -1.59 -0.93 3.89 0.04 -1.26 -4.94 135.00 131.66 1mm4 s PRO 96 Ca 0.07 -0.05 -0.17 0.00 0.04 0.00 0.00 61.00 60.89 1mm4 s PRO 96 Cb -0.18 -1.55 0.15 0.00 0.04 0.00 0.00 34.50 32.96 1mm4 s PRO 96 CO -0.18 -3.95 1.08 -0.51 0.04 0.00 0.00 177.00 173.47 1mm4 s LEU 97 N -7.12 5.39 0.07 -3.56 1.02 -1.26 -4.36 118.68 108.86 1mm4 s LEU 97 Ca 0.71 -2.24 0.00 0.00 0.02 0.00 0.00 54.13 52.62 1mm4 s LEU 97 Cb -0.10 -2.36 0.00 0.00 0.02 0.00 0.00 46.19 43.75 1mm4 s LEU 97 CO 0.56 -0.94 0.00 0.00 0.02 0.00 0.00 176.35 175.99 1mm4 n ALA 98 N 5.96 0.00 -2.41 4.21 0.00 -1.26 -5.16 120.51 121.85 1mm4 n ALA 98 Ca 0.23 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.46 1mm4 n ALA 98 Cb 0.48 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.83 1mm4 n ALA 98 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1mm4 s ASP 99 N -1.67 2.51 -0.11 0.00 -1.08 -1.26 -5.06 116.67 110.00 1mm4 s ASP 99 Ca 0.00 -1.23 0.07 0.00 -0.52 0.00 0.00 52.55 50.87 1mm4 s ASP 99 Cb 0.00 -0.12 -0.12 0.00 -1.46 0.00 0.00 42.92 41.22 1mm4 s ASP 99 CO 0.00 -0.43 -0.00 -0.62 0.52 0.00 0.00 175.17 174.64 1mm4 n GLU 100 N -0.57 1.85 0.25 4.34 -0.58 -1.26 -4.66 120.64 120.01 1mm4 n GLU 100 Ca -0.05 0.01 -0.15 0.00 -0.42 0.00 0.00 57.16 56.55 1mm4 n GLU 100 Cb 0.64 -1.26 -0.08 0.00 -0.57 0.00 0.00 31.44 30.17 1mm4 n GLU 100 CO 0.00 0.00 0.00 -0.97 -0.48 0.00 0.00 177.13 175.68 1mm4 h ASN 101 N 0.00 -0.53 -2.78 1.62 -0.00 -1.97 -3.43 115.58 108.49 1mm4 h ASN 101 Ca -0.28 -0.06 -0.52 0.00 -0.00 0.00 0.00 56.30 55.44 1mm4 h ASN 101 Cb 1.59 0.14 0.04 0.00 -0.00 0.00 0.00 38.32 40.09 1mm4 h ASN 101 CO 0.00 -0.26 0.91 -0.36 -0.00 0.00 0.00 177.43 177.73 1mm4 s PHE 102 N -5.38 2.96 0.00 0.67 0.40 -1.26 -3.41 117.98 111.96 1mm4 s PHE 102 Ca -0.15 0.55 -0.06 0.00 -0.60 0.00 0.00 56.93 56.66 1mm4 s PHE 102 Cb 0.03 -3.96 -0.00 0.00 0.51 0.00 0.00 43.02 39.60 1mm4 s PHE 102 CO 0.58 -3.61 0.11 -1.01 0.70 0.00 0.00 175.22 171.99 1mm4 s HIS 103 N 1.34 0.06 -0.04 0.36 3.76 -1.07 -4.81 115.29 114.89 1mm4 s HIS 103 Ca 0.71 -0.16 -0.02 0.00 -0.15 0.00 0.00 55.06 55.44 1mm4 s HIS 103 Cb -0.44 -0.06 0.03 0.00 1.11 0.00 0.00 32.58 33.22 1mm4 s HIS 103 CO 0.31 -0.26 0.07 -0.51 -0.85 0.00 0.00 174.74 173.50 1mm4 s LEU 104 N -1.29 0.24 0.06 0.89 1.02 -1.07 -2.05 118.68 116.48 1mm4 s LEU 104 Ca -0.14 0.10 -0.01 0.00 0.02 0.00 0.00 54.13 54.11 1mm4 s LEU 104 Cb -0.07 -0.09 -0.04 0.00 0.02 0.00 0.00 46.19 46.01 1mm4 s LEU 104 CO 0.01 -0.23 -0.03 -0.83 0.02 0.00 0.00 176.35 175.28 1mm4 s GLY 105 N 2.04 