#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 2.25 0.65 7.83 3.84 -1.26 -5.00 114.94 123.25 1mm4 s ASN 2 Ca 0.00 -0.50 0.38 0.00 0.21 0.00 0.00 52.86 52.95 1mm4 s ASN 2 Cb 0.00 -0.40 2.11 0.00 -0.55 0.00 0.00 41.25 42.41 1mm4 s ASN 2 CO 0.00 -0.29 2.24 0.00 -2.79 0.00 0.00 177.10 176.26 1mm4 h ALA 3 N 8.34 1.23 0.10 1.71 0.00 -2.05 0.26 119.26 128.86 1mm4 h ALA 3 Ca -0.16 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 1mm4 h ALA 3 Cb 1.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1mm4 h ALA 3 CO 0.28 -0.10 -0.05 0.22 0.00 0.00 0.00 179.25 179.60 1mm4 h ASP 4 N 0.00 -0.12 0.51 0.00 1.82 -1.99 -2.60 116.42 114.04 1mm4 h ASP 4 Ca 0.01 -0.25 -0.04 0.00 -0.39 0.00 0.00 57.03 56.36 1mm4 h ASP 4 Cb 0.19 0.03 -0.01 0.00 0.68 0.00 0.00 39.33 40.23 1mm4 h ASP 4 CO -0.00 0.47 -0.21 -0.08 -1.61 0.00 0.00 179.24 177.81 1mm4 h GLU 5 N -1.00 0.00 -0.00 0.28 4.81 -1.90 -2.42 114.58 114.36 1mm4 h GLU 5 Ca -0.01 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 59.06 1mm4 h GLU 5 Cb 0.36 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1mm4 h GLU 5 CO 0.02 0.21 -0.72 -1.49 -0.73 0.00 0.00 179.01 176.31 1mm4 h TRP 6 N 0.00 0.03 -0.02 0.92 4.06 -0.59 -3.13 115.95 117.21 1mm4 h TRP 6 Ca -0.00 -0.02 -0.16 0.00 2.06 0.00 0.00 58.89 60.77 1mm4 h TRP 6 Cb 0.52 -0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.66 1mm4 h TRP 6 CO 0.00 0.73 -0.72 1.98 -3.56 0.00 0.00 178.44 176.87 1mm4 h MET 7 N 0.02 0.14 0.28 0.49 4.05 -1.02 -3.09 114.93 115.80 1mm4 h MET 7 Ca -0.01 -0.12 -0.01 0.00 -0.28 0.00 0.00 59.70 59.27 1mm4 h MET 7 Cb 1.27 0.03 0.00 0.00 -0.80 0.00 0.00 31.60 32.10 1mm4 h MET 7 CO 0.10 0.80 -0.14 1.79 0.23 0.00 0.00 176.91 179.68 1mm4 h THR 8 N 0.09 0.71 -0.12 -0.77 1.35 -1.46 -1.20 112.91 111.51 1mm4 h THR 8 Ca -0.02 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.84 1mm4 h THR 8 Cb 1.28 0.71 -0.01 0.00 -1.73 0.00 0.00 68.15 68.40 1mm4 h THR 8 CO 0.11 0.00 0.06 0.00 -0.25 0.00 0.00 175.52 175.44 1mm4 h THR 9 N -0.39 1.04 -0.21 6.82 1.03 -1.61 -2.31 112.91 117.27 1mm4 h THR 9 Ca -0.04 -0.10 -0.05 0.00 -0.01 0.00 0.00 66.41 66.20 1mm4 h THR 9 Cb 0.31 0.88 -0.01 0.00 -1.07 0.00 0.00 68.15 68.26 1mm4 h THR 9 CO 0.06 0.04 -0.08 0.15 -0.01 0.00 0.00 175.52 175.68 1mm4 h PHE 10 N 0.16 0.49 -0.47 0.00 3.57 -1.34 -2.52 116.94 116.83 1mm4 h PHE 10 Ca 0.04 -0.12 0.01 0.00 3.53 0.00 0.00 57.97 61.44 1mm4 h PHE 10 Cb 0.01 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 38.61 1mm4 h PHE 10 CO 0.00 0.70 0.30 -0.09 -2.23 0.00 0.00 178.31 176.99 1mm4 h ARG 11 N 0.14 0.60 -0.09 1.11 1.12 -0.71 -1.86 114.38 114.68 1mm4 h ARG 11 Ca 0.05 -0.04 -0.01 0.00 -1.11 0.00 0.00 59.98 58.87 1mm4 h ARG 11 Cb 0.56 -0.13 -0.01 0.00 -0.01 0.00 0.00 29.97 30.38 1mm4 h ARG 11 CO 0.03 0.40 -0.01 1.49 -3.11 0.00 0.00 179.97 178.76 1mm4 h GLU 12 N 0.62 0.12 -0.32 0.20 4.81 -1.42 -1.80 114.58 116.78 1mm4 h GLU 12 Ca 0.17 -0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.30 1mm4 h GLU 12 Cb -0.06 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.28 1mm4 h GLU 12 CO -0.05 0.15 -0.20 -0.97 -0.73 0.00 0.00 179.01 177.22 1mm4 h ASN 13 N 0.12 0.59 0.46 1.04 -0.00 -0.89 -2.02 115.58 114.88 1mm4 h ASN 13 Ca 0.03 -0.19 -0.12 0.00 -0.00 0.00 0.00 56.30 56.02 1mm4 h ASN 13 Cb 0.10 -0.16 -0.01 0.00 -0.00 0.00 0.00 38.32 38.25 1mm4 h ASN 13 CO 0.00 0.79 -0.54 0.40 -0.00 0.00 0.00 177.43 178.09 1mm4 h ILE 14 N 0.53 1.38 -0.08 2.57 1.08 -1.02 -2.32 117.51 119.64 1mm4 h ILE 14 Ca 0.08 -1.84 -0.15 0.00 -0.39 0.00 0.00 64.86 62.57 1mm4 h ILE 14 Cb 0.63 1.96 0.01 0.00 -3.07 0.00 0.00 36.82 36.35 1mm4 h ILE 14 CO 0.04 0.53 -0.53 0.00 -0.69 0.00 0.00 178.15 177.51 1mm4 h ALA 15 N 1.39 0.18 -0.58 1.87 0.00 -1.21 -2.76 119.26 118.15 1mm4 h ALA 15 Ca -0.00 -0.52 -0.05 0.00 0.00 0.00 0.00 54.91 54.34 1mm4 h ALA 15 Cb 0.97 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.74 1mm4 h ALA 15 CO 0.07 0.38 0.17 0.37 0.00 0.00 0.00 179.25 180.24 1mm4 h GLN 16 N 0.08 0.91 0.41 0.00 4.15 -1.35 0.88 115.11 120.19 1mm4 h GLN 16 Ca -0.04 -0.20 -0.02 0.00 0.77 0.00 0.00 58.65 59.15 1mm4 h GLN 16 Cb 1.19 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 28.75 1mm4 h GLN 16 CO 0.11 0.83 -0.20 1.79 -1.93 0.00 0.00 178.83 179.43 1mm4 h THR 17 N 0.82 0.60 -0.11 2.39 1.35 -1.48 0.54 112.91 117.02 1mm4 h THR 17 Ca 0.18 -0.00 -0.06 0.00 -0.55 0.00 0.00 66.41 65.99 1mm4 h THR 17 Cb 0.31 0.60 -0.01 0.00 -1.73 0.00 0.00 68.15 67.32 1mm4 h THR 17 CO -0.00 0.00 -0.19 -0.50 -0.25 0.00 0.00 175.52 174.58 1mm4 h TRP 18 N -0.56 0.19 0.53 4.73 4.06 -1.44 -2.38 115.95 121.07 1mm4 h TRP 18 Ca -0.06 -0.02 -0.03 0.00 2.06 0.00 0.00 58.89 60.84 1mm4 h TRP 18 Cb 0.43 -0.05 0.01 0.00 -1.00 0.00 0.00 29.16 28.54 1mm4 h TRP 18 CO -0.05 0.36 -0.25 1.96 -3.56 0.00 0.00 178.44 176.90 1mm4 h GLN 19 N 0.17 -0.69 -3.11 0.49 4.20 -0.47 -3.39 115.11 112.31 1mm4 h GLN 19 Ca 0.03 0.05 -0.62 0.00 0.06 0.00 0.00 58.65 58.17 1mm4 h GLN 19 Cb 0.43 0.16 -0.42 0.00 0.30 0.00 0.00 27.48 27.95 1mm4 h GLN 19 CO 0.03 -0.46 -0.59 -1.14 -0.67 0.00 0.00 178.83 176.00 1mm4 s GLN 20 N -4.00 2.35 1.15 1.46 0.74 0.15 -5.08 119.66 116.44 1mm4 s GLN 20 Ca -0.10 -3.21 -0.18 0.00 0.05 0.00 0.00 55.36 51.92 1mm4 s GLN 20 Cb 0.01 -3.35 0.26 0.00 1.10 0.00 0.00 33.01 31.03 1mm4 s GLN 20 CO 0.31 -1.26 1.13 -1.25 -0.55 0.00 0.00 175.29 173.67 1mm4 s PRO 21 N -1.24 -0.81 0.53 1.67 0.04 -0.90 -4.72 135.00 129.56 1mm4 s PRO 21 Ca 0.24 -0.02 0.07 0.00 0.04 0.00 0.00 61.00 61.33 1mm4 s PRO 21 Cb -0.08 -1.64 0.04 0.00 0.04 0.00 0.00 34.50 32.87 1mm4 s PRO 21 CO -0.14 -3.45 0.53 -1.21 0.04 0.00 0.00 177.00 172.77 1mm4 s GLU 22 N -5.39 2.34 0.88 4.56 8.01 -1.26 -5.11 118.70 122.73 1mm4 s GLU 22 Ca 0.70 -1.79 -0.10 0.00 0.01 0.00 0.00 54.97 53.79 1mm4 s GLU 22 Cb -0.10 -2.35 0.12 0.00 -4.31 0.00 0.00 34.13 27.49 1mm4 s GLU 22 CO 0.56 -0.61 1.12 -3.38 0.01 0.00 0.00 175.26 172.95 1mm4 s HIS 23 N -2.67 1.96 -0.43 1.61 -3.43 -1.26 -4.97 115.29 106.10 1mm4 s HIS 23 Ca 0.46 1.65 -0.12 0.00 -0.80 0.00 0.00 55.06 56.25 1mm4 s HIS 23 Cb -0.04 -3.22 0.06 0.00 -1.43 0.00 0.00 32.58 27.95 1mm4 s HIS 23 CO 0.28 -2.51 0.30 0.71 -2.00 0.00 0.00 174.74 171.52 1mm4 s TYR 24 N -2.74 3.27 -0.13 0.38 2.02 -0.60 -4.70 117.35 114.85 1mm4 s TYR 24 Ca 0.65 -1.07 -0.28 0.00 -0.37 0.00 0.00 57.07 55.99 1mm4 s TYR 24 Cb -0.21 -2.86 -0.01 0.00 -0.40 0.00 0.00 41.96 38.49 1mm4 s TYR 24 CO 0.58 -0.75 0.97 -0.51 -1.57 0.00 0.00 175.55 174.26 1mm4 s ASP 25 N 2.09 7.16 0.01 2.29 1.11 -0.94 -2.20 116.67 126.19 1mm4 s ASP 25 Ca 0.03 1.43 0.07 0.00 0.18 0.00 0.00 52.55 54.26 1mm4 s ASP 25 Cb -0.22 -2.53 -0.03 0.00 1.07 0.00 0.00 42.92 41.21 1mm4 s ASP 25 CO 0.06 -0.46 -0.19 -1.48 1.18 0.00 0.00 175.17 174.28 1mm4 s LEU 26 N 2.15 2.51 -0.17 1.23 2.34 -0.97 -2.59 118.68 123.18 1mm4 s LEU 26 Ca 0.45 -0.40 -0.01 0.00 0.06 0.00 0.00 54.13 54.23 1mm4 s LEU 26 Cb -0.17 -1.48 0.05 0.00 -0.56 0.00 0.00 46.19 44.03 1mm4 s LEU 26 CO 0.15 0.29 -0.01 -0.31 -1.06 0.00 0.00 176.35 175.41 1mm4 s TYR 27 N -0.82 1.33 0.04 3.48 2.02 -0.92 -1.88 117.35 120.60 1mm4 s TYR 27 Ca 0.13 -0.91 0.07 0.00 -0.37 0.00 0.00 57.07 55.99 1mm4 s TYR 27 Cb -0.10 -1.14 -0.03 0.00 -0.40 0.00 0.00 41.96 40.28 1mm4 s TYR 27 CO 0.03 -0.58 -0.18 0.96 -1.57 0.00 0.00 175.55 174.20 1mm4 s ILE 28 N 1.76 2.76 0.00 2.71 -4.36 -1.05 -1.52 121.20 121.49 1mm4 s ILE 28 Ca 0.00 -1.17 0.00 0.00 -0.26 0.00 0.00 60.65 59.22 1mm4 s ILE 28 Cb -0.16 -2.15 0.00 0.00 1.25 0.00 0.00 42.46 41.40 1mm4 s ILE 28 CO -0.07 0.35 0.00 -0.81 0.24 0.00 0.00 174.94 174.65 1mm4 n PRO 29 N 1.61 -0.36 -2.84 0.37 -0.04 -1.26 -2.45 135.00 130.04 1mm4 n PRO 29 Ca -0.16 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.28 1mm4 n PRO 29 Cb 0.52 0.00 0.01 0.00 -0.04 0.00 0.00 33.50 33.99 1mm4 n PRO 29 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1mm4 s ALA 30 N -3.32 -3.16 0.03 0.55 0.00 -1.26 -4.81 121.76 109.79 1mm4 s ALA 30 Ca 0.00 0.25 0.02 0.00 0.00 0.00 0.00 51.96 52.23 1mm4 s ALA 30 Cb 0.00 -2.84 -0.02 0.00 0.00 0.00 0.00 23.12 20.26 1mm4 s ALA 30 CO 0.00 -2.35 -0.07 0.96 0.00 0.00 0.00 175.76 174.30 1mm4 s ILE 31 N 1.28 0.50 -0.09 0.00 -4.36 -1.26 -5.02 121.20 112.26 1mm4 s ILE 31 Ca 0.23 -0.77 -0.07 0.00 -0.26 0.00 0.00 60.65 59.79 1mm4 s ILE 31 Cb 0.03 -0.52 0.03 0.00 1.25 0.00 0.00 42.46 43.25 1mm4 s ILE 31 CO -0.08 -0.19 0.13 0.41 0.24 0.00 0.00 174.94 175.44 1mm4 n THR 32 N 2.01-13.20 -2.53 8.37 -1.04 -1.26 -5.01 114.28 101.63 1mm4 n THR 32 Ca -0.19 2.98 0.01 0.00 -2.04 0.00 0.00 64.05 64.81 1mm4 n THR 32 Cb 0.56 -6.35 0.02 0.00 -1.82 0.00 0.00 70.33 62.74 1mm4 n THR 32 CO 0.00 0.00 0.00 1.87 -0.64 0.00 0.00 175.07 176.30 1mm4 n TRP 33 N 1.76 0.15 -4.08 -1.42 -0.00 -1.26 -5.11 117.44 107.49 1mm4 n TRP 33 Ca -0.23 -1.05 -0.03 0.00 -0.00 0.00 0.00 57.50 56.19 1mm4 n TRP 33 Cb 0.35 0.09 -0.01 0.00 -0.00 0.00 0.00 31.31 31.74 1mm4 n TRP 33 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 177.69 179.27 1mm4 n HIS 34 N -0.06 0.10 -3.65 5.87 -0.00 -1.26 -5.17 115.22 111.06 1mm4 n HIS 34 Ca -0.01 -0.28 -0.05 0.00 0.46 0.00 0.00 57.72 57.84 1mm4 n HIS 34 Cb 0.96 -0.03 -0.07 0.00 -0.12 0.00 0.00 29.99 30.73 1mm4 n HIS 34 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 1mm4 s ALA 35 N -2.10 -2.16 0.14 1.57 0.00 -1.26 -5.09 121.76 112.86 1mm4 s ALA 35 Ca 0.01 1.75 0.00 0.00 0.00 0.00 0.00 51.96 53.72 1mm4 s ALA 35 Cb 0.00 -1.68 0.00 0.00 0.00 0.00 0.00 23.12 21.44 1mm4 s ALA 35 CO 0.00 -0.15 0.00 -2.13 0.00 0.00 0.00 175.76 173.49 1mm4 n ARG 36 N 1.83 0.00 -4.05 0.00 3.00 -1.26 -5.12 116.66 111.06 1mm4 n ARG 36 Ca -0.11 0.00 -0.22 0.00 -0.00 0.00 0.00 57.85 57.52 1mm4 n ARG 36 Cb 0.57 -0.08 -0.05 0.00 0.00 0.00 0.00 32.46 32.90 1mm4 n ARG 36 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.63 177.04 1mm4 s PHE 37 N -2.00 2.94 0.03 -0.14 -0.12 -1.26 -5.09 117.98 112.34 1mm4 s PHE 37 Ca 0.00 -0.22 -0.30 0.00 -0.05 0.00 0.00 56.93 56.36 1mm4 s PHE 37 Cb 0.00 -1.52 -0.04 0.00 -0.63 0.00 0.00 43.02 40.83 1mm4 s PHE 37 CO 0.00 0.41 1.09 0.00 -0.05 0.00 0.00 175.22 176.67 1mm4 s ALA 38 N -2.25 3.28 -0.18 1.99 0.00 -1.26 -5.03 121.76 118.31 1mm4 s ALA 38 Ca 0.36 0.70 -0.12 0.00 0.00 0.00 0.00 51.96 52.90 1mm4 s ALA 38 Cb -0.06 -3.39 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 1mm4 s ALA 38 CO 0.24 -0.33 0.20 1.52 0.00 0.00 0.00 175.76 177.39 1mm4 s TYR 39 N 1.02 3.43 0.14 0.00 -0.85 -1.26 -5.05 117.35 114.79 1mm4 s TYR 39 Ca 0.55 0.44 -0.31 0.00 -0.52 0.00 0.00 57.07 57.23 1mm4 s TYR 39 Cb -0.25 -2.24 -0.10 0.00 0.38 0.00 0.00 41.96 39.74 1mm4 s TYR 39 CO 0.29 0.26 1.75 0.34 -1.52 0.00 0.00 175.55 176.66 1mm4 s ASP 40 N 0.43 6.45 0.56 -0.18 2.15 -1.26 -4.98 116.67 119.85 1mm4 s ASP 40 Ca 0.12 2.74 -0.15 0.00 0.43 0.00 0.00 52.55 55.69 1mm4 s ASP 40 Cb -0.12 -2.58 -0.06 0.00 -0.30 0.00 0.00 42.92 39.86 1mm4 s ASP 40 CO 0.01 -0.96 1.01 -0.54 -0.17 0.00 0.00 175.17 174.52 1mm4 s LYS 41 N 2.10 3.72 -0.10 4.34 1.02 -1.26 -5.01 119.74 124.56 1mm4 s LYS 41 Ca 0.77 0.94 -0.03 0.00 0.02 0.00 0.00 55.97 57.67 1mm4 s LYS 41 Cb -0.46 -2.10 -0.05 0.00 -0.52 0.00 0.00 37.83 34.70 1mm4 s LYS 41 CO 0.34 -0.46 -0.11 0.39 -0.92 0.00 0.00 175.35 174.59 1mm4 n GLU 42 N -2.02 0.22 -2.87 1.68 -0.58 -1.26 -4.95 120.64 110.86 1mm4 n GLU 42 Ca 0.07 0.07 -0.10 0.00 -0.42 0.00 0.00 57.16 56.78 1mm4 n GLU 42 Cb 0.54 -0.99 0.00 0.00 -0.57 0.00 0.00 31.44 30.42 1mm4 n GLU 42 CO 0.00 0.00 0.00 0.36 -0.48 0.00 0.00 177.13 177.01 1mm4 n LYS 43 N -3.15 0.59 -3.59 3.49 0.00 -1.26 -5.10 118.16 109.13 1mm4 n LYS 43 Ca -0.18 -2.18 -0.25 0.00 -0.00 0.00 0.00 58.31 55.70 1mm4 n LYS 43 Cb 0.65 -1.47 -0.16 0.00 -0.00 0.00 0.00 35.03 34.04 1mm4 n LYS 43 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.40 178.39 1mm4 s THR 44 N 0.55 -0.12 0.00 0.58 2.01 -1.26 -4.94 115.64 112.47 1mm4 s THR 44 Ca 0.31 -0.18 0.00 0.00 0.31 0.00 0.00 61.69 62.13 1mm4 s THR 44 Cb 0.09 -0.60 0.00 0.00 0.01 0.00 0.00 72.50 72.00 1mm4 s THR 44 CO -0.14 -0.29 0.00 0.47 -0.69 0.00 0.00 174.62 173.97 1mm4 n ASP 45 N 5.28 0.00 -0.03 3.53 10.43 -1.26 -5.03 116.55 129.48 1mm4 n ASP 45 Ca -0.07 0.00 -0.05 0.00 2.57 0.00 0.00 54.79 57.24 1mm4 n ASP 45 Cb 0.49 0.32 -0.02 0.00 1.84 0.00 0.00 41.12 43.74 1mm4 n ASP 45 CO 0.00 0.00 0.00 -1.14 -1.07 0.00 0.00 177.20 174.99 1mm4 n ARG 46 N -2.07 0.14 -2.08 -1.24 3.00 -1.26 -4.96 116.66 108.19 1mm4 n ARG 46 Ca 0.00 0.04 -0.42 0.00 -0.00 0.00 0.00 57.85 57.47 1mm4 n ARG 46 Cb 0.00 -0.92 -0.03 0.00 0.00 0.00 0.00 32.46 31.51 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 -2.11 1.91 -0.28 -0.14 1.51 -1.26 -4.97 117.35 112.01 1mm4 s TYR 47 Ca -0.08 0.65 -0.06 0.00 -1.01 0.00 0.00 57.07 56.57 1mm4 s TYR 47 Cb 0.03 -4.16 0.00 0.00 -0.11 0.00 0.00 41.96 37.72 1mm4 s TYR 47 CO 0.12 -2.67 0.06 -0.80 -1.11 0.00 0.00 175.55 171.15 1mm4 s ASN 48 N 5.88 5.01 0.32 2.29 0.01 -1.26 -4.82 114.94 122.37 1mm4 s ASN 48 Ca 0.74 -0.64 0.07 0.00 -0.71 0.00 0.00 52.86 52.32 1mm4 s ASN 48 Cb -0.19 -1.86 -0.02 0.00 0.41 0.00 0.00 41.25 39.58 1mm4 s ASN 48 CO 0.32 -0.16 0.34 -0.70 -1.51 0.00 0.00 177.10 175.39 1mm4 s GLU 49 N 1.50 2.92 -0.04 -0.60 2.12 -1.26 -5.12 118.70 118.21 1mm4 s GLU 49 Ca 0.03 -1.14 -0.03 0.00 0.36 0.00 0.00 54.97 54.19 1mm4 s GLU 49 Cb -0.17 -2.62 -0.04 0.00 0.26 0.00 0.00 34.13 31.56 1mm4 s GLU 49 CO 0.02 0.15 0.14 0.50 -0.54 0.00 0.00 175.26 175.53 1mm4 s ARG 50 N -4.03 3.35 1.01 4.30 3.52 -1.26 -5.09 118.95 120.76 1mm4 s ARG 50 Ca 0.41 -0.30 -0.15 0.00 -0.13 0.00 0.00 55.73 55.56 1mm4 s ARG 50 Cb -0.07 -3.07 0.06 0.00 -1.56 0.00 0.00 34.95 30.31 1mm4 s ARG 50 CO 0.28 0.70 0.27 -2.30 -0.81 0.00 0.00 175.30 173.44 1mm4 n PRO 51 N 1.34 -0.79 -3.67 5.12 -0.02 -1.26 -5.04 135.00 130.68 1mm4 n PRO 51 Ca -0.14 -0.20 -0.14 0.00 -2.02 0.00 0.00 63.50 61.00 1mm4 n PRO 51 Cb 0.53 -1.81 -0.13 0.00 -0.02 0.00 0.00 33.50 32.07 1mm4 n PRO 51 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 1mm4 s TRP 52 N -2.34 -0.39 0.00 6.00 0.52 -1.26 -5.13 118.94 116.34 1mm4 s TRP 52 Ca 0.57 0.91 0.00 0.00 0.02 0.00 0.00 56.10 57.60 1mm4 s TRP 52 Cb -0.18 -0.05 0.00 0.00 -1.15 0.00 0.00 33.47 32.09 1mm4 s TRP 52 CO 0.67 -0.33 0.00 0.41 0.02 0.00 0.00 176.95 177.72 1mm4 n GLY 53 N 5.23 3.53 0.00 0.98 0.00 -1.26 -4.25 105.19 109.42 1mm4 n GLY 53 Ca -0.08 -1.78 0.00 0.00 0.00 0.00 0.00 46.02 44.16 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 -1.59 0.64 3.23 -0.02 0.00 -0.69 -4.97 105.19 101.79 1mm4 n GLY 54 Ca 0.00 -2.09 -0.26 0.00 0.00 0.00 0.00 46.02 43.68 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 1.06 -0.17 -0.02 0.00 -0.58 -1.66 107.32 105.95 1mm4 s GLY 55 Ca 0.00 -0.99 -0.11 0.00 0.00 0.00 0.00 44.72 43.63 1mm4 s GLY 55 CO 0.00 -0.89 0.43 -1.36 0.00 0.00 0.00 173.10 171.28 1mm4 s PHE 56 N -0.70 -0.60 0.00 1.90 0.08 -0.58 -2.16 117.98 115.93 1mm4 s PHE 56 Ca 0.07 1.30 -0.03 0.00 0.12 0.00 0.00 56.93 58.39 1mm4 s PHE 56 Cb -0.08 0.26 0.01 0.00 -0.57 0.00 0.00 43.02 42.64 1mm4 s PHE 56 CO 0.01 -0.33 0.13 0.41 -0.10 0.00 0.00 175.22 175.34 1mm4 n GLY 57 N 3.95 0.70 3.49 4.36 0.00 -1.07 -0.44 105.19 116.18 1mm4 n GLY 57 Ca -0.21 -0.87 -0.25 0.00 0.00 0.00 0.00 46.02 44.69 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 1.96 0.12 0.99 1.02 -0.05 -2.21 118.68 120.51 1mm4 s LEU 58 Ca 0.03 -1.68 0.04 0.00 0.02 0.00 0.00 54.13 52.54 1mm4 s LEU 58 Cb -0.00 -0.04 -0.04 0.00 0.02 0.00 0.00 46.19 46.13 1mm4 s LEU 58 CO 0.00 -0.94 -0.09 -0.94 0.02 0.00 0.00 176.35 174.40 1mm4 s SER 59 N -3.58 1.56 0.07 2.29 1.04 -1.26 -1.54 113.70 112.29 1mm4 s SER 59 Ca 0.26 -0.96 0.07 0.00 0.48 0.00 0.00 55.95 55.80 1mm4 s SER 59 Cb 0.03 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 66.13 1mm4 s SER 59 CO 0.16 -0.34 -0.20 -0.60 0.98 0.00 0.00 173.24 173.24 1mm4 s ARG 60 N -3.53 1.19 -0.16 4.02 6.06 0.10 -4.99 118.95 121.64 1mm4 s ARG 60 Ca 0.13 -1.01 -0.05 0.00 -2.50 0.00 0.00 55.73 52.30 1mm4 s ARG 60 Cb 0.02 -1.35 -0.03 0.00 0.06 0.00 0.00 34.95 33.65 1mm4 s ARG 60 CO -0.01 0.33 0.00 1.67 -2.50 0.00 0.00 175.30 174.79 1mm4 s TRP 61 N -0.99 3.12 -0.26 5.12 1.48 -1.26 -1.97 118.94 124.18 1mm4 s TRP 61 Ca 0.06 -0.11 -0.03 0.00 -1.06 0.00 0.00 56.10 54.95 1mm4 s TRP 61 Cb -0.09 -1.98 0.02 0.00 -1.16 0.00 0.00 33.47 30.26 1mm4 s TRP 61 CO 0.03 0.09 -0.03 0.34 -4.06 0.00 0.00 176.95 173.32 1mm4 s ASP 62 N 0.21 4.51 0.63 -2.66 -1.08 0.41 -4.97 116.67 113.72 1mm4 s ASP 62 Ca 0.00 -0.79 0.32 0.00 -0.52 0.00 0.00 52.55 51.56 1mm4 s ASP 62 Cb -0.13 -1.72 1.80 0.00 -1.46 0.00 0.00 42.92 41.40 1mm4 s ASP 62 CO 0.02 -0.13 2.09 -0.33 0.52 0.00 0.00 175.17 177.33 1mm4 h GLU 63 N 8.07 0.00 0.00 4.34 5.08 -1.99 0.20 114.58 130.29 1mm4 h GLU 63 Ca -0.33 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 57.99 1mm4 h GLU 63 Cb 1.12 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 1mm4 h GLU 63 CO 0.58 0.00 -0.18 0.87 -1.00 0.00 0.00 179.01 179.29 1mm4 h LYS 64 N 0.00 0.00 0.00 2.33 1.57 -2.05 -3.46 116.57 114.96 1mm4 h LYS 64 Ca 0.05 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1mm4 h LYS 64 Cb 0.49 