0.52 0.03 -3.19 0.00 0.06 -0.42 107.32 106.35 1mm4 s GLY 105 Ca 0.03 -1.23 -0.02 0.00 0.00 0.00 0.00 44.72 43.49 1mm4 s GLY 105 CO -0.03 -1.34 0.02 1.08 0.00 0.00 0.00 173.10 172.83 1mm4 s LEU 106 N -2.94 2.10 0.00 0.66 1.02 -0.91 -0.94 118.68 117.67 1mm4 s LEU 106 Ca 0.08 -0.58 0.00 0.00 0.02 0.00 0.00 54.13 53.65 1mm4 s LEU 106 Cb 0.08 0.31 0.00 0.00 0.02 0.00 0.00 46.19 46.60 1mm4 s LEU 106 CO -0.09 -0.42 0.00 0.61 0.02 0.00 0.00 176.35 176.46 1mm4 n GLY 107 N 1.06 1.17 3.36 -3.19 0.00 0.10 -2.26 105.19 105.42 1mm4 n GLY 107 Ca -0.20 -0.62 -0.27 0.00 0.00 0.00 0.00 46.02 44.93 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 -2.20 2.10 -0.01 1.61 0.40 -0.86 -0.41 117.98 118.61 1mm4 s PHE 108 Ca 0.00 -0.40 0.03 0.00 -0.60 0.00 0.00 56.93 55.97 1mm4 s PHE 108 Cb 0.00 -1.12 -0.01 0.00 0.51 0.00 0.00 43.02 42.40 1mm4 s PHE 108 CO 0.00 0.32 -0.10 0.95 0.70 0.00 0.00 175.22 177.08 1mm4 s THR 109 N -1.24 0.83 0.14 0.64 -4.23 -0.55 -1.46 115.64 109.76 1mm4 s THR 109 Ca 0.12 -0.44 0.09 0.00 -1.18 0.00 0.00 61.69 60.29 1mm4 s THR 109 Cb -0.09 -0.70 -0.04 0.00 1.34 0.00 0.00 72.50 73.01 1mm4 s THR 109 CO 0.06 0.24 -0.22 0.00 -0.54 0.00 0.00 174.62 174.16 1mm4 s ALA 110 N -0.19 2.09 0.07 3.99 0.00 0.17 -2.22 121.76 125.67 1mm4 s ALA 110 Ca 0.03 -1.42 -0.05 0.00 0.00 0.00 0.00 51.96 50.52 1mm4 s ALA 110 Cb -0.05 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 1mm4 s ALA 110 CO -0.00 0.37 0.09 0.20 0.00 0.00 0.00 175.76 176.41 1mm4 s GLY 111 N -2.27 0.28 -0.17 0.00 0.00 -0.47 -0.45 107.32 104.24 1mm4 s GLY 111 Ca 0.13 -0.91 -0.05 0.00 0.00 0.00 0.00 44.72 43.89 1mm4 s GLY 111 CO 0.06 -1.05 0.30 -1.34 0.00 0.00 0.00 173.10 171.06 1mm4 s VAL 112 N -3.89 -0.46 -0.38 1.40 -7.23 -0.69 -0.42 120.40 108.73 1mm4 s VAL 112 Ca 0.06 0.15 -0.20 0.00 -1.81 0.00 0.00 61.98 60.18 1mm4 s VAL 112 Cb 0.06 -0.56 0.01 0.00 0.56 0.00 0.00 36.38 36.45 1mm4 s VAL 112 CO -0.10 0.03 0.62 -0.89 -0.31 0.00 0.00 175.10 174.45 1mm4 s THR 113 N 2.45 4.89 0.50 5.32 2.01 -1.07 -2.59 115.64 127.14 1mm4 s THR 113 Ca 0.03 0.43 -0.07 0.00 0.31 0.00 0.00 61.69 62.39 1mm4 s THR 113 Cb -0.13 -4.10 -0.04 0.00 0.01 0.00 0.00 72.50 68.24 1mm4 s THR 113 CO -0.11 -0.38 0.83 0.00 -0.69 0.00 0.00 174.62 174.28 1mm4 s ALA 114 N 2.70 3.33 1.14 7.40 0.00 -1.26 -1.96 121.76 133.11 1mm4 s ALA 114 Ca 0.23 -0.37 -0.16 0.00 0.00 0.00 0.00 51.96 51.67 1mm4 s ALA 114 Cb -0.14 -2.71 0.23 0.00 0.00 0.00 0.00 23.12 20.49 1mm4 s ALA 114 CO 0.16 -0.36 0.95 2.89 0.00 0.00 0.00 175.76 179.40 1mm4 n ARG 115 N -2.19 -2.23 -0.01 0.00 0.00 -1.26 -5.01 116.66 105.96 1mm4 n ARG 115 Ca 0.02 -1.50 -0.02 0.00 -0.00 0.00 0.00 57.85 56.35 1mm4 n ARG 115 Cb 0.55 -1.26 -0.01 0.00 -0.00 0.00 0.00 32.46 31.73 1mm4 n ARG 115 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 1mm4 n ASP 116 N -4.27 2.22 -1.10 2.89 5.75 -1.26 -4.82 116.55 115.95 1mm4 n ASP 116 Ca 0.13 0.01 0.04 0.00 -0.01 0.00 0.00 54.79 54.96 1mm4 n ASP 116 Cb 0.48 -0.06 0.11 0.00 -1.03 0.00 0.00 41.12 40.62 1mm4 n ASP 116 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1mm4 n ASN 117 N -2.81 1.44 -2.80 -1.12 6.94 -1.26 -5.04 115.26 110.61 1mm4 n ASN 117 Ca -0.05 -2.96 -0.04 0.00 -0.02 0.00 0.00 54.58 51.51 1mm4 n ASN 117 Cb 0.54 -0.42 0.01 0.00 -2.36 0.00 0.00 39.78 37.55 1mm4 n ASN 117 CO 0.00 0.00 0.00 0.79 -1.03 0.00 0.00 177.26 177.02 1mm4 n TRP 118 N -0.33 -3.70 0.00 -2.53 8.01 -1.26 -5.00 117.44 112.62 1mm4 n TRP 118 Ca 0.13 1.58 0.00 0.00 -1.31 0.00 0.00 57.50 57.90 1mm4 n TRP 118 Cb 0.92 -3.98 0.00 0.00 -2.01 0.00 0.00 31.31 26.24 1mm4 n TRP 118 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.69 174.97 1mm4 n ASN 119 N 0.25 0.00 -4.40 -0.99 5.15 -1.26 -5.12 115.26 108.89 1mm4 n ASN 119 Ca 0.05 0.00 -0.30 0.00 -0.60 0.00 0.00 54.58 53.73 1mm4 n ASN 119 Cb 0.23 0.08 -0.13 0.00 -0.53 0.00 0.00 39.78 39.42 1mm4 n ASN 119 CO 0.00 0.00 0.00 -0.47 1.40 0.00 0.00 177.26 178.19 1mm4 s TYR 120 N -1.64 2.39 0.67 1.20 5.04 -1.26 -5.13 117.35 118.62 1mm4 s TYR 120 Ca 0.00 -0.35 -0.14 0.00 -2.44 0.00 0.00 57.07 54.14 1mm4 s TYR 120 Cb 0.00 -1.36 0.00 0.00 0.35 0.00 0.00 41.96 40.95 1mm4 s TYR 120 CO 0.00 0.25 1.08 0.96 -1.34 0.00 0.00 175.55 176.50 1mm4 s ILE 121 N -0.95 3.56 0.34 3.14 -4.36 -1.26 -4.39 121.20 117.27 1mm4 s ILE 121 Ca 0.14 0.65 -0.28 0.00 -0.26 0.00 0.00 60.65 60.90 1mm4 s ILE 121 Cb -0.10 -3.20 -0.12 0.00 1.25 0.00 0.00 42.46 40.28 1mm4 s ILE 121 CO 0.05 -0.52 1.26 -0.81 0.24 0.00 0.00 174.94 175.16 1mm4 n PRO 122 N -2.61 2.03 -3.51 0.37 -0.04 -1.26 -4.87 135.00 125.12 1mm4 n PRO 122 Ca 0.09 0.71 -0.42 0.00 -0.04 0.00 0.00 63.50 63.85 1mm4 n PRO 122 Cb 0.53 -2.27 -0.05 0.00 -0.04 0.00 0.00 33.50 31.66 1mm4 n PRO 122 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1mm4 s LEU 123 N -0.87 6.05 0.66 1.53 2.96 -0.83 -4.90 118.68 123.29 1mm4 s LEU 123 Ca 0.56 -2.88 -0.14 0.00 -0.22 0.00 0.00 54.13 51.45 1mm4 s LEU 123 Cb -0.58 -2.05 -0.00 0.00 0.50 0.00 0.00 46.19 44.06 1mm4 s LEU 123 CO 0.62 -0.45 1.09 -2.16 -1.32 0.00 0.00 176.35 174.13 1mm4 