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.80 1mm4 h LYS 64 CO -0.00 0.18 0.00 0.41 -0.57 0.00 0.00 179.45 179.47 1mm4 n GLY 65 N 0.07 1.37 3.21 3.86 0.00 0.69 -5.15 105.19 109.24 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 0.21 0.00 0.00 0.00 173.32 173.53 1mm4 s ASN 66 N -2.00 1.64 -0.33 1.61 2.47 -1.07 -4.91 114.94 112.35 1mm4 s ASN 66 Ca 0.00 -0.89 -0.01 0.00 0.42 0.00 0.00 52.86 52.38 1mm4 s ASN 66 Cb 0.00 -0.01 0.11 0.00 -1.45 0.00 0.00 41.25 39.90 1mm4 s ASN 66 CO 0.00 -0.28 0.14 0.86 -3.72 0.00 0.00 177.10 174.11 1mm4 s TRP 67 N -2.75 1.29 0.05 0.43 -0.11 -0.68 -0.45 118.94 116.72 1mm4 s TRP 67 Ca 0.10 -1.63 -0.31 0.00 1.22 0.00 0.00 56.10 55.48 1mm4 s TRP 67 Cb -0.01 -1.44 -0.07 0.00 -1.50 0.00 0.00 33.47 30.45 1mm4 s TRP 67 CO 0.00 -0.85 1.50 -1.01 -4.62 0.00 0.00 176.95 171.98 1mm4 s HIS 68 N 1.45 2.76 -0.32 5.86 3.76 -0.83 -1.48 115.29 126.49 1mm4 s HIS 68 Ca 0.12 0.64 -0.04 0.00 -0.15 0.00 0.00 55.06 55.64 1mm4 s HIS 68 Cb -0.19 -3.79 0.05 0.00 1.11 0.00 0.00 32.58 29.76 1mm4 s HIS 68 CO -0.20 -3.02 0.04 0.20 -0.85 0.00 0.00 174.74 170.91 1mm4 s GLY 69 N 1.93 1.79 -0.28 -2.22 0.00 -0.78 -0.72 107.32 107.04 1mm4 s GLY 69 Ca 0.68 -1.76 -0.05 0.00 0.00 0.00 0.00 44.72 43.59 1mm4 s GLY 69 CO 0.29 0.72 0.04 -2.27 0.00 0.00 0.00 173.10 171.89 1mm4 s LEU 70 N 1.31 3.69 0.01 0.66 0.20 -0.59 -2.25 118.68 121.72 1mm4 s LEU 70 Ca -0.04 -0.77 0.04 0.00 0.69 0.00 0.00 54.13 54.05 1mm4 s LEU 70 Cb -0.20 -1.82 -0.02 0.00 -0.43 0.00 0.00 46.19 43.73 1mm4 s LEU 70 CO 0.00 -0.18 -0.13 -0.31 -0.29 0.00 0.00 176.35 175.44 1mm4 s TYR 71 N 1.45 1.17 -0.22 5.38 2.02 -0.29 -0.88 117.35 125.98 1mm4 s TYR 71 Ca 0.02 -0.29 -0.01 0.00 -0.37 0.00 0.00 57.07 56.42 1mm4 s TYR 71 Cb -0.17 -0.72 0.06 0.00 -0.40 0.00 0.00 41.96 40.73 1mm4 s TYR 71 CO 0.01 0.01 -0.01 0.00 -1.57 0.00 0.00 175.55 173.98 1mm4 s ALA 72 N -0.58 1.52 0.63 3.71 0.00 0.42 -1.16 121.76 126.29 1mm4 s ALA 72 Ca 0.03 -1.06 0.03 0.00 0.00 0.00 0.00 51.96 50.96 1mm4 s ALA 72 Cb -0.06 -1.32 0.09 0.00 0.00 0.00 0.00 23.12 21.83 1mm4 s ALA 72 CO 0.00 -1.19 0.87 -1.64 0.00 0.00 0.00 175.76 173.80 1mm4 s MET 73 N 1.61 2.09 -0.29 0.00 -1.94 0.47 -1.53 119.30 119.71 1mm4 s MET 73 Ca -0.03 -1.16 -0.23 0.00 -1.71 0.00 0.00 55.69 52.55 1mm4 s MET 73 Cb -0.18 -2.47 0.18 0.00 2.01 0.00 0.00 34.83 34.37 1mm4 s MET 73 CO -0.07 -1.07 1.32 0.00 -0.01 0.00 0.00 175.02 175.18 1mm4 s ALA 74 N -2.90 -2.24 -0.01 3.03 0.00 -0.66 -1.48 121.76 117.50 1mm4 s ALA 74 Ca 0.62 1.78 0.06 0.00 0.00 0.00 0.00 51.96 54.43 1mm4 s ALA 74 Cb -0.07 -1.74 -0.02 0.00 0.00 0.00 0.00 23.12 21.30 1mm4 s ALA 74 CO 0.41 -0.17 -0.20 -0.59 0.00 0.00 0.00 175.76 175.22 1mm4 s PHE 75 N 0.27 1.75 -0.23 0.00 -0.71 -1.08 -1.71 117.98 116.27 1mm4 s PHE 75 Ca 0.04 -0.33 -0.14 0.00 -1.04 0.00 0.00 56.93 55.45 1mm4 s PHE 75 Cb -0.05 -1.12 -0.04 0.00 -1.21 0.00 0.00 43.02 40.60 1mm4 s PHE 75 CO -0.13 -0.03 0.34 0.21 -1.34 0.00 0.00 175.22 174.27 1mm4 s LYS 76 N -0.47 4.10 0.59 1.99 2.20 -1.26 -0.86 119.74 126.04 1mm4 s LYS 76 Ca 0.07 0.05 -0.20 0.00 -0.36 0.00 0.00 55.97 55.54 1mm4 s LYS 76 Cb -0.08 -3.57 -0.03 0.00 -1.51 0.00 0.00 37.83 32.64 1mm4 s LYS 76 CO -0.01 -0.09 1.30 -3.47 -0.36 0.00 0.00 175.35 172.72 1mm4 n ASP 77 N 4.70 2.28 0.30 1.43 2.03 -0.49 -4.88 116.55 121.93 1mm4 n ASP 77 Ca -0.10 0.90 0.20 0.00 0.52 0.00 0.00 54.79 56.31 1mm4 n ASP 77 Cb 0.51 -1.55 0.95 0.00 -0.72 0.00 0.00 41.12 40.31 1mm4 n ASP 77 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 1mm4 h SER 78 N 0.98 0.00 -0.10 1.67 0.02 -1.97 -3.21 113.55 110.94 1mm4 h SER 78 Ca -0.51 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.27 1mm4 h SER 78 Cb 1.32 0.00 -0.25 0.00 0.14 0.00 0.00 62.40 63.61 1mm4 h SER 78 CO 0.55 0.00 -0.64 1.87 -1.14 0.00 0.00 176.83 177.47 1mm4 n TRP 79 N -3.05 -0.30 -2.52 3.45 -0.00 -1.26 -5.12 117.44 108.64 1mm4 n TRP 79 Ca -0.01 -1.21 0.00 0.00 -0.00 0.00 0.00 57.50 56.28 1mm4 n TRP 79 Cb 0.18 0.49 0.00 0.00 -0.00 0.00 0.00 31.31 31.98 1mm4 n TRP 79 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1mm4 n ASN 80 N -0.46 0.00 -3.34 5.87 2.85 -1.21 -5.18 115.26 113.78 1mm4 n ASN 80 Ca -0.10 -0.38 -0.19 0.00 -0.11 0.00 0.00 54.58 53.80 1mm4 n ASN 80 Cb 0.87 0.00 0.13 0.00 1.24 0.00 0.00 39.78 42.02 1mm4 n ASN 80 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 1mm4 n LYS 81 N 0.00 -0.68 -4.01 1.20 2.85 -1.26 -3.96 118.16 112.29 1mm4 n LYS 81 Ca 0.00 -1.45 -0.36 0.00 -1.05 0.00 0.00 58.31 55.45 1mm4 n LYS 81 Cb 0.00 -0.82 -0.08 0.00 -0.65 0.00 0.00 35.03 33.48 1mm4 n LYS 81 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 177.40 179.02 1mm4 s TRP 82 N -2.75 3.41 -0.21 5.58 1.48 -1.26 -1.39 118.94 123.80 1mm4 s TRP 82 Ca 0.49 0.35 -0.15 0.00 -1.06 0.00 0.00 56.10 55.73 1mm4 s TRP 82 Cb -0.02 -1.95 -0.04 0.00 -1.16 0.00 0.00 33.47 30.31 1mm4 s TRP 82 CO 0.34 0.53 0.37 -1.21 -4.06 0.00 0.00 176.95 172.92 1mm4 s GLU 83 N -0.62 4.15 0.51 3.25 0.41 -0.04 -4.91 118.70 121.45 1mm4 s GLU 83 Ca 0.12 0.14 -0.13 0.00 -0.41 0.00 0.00 54.97 54.69 1mm4 s GLU 83 Cb -0.12 -3.54 -0.06 0.00 -1.78 0.00 0.00 34.13 28.63 1mm4 s GLU 83 CO 0.02 -0.04 0.92 -1.25 -0.49 0.00 0.00 175.26 174.43 1mm4 s PRO 84 N 1.32 3.79 -0.24 0.39 0.04 -1.26 -2.62 135.00 136.41 1mm4 s PRO 84 Ca 0.17 0.71 -0.10 0.00 0.04 0.00 0.00 61.00 61.83 1mm4 s PRO 84 Cb -0.15 -2.21 0.10 0.00 0.04 0.00 0.00 34.50 32.28 1mm4 s PRO 84 CO 0.08 -0.27 0.54 0.96 0.04 0.00 0.00 177.00 178.35 1mm4 s ILE 85 N -2.70 -0.60 0.16 0.56 -4.36 -0.55 -4.28 121.20 109.43 1mm4 s ILE 85 Ca 0.55 0.07 0.07 0.00 -0.26 0.00 0.00 60.65 61.08 1mm4 s ILE 85 Cb -0.10 -0.83 -0.04 0.00 1.25 0.00 0.00 42.46 42.74 1mm4 