s PRO 124 N -0.11 2.86 -0.09 0.98 0.04 -1.26 -2.60 135.00 134.82 1mm4 s PRO 124 Ca 0.19 1.27 -0.16 0.00 0.04 0.00 0.00 61.00 62.33 1mm4 s PRO 124 Cb -0.14 -1.97 0.04 0.00 0.04 0.00 0.00 34.50 32.47 1mm4 s PRO 124 CO -0.07 -1.18 0.41 0.14 0.04 0.00 0.00 177.00 176.34 1mm4 s VAL 125 N -2.52 0.02 -0.14 -0.36 -7.23 0.44 -4.95 120.40 105.67 1mm4 s VAL 125 Ca 0.64 -0.18 -0.04 0.00 -1.81 0.00 0.00 61.98 60.60 1mm4 s VAL 125 Cb -0.18 -0.64 0.06 0.00 0.56 0.00 0.00 36.38 36.18 1mm4 s VAL 125 CO 0.44 -0.10 0.16 -0.76 -0.31 0.00 0.00 175.10 174.53 1mm4 s LEU 126 N -0.50 -0.00 0.05 1.32 1.43 -1.26 -1.37 118.68 118.34 1mm4 s LEU 126 Ca -0.06 -0.03 -0.11 0.00 -1.03 0.00 0.00 54.13 52.90 1mm4 s LEU 126 Cb -0.04 0.20 0.01 0.00 0.03 0.00 0.00 46.19 46.39 1mm4 s LEU 126 CO 0.03 -0.29 0.23 -1.48 0.23 0.00 0.00 176.35 175.07 1mm4 s LEU 127 N 2.27 1.21 0.46 1.79 0.05 -0.94 -5.03 118.68 118.49 1mm4 s LEU 127 Ca 0.04 -0.34 -0.22 0.00 0.05 0.00 0.00 54.13 53.66 1mm4 s LEU 127 Cb -0.14 1.10 -0.08 0.00 -2.05 0.00 0.00 46.19 45.02 1mm4 s LEU 127 CO -0.08 -0.59 1.13 -2.16 -0.55 0.00 0.00 176.35 174.10 1mm4 s PRO 128 N -2.69 3.78 -0.00 1.48 0.04 -1.24 -1.49 135.00 134.88 1mm4 s PRO 128 Ca -0.04 1.69 -0.05 0.00 0.04 0.00 0.00 61.00 62.64 1mm4 s PRO 128 Cb -0.00 -2.36 -0.00 0.00 0.04 0.00 0.00 34.50 32.17 1mm4 s PRO 128 CO -0.04 -0.52 0.09 -1.17 0.04 0.00 0.00 177.00 175.40 1mm4 s LEU 129 N -3.09 1.75 0.02 -3.56 0.20 0.45 -2.56 118.68 111.89 1mm4 s LEU 129 Ca 0.64 -0.19 0.06 0.00 0.69 0.00 0.00 54.13 55.33 1mm4 s LEU 129 Cb -0.26 0.45 -0.02 0.00 -0.43 0.00 0.00 46.19 45.93 1mm4 s LEU 129 CO 0.32 -0.28 -0.19 0.00 -0.29 0.00 0.00 176.35 175.91 1mm4 s ALA 130 N -1.09 1.56 -0.19 5.97 0.00 -0.51 -0.72 121.76 126.78 1mm4 s ALA 130 Ca -0.12 -0.91 -0.00 0.00 0.00 0.00 0.00 51.96 50.93 1mm4 s ALA 130 Cb -0.07 -0.33 0.05 0.00 0.00 0.00 0.00 23.12 22.77 1mm4 s ALA 130 CO 0.01 0.35 -0.06 -1.54 0.00 0.00 0.00 175.76 174.52 1mm4 s SER 131 N -0.89 3.15 -0.02 0.00 1.04 -0.12 -1.16 113.70 115.71 1mm4 s SER 131 Ca 0.06 -0.81 0.00 0.00 0.48 0.00 0.00 55.95 55.68 1mm4 s SER 131 Cb -0.08 -1.03 0.03 0.00 0.10 0.00 0.00 66.02 65.03 1mm4 s SER 131 CO 0.01 -0.19 0.02 0.68 0.98 0.00 0.00 173.24 174.75 1mm4 s VAL 132 N 1.54 -0.03 -5.00 5.02 -7.23 -0.82 -0.76 120.40 113.11 1mm4 s VAL 132 Ca -0.01 0.18 0.00 0.00 -1.81 0.00 0.00 61.98 60.34 1mm4 s VAL 132 Cb -0.16 -0.09 0.00 0.00 0.56 0.00 0.00 36.38 36.69 1mm4 s VAL 132 CO -0.08 0.08 0.00 0.61 -0.31 0.00 0.00 175.10 175.41 1mm4 n GLY 133 N 