s ILE 85 CO 0.38 0.03 0.01 0.00 0.24 0.00 0.00 174.94 175.60 1mm4 s ALA 86 N 2.42 3.25 -0.28 2.27 0.00 -1.06 -0.39 121.76 127.98 1mm4 s ALA 86 Ca -0.05 -1.31 -0.21 0.00 0.00 0.00 0.00 51.96 50.38 1mm4 s ALA 86 Cb -0.11 -1.06 0.09 0.00 0.00 0.00 0.00 23.12 22.04 1mm4 s ALA 86 CO -0.16 0.52 0.77 0.20 0.00 0.00 0.00 175.76 177.08 1mm4 s GLY 87 N -2.87 -0.48 0.00 0.00 0.00 -0.31 -2.16 107.32 101.50 1mm4 s GLY 87 Ca 0.27 2.32 -0.03 0.00 0.00 0.00 0.00 44.72 47.28 1mm4 s GLY 87 CO 0.19 2.04 0.06 -2.52 0.00 0.00 0.00 173.10 172.86 1mm4 s TYR 88 N 0.84 0.09 0.00 1.90 1.13 -0.57 -1.14 117.35 119.60 1mm4 s TYR 88 Ca -0.03 -0.19 0.00 0.00 -1.41 0.00 0.00 57.07 55.44 1mm4 s TYR 88 Cb -0.05 -0.08 0.00 0.00 -1.10 0.00 0.00 41.96 40.73 1mm4 s TYR 88 CO -0.08 -0.18 0.00 0.41 -2.51 0.00 0.00 175.55 173.19 1mm4 n GLY 89 N 1.96 2.19 3.31 5.49 0.00 -0.95 -0.77 105.19 116.41 1mm4 n GLY 89 Ca -0.20 -0.90 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 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 -6.24 2.64 0.08 1.61 1.48 -0.85 -1.86 118.94 115.79 1mm4 s TRP 90 Ca 0.00 -0.76 0.05 0.00 -1.06 0.00 0.00 56.10 54.33 1mm4 s TRP 90 Cb 0.00 -1.73 -0.03 0.00 -1.16 0.00 0.00 33.47 30.55 1mm4 s TRP 90 CO 0.00 -0.25 -0.14 -2.00 -4.06 0.00 0.00 176.95 170.50 1mm4 s GLU 91 N 0.15 0.85 -0.16 3.25 2.12 -0.55 -1.70 118.70 122.65 1mm4 s GLU 91 Ca -0.10 -1.00 -0.05 0.00 0.36 0.00 0.00 54.97 54.17 1mm4 s GLU 91 Cb -0.16 -0.82 -0.03 0.00 0.26 0.00 0.00 34.13 33.38 1mm4 s GLU 91 CO 0.06 0.18 0.01 -1.12 -0.54 0.00 0.00 175.26 173.84 1mm4 s SER 92 N -1.87 5.19 0.17 -1.70 0.01 -0.44 -1.69 113.70 113.36 1mm4 s SER 92 Ca -0.00 -0.02 -0.15 0.00 1.31 0.00 0.00 55.95 57.09 1mm4 s SER 92 Cb -0.09 -1.85 -0.07 0.00 0.21 0.00 0.00 66.02 64.22 1mm4 s SER 92 CO 0.02 0.18 0.58 0.28 0.41 0.00 0.00 173.24 174.72 1mm4 s THR 93 N 0.29 4.81 -0.23 1.44 -1.32 -1.26 -2.59 115.64 116.78 1mm4 s THR 93 Ca -0.00 0.89 -0.03 0.00 -1.21 0.00 0.00 61.69 61.34 1mm4 s THR 93 Cb -0.13 -3.75 0.11 0.00 -1.51 0.00 0.00 72.50 67.22 1mm4 s THR 93 CO 0.02 0.21 0.26 0.86 -2.21 0.00 0.00 174.62 173.76 1mm4 s TRP 94 N -1.50 -0.38 -0.22 9.09 -0.00 -0.46 -4.99 118.94 120.48 1mm4 s TRP 94 Ca 0.39 0.22 -0.04 0.00 -0.00 0.00 0.00 56.10 56.68 1mm4 s TRP 94 Cb -0.15 -0.33 -0.01 0.00 -0.00 0.00 0.00 33.47 32.98 1mm4 s TRP 94 CO 0.19 -0.69 -0.04 0.50 -0.00 0.00 0.00 176.95 176.92 1mm4 s ARG 95 N 2.36 3.41 0.00 5.86 3.52 -1.26 -2.04 118.95 130.80 1mm4 s ARG 95 Ca 0.08 -0.61 0.00 0.00 -0.13 0.00 0.00 55.73 55.07 1mm4 s ARG 95 Cb -0.15 -3.01 0.00 0.00 -1.56 0.00 0.00 34.95 30.23 1mm4 s ARG 95 CO -0.17 -0.16 0.00 -2.30 -0.81 0.00 0.00 175.30 171.86 1mm4 n PRO 96 N 4.69 -0.87 -0.11 5.12 -0.02 -1.26 -4.99 135.00 137.57 1mm4 n PRO 96 Ca -0.18 0.00 -0.23 0.00 -2.02 0.00 0.00 63.50 61.07 1mm4 n PRO 96 Cb 0.51 0.00 -0.11 0.00 -0.02 0.00 0.00 33.50 33.88 1mm4 n PRO 96 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1mm4 n LEU 97 N 0.00 1.87 -3.26 2.45 7.99 -1.26 -4.88 117.00 119.91 1mm4 n LEU 97 Ca 0.00 0.41 -0.10 0.00 -0.01 0.00 0.00 56.01 56.32 1mm4 n LEU 97 Cb 0.00 -0.95 -0.05 0.00 -0.11 0.00 0.00 43.42 42.32 1mm4 n LEU 97 CO 0.00 0.31 -0.05 0.00 -1.51 0.00 0.00 177.39 176.14 1mm4 s ALA 98 N -2.39 -1.21 -0.35 -1.18 0.00 -1.26 -4.99 121.76 110.38 1mm4 s ALA 98 Ca -0.30 -0.56 0.15 0.00 0.00 0.00 0.00 51.96 51.25 1mm4 s ALA 98 Cb 0.07 -2.35 0.44 0.00 0.00 0.00 0.00 23.12 21.28 1mm4 s ALA 98 CO 0.57 -2.18 1.08 -0.25 0.00 0.00 0.00 175.76 174.99 1mm4 n ASP 99 N 4.15 0.35 -2.48 0.00 9.92 -1.26 -4.95 116.55 122.27 1mm4 n ASP 99 Ca 0.12 -2.64 -0.20 0.00 -0.53 0.00 0.00 54.79 51.54 1mm4 n ASP 99 Cb 0.50 -0.03 0.01 0.00 -0.64 0.00 0.00 41.12 40.96 1mm4 n ASP 99 CO 0.00 0.00 0.00 -0.62 0.13 0.00 0.00 177.20 176.71 1mm4 n GLU 100 N -0.23 -2.64 -2.86 -1.24 1.02 -1.26 -3.61 120.64 109.82 1mm4 n GLU 100 Ca 0.05 0.94 -0.07 0.00 -0.02 0.00 0.00 57.16 58.06 1mm4 n GLU 100 Cb 0.83 -5.61 0.01 0.00 -0.02 0.00 0.00 31.44 26.65 1mm4 n GLU 100 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1mm4 n ASN 101 N -1.99 -7.89 -4.83 1.62 2.85 -1.26 -4.71 115.26 99.04 1mm4 n ASN 101 Ca -0.19 0.48 -0.37 0.00 -0.11 0.00 0.00 54.58 54.38 1mm4 n ASN 101 Cb 0.66 -5.36 -0.06 0.00 1.24 0.00 0.00 39.78 36.26 1mm4 n ASN 101 CO 0.00 0.00 0.00 0.12 -2.11 0.00 0.00 177.26 175.27 1mm4 s PHE 102 N -2.63 3.71 -0.19 1.20 2.19 -1.24 -4.07 117.98 116.95 1mm4 s PHE 102 Ca 0.22 1.12 -0.02 0.00 0.33 0.00 0.00 56.93 58.59 1mm4 s PHE 102 Cb -0.06 -2.39 -0.00 0.00 -1.31 0.00 0.00 43.02 39.25 1mm4 s PHE 102 CO 0.76 0.54 -0.10 -1.58 1.83 0.00 0.00 175.22 176.67 1mm4 s HIS 103 N -1.24 2.88 -0.02 10.12 5.65 -0.37 -4.17 115.29 128.14 1mm4 s HIS 103 Ca 0.31 -0.98 0.07 0.00 0.25 0.00 0.00 55.06 54.71 1mm4 s HIS 103 Cb -0.17 -2.00 -0.02 0.00 -1.18 0.00 0.00 32.58 29.22 1mm4 s HIS 103 CO 0.18 -0.50 -0.22 -1.17 -0.65 0.00 0.00 174.74 172.38 1mm4 s LEU 104 N 1.12 2.04 -0.04 8.88 0.20 -0.86 -2.13 118.68 127.89 1mm4 s LEU 104 Ca 0.01 -0.41 -0.05 0.00 0.69 0.00 0.00 54.13 54.37 1mm4 s LEU 104 Cb -0.14 -1.15 0.01 0.00 -0.43 0.00 0.00 46.19 44.47 1mm4 s LEU 104 CO -0.03 0.27 0.13 -0.83 -0.29 0.00 0.00 176.35 175.60 1mm4 s GLY 105 N -0.50 -0.05 -0.26 7.98 0.00 0.20 -1.35 107.32 113.34 1mm4 s GLY 105 Ca 0.08 0.22 -0.12 0.00 0.00 0.00 0.00 44.72 44.91 1mm4 s GLY 105 CO -0.01 0.15 0.59 -2.27 0.00 0.00 0.00 173.10 171.57 1mm4 s LEU 106 N -0.31 -0.84 0.00 0.66 2.96 -1.07 -2.07 118.68 118.01 1mm4 s LEU 106 Ca -0.04 1.36 0.00 0.00 -0.22 0.00 0.00 54.13 55.23 1mm4 s LEU 106 Cb -0.03 2.04 0.00 0.00 0.50 0.00 0.00 46.19 48.70 1mm4 s LEU 106 CO 0.00 -0.22 0.00 0.61 -1.32 0.00 0.00 176.35 175.42 1mm4 n GLY 107 N 4.86 1.09 