4.04 -0.33 3.80 2.32 0.00 -0.87 -1.85 105.19 112.30 1mm4 n GLY 133 Ca -0.26 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.39 1mm4 n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1mm4 s TYR 134 N -3.56 3.47 0.11 1.61 2.02 0.43 -2.59 117.35 118.84 1mm4 s TYR 134 Ca 0.00 1.69 -0.30 0.00 -0.37 0.00 0.00 57.07 58.09 1mm4 s TYR 134 Cb 0.00 -2.90 -0.11 0.00 -0.40 0.00 0.00 41.96 38.55 1mm4 s TYR 134 CO 0.00 -0.01 1.49 0.78 -1.57 0.00 0.00 175.55 176.23 1mm4 h GLY 135 N 2.50 -1.14 2.00 0.71 0.00 -1.89 -1.39 103.07 103.86 1mm4 h GLY 135 Ca -0.48 0.70 -0.03 0.00 0.00 0.00 0.00 47.33 47.52 1mm4 h GLY 135 CO 0.63 -0.23 -0.12 -0.56 0.00 0.00 0.00 176.54 176.26 1mm4 h PRO 136 N -0.47 0.00 -3.26 4.80 0.13 -1.93 -3.40 132.00 127.87 1mm4 h PRO 136 Ca 0.04 -0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.69 1mm4 h PRO 136 Cb 0.58 -0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.31 1mm4 h PRO 136 CO -0.42 0.13 -0.75 0.54 -0.23 0.00 0.00 178.00 177.26 1mm4 s VAL 137 N -4.78 0.14 0.09 1.56 0.11 -0.56 -1.16 120.40 115.79 1mm4 s VAL 137 Ca -0.04 -0.25 0.08 0.00 -2.93 0.00 0.00 61.98 58.84 1mm4 s VAL 137 Cb 0.16 -0.70 -0.04 0.00 -1.53 0.00 0.00 36.38 34.27 1mm4 s VAL 137 CO 0.69 -0.21 -0.19 0.42 -3.33 0.00 0.00 175.10 172.48 1mm4 s THR 138 N 2.04 2.75 -0.04 5.04 -4.23 -1.01 -0.43 115.64 119.76 1mm4 s THR 138 Ca 0.01 -1.40 -0.20 0.00 -1.18 0.00 0.00 61.69 58.93 1mm4 s THR 138 Cb -0.16 -2.21 -0.05 0.00 1.34 0.00 0.00 72.50 71.42 1mm4 s THR 138 CO -0.08 0.20 0.55 -0.36 -0.54 0.00 0.00 174.62 174.39 1mm4 s PHE 139 N -1.04 3.63 -0.17 3.99 0.40 -0.77 -2.36 117.98 121.65 1mm4 s PHE 139 Ca 0.16 1.10 -0.06 0.00 -0.60 0.00 0.00 56.93 57.53 1mm4 s PHE 139 Cb -0.10 -2.58 -0.04 0.00 0.51 0.00 0.00 43.02 40.81 1mm4 s PHE 139 CO 0.08 0.31 0.04 -1.14 0.70 0.00 0.00 175.22 175.20 1mm4 s GLN 140 N 0.03 3.85 -0.16 0.44 2.00 -0.93 -1.95 119.66 122.96 1mm4 s GLN 140 Ca 0.29 -0.38 0.00 0.00 -2.00 0.00 0.00 55.36 53.28 1mm4 s GLN 140 Cb -0.17 -3.12 0.03 0.00 0.80 0.00 0.00 33.01 30.54 1mm4 s GLN 140 CO 0.15 0.30 -0.11 -1.64 -0.50 0.00 0.00 175.29 173.49 1mm4 s MET 141 N 0.27 2.00 -0.19 1.67 -1.94 -0.31 -0.41 119.30 120.39 1mm4 s MET 141 Ca 0.02 -0.56 -0.10 0.00 -1.71 0.00 0.00 55.69 53.34 1mm4 s MET 141 Cb -0.13 -2.07 -0.05 0.00 2.01 0.00 0.00 34.83 34.59 1mm4 s MET 141 CO 0.01 -0.31 0.15 0.95 -0.01 0.00 0.00 175.02 175.81 1mm4 s THR 142 N 1.52 5.41 0.12 2.05 -4.23 -1.07 -1.42 115.64 118.03 1mm4 s THR 142 Ca 0.03 0.23 0.04 0.00 -1.18 0.00 0.00 61.69 