3.53 7.98 0.00 -1.03 -1.33 105.19 120.29 1mm4 n GLY 107 Ca -0.16 -0.68 -0.24 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.55 2.42 -0.02 1.61 0.40 -0.69 -1.59 117.98 117.55 1mm4 s PHE 108 Ca 0.00 -0.31 0.01 0.00 -0.60 0.00 0.00 56.93 56.03 1mm4 s PHE 108 Cb 0.00 -1.08 0.02 0.00 0.51 0.00 0.00 43.02 42.46 1mm4 s PHE 108 CO 0.00 0.68 -0.01 0.99 0.70 0.00 0.00 175.22 177.57 1mm4 s THR 109 N -2.46 0.22 -0.04 0.64 2.01 -0.66 -2.02 115.64 113.33 1mm4 s THR 109 Ca 0.31 -0.01 -0.03 0.00 0.31 0.00 0.00 61.69 62.26 1mm4 s THR 109 Cb -0.05 -0.26 0.01 0.00 0.01 0.00 0.00 72.50 72.21 1mm4 s THR 109 CO 0.17 0.12 0.10 0.00 -0.69 0.00 0.00 174.62 174.32 1mm4 s ALA 110 N 0.59 -0.25 0.00 7.40 0.00 0.05 -1.19 121.76 128.37 1mm4 s ALA 110 Ca -0.06 0.30 0.00 0.00 0.00 0.00 0.00 51.96 52.20 1mm4 s ALA 110 Cb -0.09 -0.18 0.00 0.00 0.00 0.00 0.00 23.12 22.85 1mm4 s ALA 110 CO -0.01 -0.05 0.00 0.41 0.00 0.00 0.00 175.76 176.11 1mm4 n GLY 111 N 3.09 2.42 3.01 0.00 0.00 -0.82 -1.51 105.19 111.39 1mm4 n GLY 111 Ca -0.13 -0.08 -0.21 0.00 0.00 0.00 0.00 46.02 45.60 1mm4 n GLY 111 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1mm4 s VAL 112 N 0.28 0.83 0.05 1.61 -7.23 -0.92 -2.58 120.40 112.44 1mm4 s VAL 112 Ca 0.00 -0.39 0.03 0.00 -1.81 0.00 0.00 61.98 59.81 1mm4 s VAL 112 Cb 0.00 -0.73 -0.02 0.00 0.56 0.00 0.00 36.38 36.18 1mm4 s VAL 112 CO 0.00 0.26 -0.10 0.28 -0.31 0.00 0.00 175.10 175.23 1mm4 s THR 113 N 0.16 0.73 -0.29 5.32 -1.32 -0.68 -2.57 115.64 116.98 1mm4 s THR 113 Ca -0.03 -1.10 -0.12 0.00 -1.21 0.00 0.00 61.69 59.23 1mm4 s THR 113 Cb -0.08 -0.75 -0.04 0.00 -1.51 0.00 0.00 72.50 70.12 1mm4 s THR 113 CO 0.01 -0.29 0.24 0.00 -2.21 0.00 0.00 174.62 172.36 1mm4 s ALA 114 N -1.26 3.53 -0.35 11.08 0.00 -1.26 -1.38 121.76 132.12 1mm4 s ALA 114 Ca -0.07 -1.10 0.04 0.00 0.00 0.00 0.00 51.96 50.84 1mm4 s ALA 114 Cb -0.09 -2.57 0.17 0.00 0.00 0.00 0.00 23.12 20.62 1mm4 s ALA 114 CO 0.01 -0.67 0.47 1.03 0.00 0.00 0.00 175.76 176.60 1mm4 s ARG 115 N 1.82 0.61 0.20 0.00 1.81 -1.26 -5.04 118.95 117.09 1mm4 s ARG 115 Ca 0.08 -0.31 -0.17 0.00 -1.72 0.00 0.00 55.73 53.62 1mm4 s ARG 115 Cb -0.16 -0.31 0.06 0.00 -0.45 0.00 0.00 34.95 34.09 1mm4 s ARG 115 CO 0.11 -1.14 0.84 -0.25 -0.68 0.00 0.00 175.30 174.18 1mm4 n ASP 116 N 4.71 -1.60 -4.14 0.23 8.00 -1.26 -5.01 116.55 117.47 1mm4 n ASP 116 Ca 0.07 -1.92 -0.35 0.00 0.71 0.00 0.00 54.79 53.30 1mm4 n ASP 116 Cb 0.50 2.62 -0.13 0.00 -0.02 0.00 0.00 41.12 44.10 1mm4 n ASP 116 CO 0.00 0.00 0.00 0.20 -0.39 0.00 0.00 177.20 177.01 1mm4 s ASN 117 N -3.02 5.07 -1.63 -2.24 0.01 -1.26 -4.64 114.94 107.24 1mm4 s ASN 117 Ca 0.18 -1.68 -0.03 0.00 -0.71 0.00 0.00 52.86 50.62 1mm4 s ASN 117 Cb -0.03 -1.77 0.00 0.00 0.41 0.00 0.00 41.25 39.87 1mm4 s ASN 117 CO 0.06 -0.40 0.41 1.87 -1.51 0.00 0.00 177.10 177.53 1mm4 n TRP 118 N 4.59 -1.64 -3.61 2.20 -0.00 -1.26 -4.98 117.44 112.74 1mm4 n TRP 118 Ca -0.07 0.35 -0.26 0.00 -0.00 0.00 0.00 57.50 57.53 1mm4 n TRP 118 Cb 0.42 -4.33 -0.17 0.00 -0.00 0.00 0.00 31.31 27.24 1mm4 n TRP 118 CO 0.00 0.00 0.00 -0.80 -0.00 0.00 0.00 177.69 176.89 1mm4 s ASN 119 N -2.50 2.26 -1.18 5.87 -0.87 -1.26 -5.07 114.94 112.19 1mm4 s ASN 119 Ca 0.20 -0.57 -0.16 0.00 -1.57 0.00 0.00 52.86 50.77 1mm4 s ASN 119 Cb -0.09 -0.22 0.14 0.00 -0.02 0.00 0.00 41.25 41.06 1mm4 s ASN 119 CO 0.25 -0.34 1.44 -0.47 -2.57 0.00 0.00 177.10 175.41 1mm4 s TYR 120 N 2.14 3.28 -0.36 2.20 5.04 -1.26 -4.58 117.35 123.81 1mm4 s TYR 120 Ca 0.02 -1.89 -0.00 0.00 -2.44 0.00 0.00 57.07 52.76 1mm4 s TYR 120 Cb -0.16 -4.40 0.13 0.00 0.35 0.00 0.00 41.96 37.88 1mm4 s TYR 120 CO -0.09 -1.50 0.19 -1.50 -1.34 0.00 0.00 175.55 171.31 1mm4 s ILE 121 N 2.33 0.55 -0.10 3.14 2.07 -1.26 -5.11 121.20 122.82 1mm4 s ILE 121 Ca 0.43 -1.75 -0.37 0.00 -1.41 0.00 0.00 60.65 57.56 1mm4 s ILE 121 Cb -0.02 -1.41 -0.14 0.00 0.13 0.00 0.00 42.46 41.02 1mm4 s ILE 121 CO -0.00 -0.88 1.73 -2.65 -1.91 0.00 0.00 174.94 171.23 1mm4 n PRO 122 N 4.21 1.69 -4.15 3.50 -0.02 -1.26 -4.75 135.00 134.22 1mm4 n PRO 122 Ca 0.06 0.62 -0.36 0.00 -2.02 0.00 0.00 63.50 61.81 1mm4 n PRO 122 Cb 0.38 -2.37 -0.08 0.00 -0.02 0.00 0.00 33.50 31.40 1mm4 n PRO 122 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1mm4 s LEU 123 N 3.07 3.94 0.18 2.45 0.20 -0.48 -4.86 118.68 123.18 1mm4 s LEU 123 Ca 0.92 0.28 -0.30 0.00 0.69 0.00 0.00 54.13 55.72 1mm4 s LEU 123 Cb -0.85 -1.95 -0.08 0.00 -0.43 0.00 0.00 46.19 42.88 1mm4 s LEU 123 CO 0.54 0.39 1.21 -2.16 -0.29 0.00 0.00 176.35 176.04 1mm4 s PRO 124 N -0.99 4.48 -0.01 0.98 0.04 -1.26 -1.69 135.00 136.55 1mm4 s PRO 124 Ca 0.15 1.88 0.01 0.00 0.04 0.00 0.00 61.00 63.08 1mm4 s PRO 124 Cb -0.12 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.18 1mm4 s PRO 124 CO 0.04 -0.11 -0.03 0.54 0.04 0.00 0.00 177.00 177.47 1mm4 s VAL 125 N 0.05 0.27 -0.07 -0.36 0.11 -1.07 -4.96 120.40 114.37 1mm4 s VAL 125 Ca 0.54 -0.10 -0.01 0.00 -2.93 0.00 0.00 61.98 59.47 1mm4 s VAL 125 Cb -0.33 -0.26 0.03 0.00 -1.53 0.00 0.00 36.38 34.29 1mm4 s VAL 125 CO 0.36 0.10 0.00 -0.22 -3.33 0.00 0.00 175.10 172.01 1mm4 s LEU 126 N 0.20 0.60 -0.02 2.54 0.20 -1.26 -1.94 118.68 119.00 1mm4 s LEU 126 Ca -0.02 -0.08 -0.08 0.00 0.69 0.00 0.00 54.13 54.64 1mm4 s LEU 126 Cb -0.05 -0.43 0.01 0.00 -0.43 0.00 0.00 46.19 45.29 1mm4 s LEU 126 CO -0.00 -0.19 0.18 -1.48 -0.29 0.00 0.00 176.35 174.56 1mm4 s LEU 127 N 1.94 1.37 0.69 -0.68 0.05 -0.33 -4.93 118.68 116.80 1mm4 s LEU 127 Ca 0.04 -0.02 -0.12 0.00 0.05 0.00 0.00 54.13 54.08 1mm4 s LEU 127 Cb -0.12 0.77 0.01 0.00 -2.05 0.00 0.00 46.19 44.80 1mm4 s LEU 127 CO -0.05 -0.31 1.08 -2.16 -0.55 0.00 0.00 176.35 174.35 1mm4 s PRO 128 N -1.03 2.78 0.27 1.48 