60.80 1mm4 s THR 142 Cb -0.14 -3.48 -0.04 0.00 1.34 0.00 0.00 72.50 70.18 1mm4 s THR 142 CO -0.09 0.46 -0.09 -0.47 -0.54 0.00 0.00 174.62 173.88 1mm4 s TYR 143 N 0.20 1.13 0.02 3.99 6.14 -1.06 -2.55 117.35 125.23 1mm4 s TYR 143 Ca 0.10 -0.78 0.00 0.00 0.64 0.00 0.00 57.07 57.03 1mm4 s TYR 143 Cb -0.11 -0.60 -0.01 0.00 0.42 0.00 0.00 41.96 41.65 1mm4 s TYR 143 CO -0.01 0.01 -0.03 0.96 0.64 0.00 0.00 175.55 177.12 1mm4 s ILE 144 N -3.22 0.15 0.98 3.14 -0.00 -1.26 -3.59 121.20 117.39 1mm4 s ILE 144 Ca 0.13 -0.67 -0.13 0.00 -0.00 0.00 0.00 60.65 59.98 1mm4 s ILE 144 Cb 0.02 -0.24 0.18 0.00 -0.00 0.00 0.00 42.46 42.42 1mm4 s ILE 144 CO -0.01 -0.34 1.11 -2.16 -0.00 0.00 0.00 174.94 173.54 1mm4 s PRO 145 N -1.05 0.56 0.00 0.37 0.04 -1.26 -5.07 135.00 128.59 1mm4 s PRO 145 Ca -0.11 0.41 0.00 0.00 0.04 0.00 0.00 61.00 61.34 1mm4 s PRO 145 Cb -0.07 -1.76 0.00 0.00 0.04 0.00 0.00 34.50 32.71 1mm4 s PRO 145 CO -0.01 -2.62 0.00 0.41 0.04 0.00 0.00 177.00 174.83 1mm4 n GLY 146 N -1.45 3.71 0.11 0.56 0.00 -1.26 -5.07 105.19 101.79 1mm4 n GLY 146 Ca 0.06 -1.25 -0.13 0.00 0.00 0.00 0.00 46.02 44.69 1mm4 n GLY 146 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mm4 n THR 147 N 0.00 1.48 0.06 2.61 -2.24 -1.26 -4.99 114.28 109.94 1mm4 n THR 147 Ca 0.00 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 61.03 1mm4 n THR 147 Cb 0.00 -0.93 0.00 0.00 -2.10 0.00 0.00 70.33 67.30 1mm4 n THR 147 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1mm4 n TYR 148 N -3.00 -2.40 -3.46 4.78 4.19 -1.26 -5.10 117.16 110.90 1mm4 n TYR 148 Ca -0.34 0.38 -0.41 0.00 3.31 0.00 0.00 57.90 60.84 1mm4 n TYR 148 Cb 1.09 1.21 -0.10 0.00 0.49 0.00 0.00 39.34 42.03 1mm4 n TYR 148 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 1mm4 s ASN 149 N -2.00 6.12 -0.22 2.98 4.22 -1.26 -4.92 114.94 119.86 1mm4 s ASN 149 Ca 0.00 -0.39 0.09 0.00 -2.14 0.00 0.00 52.86 50.42 1mm4 s ASN 149 Cb 0.00 -2.17 -0.20 0.00 1.28 0.00 0.00 41.25 40.16 1mm4 s ASN 149 CO 0.00 -0.31 -0.08 0.59 -2.04 0.00 0.00 177.10 175.26 1mm4 n ASN 150 N 5.24 1.19 0.00 3.54 5.03 -1.26 -5.00 115.26 124.00 1mm4 n ASN 150 Ca -0.11 -0.07 0.00 0.00 0.87 0.00 0.00 54.58 55.27 1mm4 n ASN 150 Cb 0.49 0.26 0.00 0.00 -1.02 0.00 0.00 39.78 39.52 1mm4 n ASN 150 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1mm4 n GLY 151 N 2.07 0.50 3.60 7.41 0.00 -1.26 -3.76 105.19 113.76 1mm4 n GLY 151 Ca -0.38 -0.88 -0.26 0.00 0.00 0.00 0.00 46.02 44.50 1mm4 n GLY 151 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1mm4 