0.04 -1.24 -1.65 135.00 135.64 1mm4 s PRO 128 Ca -0.11 1.14 -0.11 0.00 0.04 0.00 0.00 61.00 61.97 1mm4 s PRO 128 Cb -0.06 -1.96 -0.00 0.00 0.04 0.00 0.00 34.50 32.52 1mm4 s PRO 128 CO 0.02 -1.24 0.48 -0.48 0.04 0.00 0.00 177.00 175.82 1mm4 s LEU 129 N -5.34 0.45 -0.15 -3.56 -0.00 -0.62 -2.59 118.68 106.87 1mm4 s LEU 129 Ca 0.62 -1.05 -0.30 0.00 -0.00 0.00 0.00 54.13 53.39 1mm4 s LEU 129 Cb -0.16 1.71 0.13 0.00 -0.00 0.00 0.00 46.19 47.87 1mm4 s LEU 129 CO 0.49 -1.18 1.04 0.00 -0.00 0.00 0.00 176.35 176.71 1mm4 s ALA 130 N -3.78 -1.95 -0.05 1.48 0.00 -0.76 -2.47 121.76 114.24 1mm4 s ALA 130 Ca 0.24 1.51 -0.02 0.00 0.00 0.00 0.00 51.96 53.69 1mm4 s ALA 130 Cb -0.00 -0.50 0.03 0.00 0.00 0.00 0.00 23.12 22.65 1mm4 s ALA 130 CO 0.11 -0.41 0.08 0.45 0.00 0.00 0.00 175.76 175.99 1mm4 s SER 131 N -1.51 0.71 -0.03 0.00 0.15 -0.88 -0.49 113.70 111.65 1mm4 s SER 131 Ca 0.02 0.14 0.02 0.00 0.70 0.00 0.00 55.95 56.83 1mm4 s SER 131 Cb -0.01 -0.02 0.01 0.00 -1.71 0.00 0.00 66.02 64.29 1mm4 s SER 131 CO -0.02 -0.21 -0.08 0.68 1.20 0.00 0.00 173.24 174.80 1mm4 s VAL 132 N 1.85 0.72 -2.96 4.45 -7.23 0.19 -0.62 120.40 116.81 1mm4 s VAL 132 Ca 0.00 -0.31 0.00 0.00 -1.81 0.00 0.00 61.98 59.86 1mm4 s VAL 132 Cb -0.12 -0.66 0.00 0.00 0.56 0.00 0.00 36.38 36.16 1mm4 s VAL 132 CO -0.04 0.24 0.00 0.61 -0.31 0.00 0.00 175.10 175.60 1mm4 n GLY 133 N 3.42 -0.55 2.95 2.32 0.00 -0.91 -0.44 105.19 111.99 1mm4 n GLY 133 Ca -0.19 -0.81 -0.11 0.00 0.00 0.00 0.00 46.02 44.92 1mm4 n GLY 133 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mm4 s TYR 134 N -3.29 0.10 0.00 1.61 1.13 -0.46 -1.24 117.35 115.21 1mm4 s TYR 134 Ca 0.00 -0.21 0.00 0.00 -1.41 0.00 0.00 57.07 55.45 1mm4 s TYR 134 Cb 0.00 -0.08 0.00 0.00 -1.10 0.00 0.00 41.96 40.78 1mm4 s TYR 134 CO 0.00 -0.12 0.00 0.41 -2.51 0.00 0.00 175.55 173.33 1mm4 n GLY 135 N 2.26 1.43 0.16 5.49 0.00 -1.26 -2.24 105.19 111.03 1mm4 n GLY 135 Ca -0.18 -0.54 0.13 0.00 0.00 0.00 0.00 46.02 45.43 1mm4 n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mm4 h PRO 136 N 0.00 0.00 -5.02 1.61 0.13 -1.96 -3.41 132.00 123.35 1mm4 h PRO 136 Ca 0.00 0.00 -0.68 0.00 -0.87 0.00 0.00 66.00 64.45 1mm4 h PRO 136 Cb 0.00 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 30.95 1mm4 h PRO 136 CO 0.00 0.00 -0.13 0.08 -0.23 0.00 0.00 178.00 177.72 1mm4 s VAL 137 N -3.40 5.04 -0.03 1.56 1.01 -0.95 -3.46 120.40 120.16 1mm4 s VAL 137 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1mm4 s VAL 137 Cb 0.09 -4.04 0.03 0.00 0.00 0.00 0.00 36.38 32.45 1mm4 s VAL 137 CO 0.40 -0.41 0.01 -0.89 0.00 0.00 0.00 175.10 174.21 1mm4 s THR 138 N 2.29 0.13 -0.23 3.92 2.01 -1.07 -1.35 115.64 121.34 1mm4 s THR 138 Ca 0.15 0.12 -0.27 0.00 0.31 0.00 0.00 61.69 62.00 1mm4 s THR 138 Cb -0.16 -0.24 0.00 0.00 0.01 0.00 0.00 72.50 72.11 1mm4 s THR 138 CO 0.14 0.14 0.94 -0.36 -0.69 0.00 0.00 174.62 174.80 1mm4 s PHE 139 N 1.11 3.33 -0.28 4.92 0.40 0.42 -1.32 117.98 126.56 1mm4 s PHE 139 Ca -0.09 1.32 -0.08 0.00 -0.60 0.00 0.00 56.93 57.48 1mm4 s PHE 139 Cb -0.13 -3.17 -0.02 0.00 0.51 0.00 0.00 43.02 40.21 1mm4 s PHE 139 CO -0.02 -0.44 0.11 -1.14 0.70 0.00 0.00 175.22 174.44 1mm4 s GLN 140 N 3.00 3.51 -0.18 0.44 -0.44 0.23 -0.63 119.66 125.59 1mm4 s GLN 140 Ca 0.40 -0.59 -0.03 0.00 -2.50 0.00 0.00 55.36 52.64 1mm4 s GLN 140 Cb -0.15 -3.45 -0.02 0.00 -1.64 0.00 0.00 33.01 27.75 1mm4 s GLN 140 CO 0.07 -0.30 -0.05 0.00 0.50 0.00 0.00 175.29 175.51 1mm4 s MET 141 N 1.62 3.50 0.06 1.67 0.23 0.36 -0.78 119.30 125.96 1mm4 s MET 141 Ca 0.05 -0.59 0.09 0.00 -1.03 0.00 0.00 55.69 54.21 1mm4 s MET 141 Cb -0.16 -2.91 -0.03 0.00 -1.53 0.00 0.00 34.83 30.20 1mm4 s MET 141 CO 0.05 0.05 -0.22 0.99 -2.03 0.00 0.00 175.02 173.86 1mm4 s THR 142 N 0.84 2.51 -0.07 3.16 2.01 -0.64 -1.82 115.64 121.63 1mm4 s THR 142 Ca -0.01 -1.36 0.05 0.00 0.31 0.00 0.00 61.69 60.67 1mm4 s THR 142 Cb -0.15 -2.05 -0.00 0.00 0.01 0.00 0.00 72.50 70.31 1mm4 s THR 142 CO 0.01 0.29 -0.22 -0.47 -0.69 0.00 0.00 174.62 173.54 1mm4 s TYR 143 N -0.93 2.29 -0.35 4.92 6.14 -1.07 -2.21 117.35 126.14 1mm4 s TYR 143 Ca 0.14 -0.81 0.03 0.00 0.64 0.00 0.00 57.07 57.07 1mm4 s TYR 143 Cb -0.10 -1.53 0.10 0.00 0.42 0.00 0.00 41.96 40.85 1mm4 s TYR 143 CO 0.05 -0.30 0.07 0.96 0.64 0.00 0.00 175.55 176.97 1mm4 s ILE 144 N 0.17 2.42 0.94 3.14 -4.36 -1.26 -3.71 121.20 118.53 1mm4 s ILE 144 Ca -0.11 -2.32 -0.12 0.00 -0.26 0.00 0.00 60.65 57.84 1mm4 s ILE 144 Cb -0.15 -2.77 0.15 0.00 1.25 0.00 0.00 42.46 40.94 1mm4 s ILE 144 CO 0.06 -0.61 1.10 -2.16 0.24 0.00 0.00 174.94 173.56 1mm4 s PRO 145 N 0.92 0.94 0.00 0.37 0.04 -1.26 -4.78 135.00 131.24 1mm4 s PRO 145 Ca 0.11 0.59 0.00 0.00 0.04 0.00 0.00 61.00 61.74 1mm4 s PRO 145 Cb -0.20 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1mm4 s PRO 145 CO -0.07 -2.40 0.00 0.41 0.04 0.00 0.00 177.00 174.98 1mm4 n GLY 146 N -1.35 0.85 3.55 0.56 0.00 -1.26 -5.12 105.19 102.43 1mm4 n GLY 146 Ca 0.06 -0.21 -0.29 0.00 0.00 0.00 0.00 46.02 45.58 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 0.00 0.14 2.61 -2.24 -1.26 -4.97 114.28 108.56 1mm4 n THR 147 Ca 0.00 -0.27 -0.05 0.00 -2.27 0.00 0.00 64.05 61.46 1mm4 n THR 147 Cb 0.00 -1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 67.20 1mm4 n THR 147 CO 0.00 0.00 0.00 1.88 -0.57 0.00 0.00 175.07 176.38 1mm4 h TYR 148 N -2.38 -0.32 -3.58 4.78 -1.99 -2.01 -3.49 116.97 107.98 1mm4 h TYR 148 Ca -0.54 -0.01 0.36 0.00 2.00 0.00 0.00 58.73 60.54 1mm4 h TYR 148 Cb 1.31 0.11 -0.20 0.00 2.00 0.00 0.00 36.73 39.95 1mm4 h TYR 148 CO 0.36 -0.20 -1.30 0.09 -0.00 0.00 0.00 178.16 177.11 1mm4 n ASN 149 N -2.93 -8.03 -1.91 3.88 3.02 -1.26 -4.63 115.26 103.40 1mm4 n ASN 149 Ca -0.04 1.49 -0.22 0.00 -0.03 0.00 0.00 54.58 55.77 1mm4 n ASN 149 Cb 0.14 -5.07 0.12 0.00 -0.61 0.00 0.00 39.78 34.35 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 -4.39 4.90 -2.14 6.41 3.02 -1.26 -4.89 115.26 116.91 1mm4 n ASN 150 Ca -0.10 -3.75 -0.14 0.00 -0.03 0.00 0.00 54.58 50.55 1mm4 n ASN 150 Cb 0.70 -0.72 0.03 0.00 -0.61 0.00 0.00 39.78 39.19 1mm4 n ASN 150 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mm4 n GLY 151 N -0.97 -0.05 2.66 7.41 0.00 -1.26 -4.94 105.19 108.03 1mm4 n GLY 151 Ca 0.50 -0.17 -0.08 0.00 0.00 0.00 0.00 46.02 46.27 1mm4 n GLY 151 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1mm4 n ASN 152 N -1.08 2.11 -4.01 1.61 3.02 -1.26 -5.03 115.26 110.63 1mm4 n ASN 152 Ca -0.05 -2.59 -0.31 0.00 -0.03 0.00 0.00 54.58 51.60 1mm4 n ASN 152 Cb 0.56 -0.48 -0.15 0.00 -0.61 0.00 0.00 39.78 39.10 1mm4 n ASN 152 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1mm4 s VAL 153 N -3.77 2.13 -0.01 2.41 -7.23 -1.26 -5.09 120.40 107.58 1mm4 s VAL 153 Ca 0.31 -2.09 0.01 0.00 -1.81 0.00 0.00 61.98 58.40 1mm4 s VAL 153 Cb 0.39 -2.50 0.01 0.00 0.56 0.00 0.00 36.38 34.84 1mm4 s VAL 153 CO -0.01 -0.46 -0.02 -0.72 -0.31 0.00 0.00 175.10 173.58 1mm4 s TYR 154 N 1.01 0.24 -0.21 2.82 -0.85 -1.26 -4.74 117.35 114.36 1mm4 s TYR 154 Ca 0.06 -0.03 -0.04 0.00 -0.52 0.00 0.00 57.07 56.54 1mm4 s TYR 154 Cb -0.19 -0.21 -0.01 0.00 0.38 0.00 0.00 41.96 41.92 1mm4 s TYR 154 CO -0.08 -0.04 -0.03 0.12 -1.52 0.00 0.00 175.55 174.00 1mm4 s PHE 155 N 0.24 2.98 0.37 -3.49 2.19 -0.94 -5.01 117.98 114.32 1mm4 s PHE 155 Ca -0.02 -0.74 -0.05 0.00 0.33 0.00 0.00 56.93 56.44 1mm4 s PHE 155 Cb -0.04 -2.09 -0.05 0.00 -1.31 0.00 0.00 43.02 39.53 1mm4 s PHE 155 CO -0.01 -0.42 0.66 0.00 1.83 0.00 0.00 175.22 177.28 1mm4 s ALA 156 N 1.27 3.52 -0.24 11.12 0.00 -1.26 -1.62 121.76 134.55 1mm4 s ALA 156 Ca 0.03 -0.52 -0.20 0.00 0.00 0.00 0.00 51.96 51.27 1mm4 s ALA 156 Cb -0.14 -2.43 0.07 0.00 0.00 0.00 0.00 23.12 20.61 1mm4 s ALA 156 CO -0.01 -0.01 0.64 -0.46 0.00 0.00 0.00 175.76 175.92 1mm4 s TRP 157 N -2.35 -0.78 -0.27 0.00 -0.11 0.04 -4.84 118.94 110.62 1mm4 s TRP 157 Ca 0.46 1.79 -0.16 0.00 1.22 0.00 0.00 56.10 59.41 1mm4 s TRP 157 Cb -0.10 0.33 -0.03 0.00 -1.50 0.00 0.00 33.47 32.17 1mm4 s TRP 157 CO 0.35 -0.38 0.42 -1.64 -4.62 0.00 0.00 176.95 171.07 1mm4 s MET 158 N 0.72 4.01 -0.20 5.86 -1.94 -1.03 -0.60 119.30 126.12 1mm4 s MET 158 Ca -0.03 0.10 -0.10 0.00 -1.71 0.00 0.00 55.69 53.96 1mm4 s MET 158 Cb -0.05 -3.66 -0.05 0.00 2.01 0.00 0.00 34.83 33.08 1mm4 s MET 158 CO -0.05 -0.31 0.12 0.50 -0.01 0.00 0.00 175.02 175.27 1mm4 s ARG 159 N 2.14 4.14 0.05 2.03 3.52 -0.44 -2.54 118.95 127.85 1mm4 s ARG 159 Ca 0.17 -0.25 0.05 0.00 -0.13 0.00 0.00 55.73 55.57 1mm4 s ARG 159 Cb -0.16 -3.39 -0.02 0.00 -1.56 0.00 0.00 34.95 29.82 1mm4 s ARG 159 CO 0.10 0.28 -0.14 0.12 -0.81 0.00 0.00 175.30 174.85 1mm4 s PHE 160 N 0.40 1.20 -0.13 5.12 2.19 -0.79 -2.59 117.98 123.38 1mm4 s PHE 160 Ca 0.07 -0.38 -0.12 0.00 0.33 0.00 0.00 56.93 56.82 1mm4 s PHE 160 Cb -0.11 -0.70 -0.05 0.00 -1.31 0.00 0.00 43.02 40.85 1mm4 s PHE 160 CO -0.01 0.04 0.27 -1.14 1.83 0.00 0.00 175.22 176.20 1mm4 s GLN 161 N -1.31 4.05 0.19 10.12 0.74 -1.22 -2.30 119.66 129.92 1mm4 s GLN 161 Ca 0.00 0.08 0.06 0.00 0.05 0.00 0.00 55.36 55.54 1mm4 s GLN 161 Cb -0.08 -3.35 -0.05 0.00 1.10 0.00 0.00 33.01 30.63 1mm4 s GLN 161 CO 0.01 0.41 -0.10 0.12 -0.55 0.00 0.00 175.29 175.19 1mm4 s PHE 162 N -0.06 1.52 -0.03 1.67 5.36 -0.94 -4.99 117.98 120.51 1mm4 s PHE 162 Ca 0.17 -0.71 -0.22 0.00 -0.96 0.00 0.00 56.93 55.21 1mm4 s PHE 162 Cb -0.13 -0.77 0.04 0.00 -0.34 0.00 0.00 43.02 41.82 1mm4 s PHE 162 CO 0.05 0.18 0.47 -0.48 -1.46 0.00 0.00 175.22 173.98 1mm4 s LEU 163 N -3.26 0.21 -0.72 6.12 2.34 -1.26 -1.55 118.68 120.55 1mm4 s LEU 163 Ca 0.21 0.37 -0.04 0.00 0.06 0.00 0.00 54.13 54.73 1mm4 s LEU 163 Cb 0.02 1.80 0.19 0.00 -0.56 0.00 0.00 46.19 47.63 1mm4 s LEU 163 CO 0.05 -0.51 0.58 -1.61 -1.06 0.00 0.00 176.35 173.80 1mm4 s GLU 164 N -1.23 2.91 -0.29 1.48 8.01 -1.26 -5.01 118.70 123.30 1mm4 s GLU 164 Ca -0.12 -2.71 0.02 0.00 0.01 0.00 0.00 54.97 52.17 1mm4 s GLU 164 Cb -0.03 -3.90 0.08 0.00 -4.31 0.00 0.00 34.13 25.98 1mm4 s GLU 164 CO 0.07 -1.21 0.02 -1.01 0.01 0.00 0.00 175.26 173.13 1mm4 s HIS 165 N -0.35 2.84 0.00 1.61 3.76 -1.26 -4.80 115.29 117.09 1mm4 s HIS 165 Ca 0.20 -2.28 0.00 0.00 -0.15 0.00 0.00 55.06 52.82 1mm4 s HIS 165 Cb -0.16 -2.16 0.00 0.00 1.11 0.00 0.00 32.58 31.37 1mm4 s HIS 165 CO -0.06 -0.88 0.00 -2.39 -0.85 0.00 0.00 174.74 170.56 1mm4 n HIS 166 N 4.53 -0.15 -5.11 1.40 1.44 -1.26 -5.13 115.22 110.93 1mm4 n HIS 166 Ca -0.04 0.00 -0.32 0.00 -2.01 0.00 0.00 57.72 55.35 1mm4 n HIS 166 Cb 0.43 0.03 -0.15 0.00 0.12 0.00 0.00 29.99 30.41 1mm4 n HIS 166 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 1mm4 s HIS 167 N -1.20 2.53 -0.09 -1.40 4.02 -1.26 -5.11 115.29 112.78 1mm4 s HIS 167 Ca 0.00 -0.49 -0.03 0.00 1.02 0.00 0.00 55.06 55.56 1mm4 s HIS 167 Cb 0.00 -1.61 0.05 0.00 -1.02 0.00 0.00 32.58 29.99 1mm4 s HIS 167 CO 0.00 -0.06 0.11 -1.58 1.02 0.00 0.00 174.74 174.23 1mm4 s HIS 168 N -0.36 -0.03 -0.36 1.40 2.46 -1.26 -5.12 115.29 112.01 1mm4 s HIS 168 Ca 0.03 0.30 -0.08 0.00 0.47 0.00 0.00 55.06 55.77 1mm4 s HIS 168 Cb -0.12 -0.42 0.04 0.00 -0.13 0.00 0.00 32.58 31.95 1mm4 s HIS 168 CO 0.02 -0.30 0.17 -1.01 -2.47 0.00 0.00 174.74 171.15 1mm4 s HIS 169 N 2.22 3.27 -2.63 3.88 3.76 -1.26 -5.31 115.29 119.22 1mm4 s HIS 169 Ca 0.04 -1.29 0.21 0.00 -0.15 0.00 0.00 55.06 53.87 1mm4 s HIS 169 Cb -0.13 -2.45 0.17 0.00 1.11 0.00 0.00 32.58 31.28 1mm4 s HIS 169 CO -0.06 -0.72 1.17 0.72 -0.85 0.00 0.00 174.74 175.00