n ASN 152 N 1.76 -5.77 -4.61 1.61 5.15 -1.26 -4.89 115.26 107.24 1mm4 n ASN 152 Ca 0.00 -0.57 -0.43 0.00 -0.60 0.00 0.00 54.58 52.98 1mm4 n ASN 152 Cb 0.20 -4.58 -0.02 0.00 -0.53 0.00 0.00 39.78 34.85 1mm4 n ASN 152 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 1mm4 s VAL 153 N -3.27 3.85 0.01 3.44 0.11 -1.25 -4.99 120.40 118.30 1mm4 s VAL 153 Ca 0.56 0.91 0.01 0.00 -2.93 0.00 0.00 61.98 60.53 1mm4 s VAL 153 Cb -0.26 -4.01 -0.01 0.00 -1.53 0.00 0.00 36.38 30.57 1mm4 s VAL 153 CO 0.70 -0.55 -0.03 -0.31 -3.33 0.00 0.00 175.10 171.58 1mm4 s TYR 154 N 5.37 0.30 0.04 1.54 1.51 -1.26 -4.72 117.35 120.12 1mm4 s TYR 154 Ca 0.65 -0.18 0.06 0.00 -1.01 0.00 0.00 57.07 56.58 1mm4 s TYR 154 Cb -0.18 -0.19 -0.03 0.00 -0.11 0.00 0.00 41.96 41.44 1mm4 s TYR 154 CO 0.30 -0.04 -0.12 -0.06 -1.11 0.00 0.00 175.55 174.52 1mm4 s PHE 155 N -0.47 2.73 0.27 2.71 0.40 -1.06 -5.01 117.98 117.57 1mm4 s PHE 155 Ca -0.03 -0.15 0.07 0.00 -0.60 0.00 0.00 56.93 56.23 1mm4 s PHE 155 Cb -0.04 -1.51 -0.03 0.00 0.51 0.00 0.00 43.02 41.95 1mm4 s PHE 155 CO -0.00 0.34 0.20 0.00 0.70 0.00 0.00 175.22 176.46 1mm4 s ALA 156 N -1.03 3.61 0.20 5.36 0.00 -1.26 -2.59 121.76 126.05 1mm4 s ALA 156 Ca 0.17 -1.50 -0.24 0.00 0.00 0.00 0.00 51.96 50.39 1mm4 s ALA 156 Cb -0.11 -1.21 0.05 0.00 0.00 0.00 0.00 23.12 21.84 1mm4 s ALA 156 CO 0.08 0.19 0.86 -1.58 0.00 0.00 0.00 175.76 175.32 1mm4 s TRP 157 N -2.20 -0.16 -0.01 0.00 0.51 0.45 -4.59 118.94 112.95 1mm4 s TRP 157 Ca 0.35 -0.20 0.01 0.00 -2.12 0.00 0.00 56.10 54.14 1mm4 s TRP 157 Cb -0.07 0.66 0.00 0.00 -0.81 0.00 0.00 33.47 33.25 1mm4 s TRP 157 CO 0.25 -0.98 -0.02 -1.64 -0.51 0.00 0.00 176.95 174.05 1mm4 s MET 158 N -3.52 0.20 -0.06 4.98 -1.94 -0.88 -2.18 119.30 115.89 1mm4 s MET 158 Ca 0.12 -0.06 0.00 0.00 -1.71 0.00 0.00 55.69 54.04 1mm4 s MET 158 Cb -0.03 -0.22 0.02 0.00 2.01 0.00 0.00 34.83 36.61 1mm4 s MET 158 CO 0.04 0.02 -0.04 0.50 -0.01 0.00 0.00 175.02 175.54 1mm4 s ARG 159 N 0.10 0.87 0.02 2.03 3.52 -1.00 -2.46 118.95 122.04 1mm4 s ARG 159 Ca -0.01 -0.06 0.00 0.00 -0.13 0.00 0.00 55.73 55.53 1mm4 s ARG 159 Cb -0.03 -1.01 -0.04 0.00 -1.56 0.00 0.00 34.95 32.32 1mm4 s ARG 159 CO -0.00 -0.18 0.11 -0.06 -0.81 0.00 0.00 175.30 174.36 1mm4 s PHE 160 N 1.39 3.34 -0.06 5.12 0.40 -0.68 -2.60 117.98 124.89 1mm4 s PHE 160 Ca -0.03 0.21 0.05 0.00 -0.60 0.00 0.00 56.93 56.55 1mm4 s PHE 160 Cb -0.13 -1.73 -0.00 0.00 0.51 0.00 0.00 43.02 41.66 1mm4 s PHE 160 CO -0.03 0.57 -0.21 -0.65 0.70 0.00 0.00 175.22 175.60 1mm4 s GLN 161 N -2.00 2.22 -0.02 0.44 1.11 -0.31 -0.49 119.66 120.60 1mm4 s GLN 161 Ca 0.26 -0.74 0.01 0.00 0.01 0.00 0.00 55.36 54.90 1mm4 s GLN 161 Cb -0.12 -1.86 0.01 0.00 -1.01 0.00 0.00 33.01 30.03 1mm4 s GLN 161 CO 0.18 0.28 -0.03 -0.06 0.01 0.00 0.00 175.29 175.66 1mm4 s PHE 162 N 0.03 0.49 0.12 0.91 0.08 -0.38 -4.88 117.98 114.36 1mm4 s PHE 162 Ca -0.06 -0.09 0.05 0.00 0.12 0.00 0.00 56.93 56.94 1mm4 s PHE 162 Cb -0.13 -0.44 -0.04 0.00 -0.57 0.00 0.00 43.02 41.84 1mm4 s PHE 162 CO 0.04 -0.10 0.07 -1.17 -0.10 0.00 0.00 175.22 173.96 1mm4 s LEU 163 N 0.54 3.68 -0.20 -0.37 2.96 -1.26 -1.69 118.68 122.34 1mm4 s LEU 163 Ca -0.06 -0.13 0.00 0.00 -0.22 0.00 0.00 54.13 53.72 1mm4 s LEU 163 Cb -0.09 -2.35 0.05 0.00 0.50 0.00 0.00 46.19 44.30 1mm4 s LEU 163 CO -0.00 0.13 -0.06 -1.61 -1.32 0.00 0.00 176.35 173.48 1mm4 s GLU 164 N -2.68 1.61 0.49 1.98 8.01 -1.26 -5.04 118.70 121.80 1mm4 s GLU 164 Ca 0.29 -0.75 -0.08 0.00 0.01 0.00 0.00 54.97 54.44 1mm4 s GLU 164 Cb -0.11 -2.31 0.13 0.00 -4.31 0.00 0.00 34.13 27.53 1mm4 s GLU 164 CO 0.21 -0.49 0.29 0.72 0.01 0.00 0.00 175.26 176.00 1mm4 n HIS 165 N 4.77 -2.63 -3.30 1.61 8.25 -1.26 -4.99 115.22 117.67 1mm4 n HIS 165 Ca -0.13 -0.27 0.00 0.00 -0.26 0.00 0.00 57.72 57.06 1mm4 n HIS 165 Cb 0.46 -0.41 0.00 0.00 1.12 0.00 0.00 29.99 31.16 1mm4 n HIS 165 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1mm4 n HIS 166 N -3.92 -0.68 -2.59 4.41 8.25 -1.26 -5.09 115.22 114.34 1mm4 n HIS 166 Ca 0.05 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.47 1mm4 n HIS 166 Cb 0.20 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.28 1mm4 n HIS 166 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1mm4 n HIS 167 N 0.00 -4.13 -1.53 4.41 8.25 -1.26 -4.88 115.22 116.08 1mm4 n HIS 167 Ca 0.00 2.19 0.00 0.00 -0.26 0.00 0.00 57.72 59.65 1mm4 n HIS 167 Cb 0.00 -3.87 0.00 0.00 1.12 0.00 0.00 29.99 27.24 1mm4 n HIS 167 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1mm4 n HIS 168 N 1.24 -4.02 -2.13 4.41 -0.00 -1.26 -5.03 115.22 108.44 1mm4 n HIS 168 Ca -0.24 2.10 -0.04 0.00 -0.00 0.00 0.00 57.72 59.54 1mm4 n HIS 168 Cb 0.38 -3.32 0.00 0.00 -0.00 0.00 0.00 29.99 27.05 1mm4 n HIS 168 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1mm4 n HIS 169 N 0.04 -0.52 -0.38 1.57 -0.00 -1.26 -5.14 115.22 109.54 1mm4 n HIS 169 Ca 0.00 -0.65 0.00 0.00 -0.00 0.00 0.00 57.72 57.07 1mm4 n HIS 169 Cb 0.00 0.72 0.00 0.00 -0.00 0.00 0.00 29.99 30.71 1mm4 n HIS 169 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92