#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 3.64 0.65 7.83 0.01 -1.26 -5.00 114.94 120.81 1mm4 s ASN 2 Ca 0.00 -0.38 0.39 0.00 -0.71 0.00 0.00 52.86 52.16 1mm4 s ASN 2 Cb 0.00 -0.59 2.14 0.00 0.41 0.00 0.00 41.25 43.21 1mm4 s ASN 2 CO 0.00 0.30 2.26 0.00 -1.51 0.00 0.00 177.10 178.15 1mm4 h ALA 3 N 5.03 1.22 0.11 0.60 0.00 -2.05 0.48 119.26 124.65 1mm4 h ALA 3 Ca -0.46 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.44 1mm4 h ALA 3 Cb 1.14 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1mm4 h ALA 3 CO 0.48 -0.09 -0.05 0.22 0.00 0.00 0.00 179.25 179.81 1mm4 h ASP 4 N 0.00 -0.12 0.73 0.00 -0.00 -1.99 -2.59 116.42 112.44 1mm4 h ASP 4 Ca 0.01 -0.25 -0.07 0.00 -0.00 0.00 0.00 57.03 56.72 1mm4 h ASP 4 Cb 0.16 0.03 -0.01 0.00 -0.00 0.00 0.00 39.33 39.51 1mm4 h ASP 4 CO -0.00 0.47 -0.31 -0.33 -0.00 0.00 0.00 179.24 179.07 1mm4 h GLU 5 N -0.99 0.00 -0.23 0.28 3.07 -1.90 -2.55 114.58 112.26 1mm4 h GLU 5 Ca -0.01 0.00 -0.11 0.00 -0.50 0.00 0.00 59.36 58.74 1mm4 h GLU 5 Cb 0.36 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.27 1mm4 h GLU 5 CO 0.02 0.31 -0.29 2.35 -1.40 0.00 0.00 179.01 180.01 1mm4 h TRP 6 N 0.00 0.73 -0.33 4.33 7.01 -0.15 -2.88 115.95 124.67 1mm4 h TRP 6 Ca -0.00 -0.23 -0.13 0.00 2.11 0.00 0.00 58.89 60.64 1mm4 h TRP 6 Cb 0.76 -0.15 -0.01 0.00 -2.10 0.00 0.00 29.16 27.66 1mm4 h TRP 6 CO 0.00 0.96 -0.31 0.52 -2.79 0.00 0.00 178.44 176.81 1mm4 h MET 7 N 0.30 0.70 -0.97 2.65 2.86 -1.36 -2.85 114.93 116.26 1mm4 h MET 7 Ca 0.03 -0.32 0.02 0.00 -2.06 0.00 0.00 59.70 57.37 1mm4 h MET 7 Cb 0.86 -0.01 -0.05 0.00 0.06 0.00 0.00 31.60 32.46 1mm4 h MET 7 CO 0.07 0.92 0.64 1.15 1.06 0.00 0.00 176.91 180.76 1mm4 h THR 8 N 0.60 1.22 -0.04 2.22 2.02 -1.44 -1.72 112.91 115.76 1mm4 h THR 8 Ca 0.07 -0.44 -0.11 0.00 0.77 0.00 0.00 66.41 66.70 1mm4 h THR 8 Cb 0.83 -0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1mm4 h THR 8 CO 0.07 0.24 -0.48 0.71 0.37 0.00 0.00 175.52 176.43 1mm4 h THR 9 N 1.29 1.34 -0.67 3.16 1.35 -1.37 -2.98 112.91 115.03 1mm4 h THR 9 Ca 0.37 -1.66 -0.04 0.00 -0.55 0.00 0.00 66.41 64.53 1mm4 h THR 9 Cb -0.10 1.84 -0.03 0.00 -1.73 0.00 0.00 68.15 68.13 1mm4 h THR 9 CO -0.09 0.48 0.27 0.15 -0.25 0.00 0.00 175.52 176.08 1mm4 h PHE 10 N 0.08 0.99 -0.50 4.73 3.57 -1.09 -1.07 116.94 123.66 1mm4 h PHE 10 Ca 0.00 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.44 1mm4 h PHE 10 Cb 0.88 -0.30 -0.02 0.00 2.79 0.00 0.00 35.95 39.29 1mm4 h PHE 10 CO 0.01 0.76 0.32 0.00 -2.23 0.00 0.00 178.31 177.17 1mm4 h ARG 11 N 0.97 0.67 -0.04 1.11 3.08 -1.34 -1.99 114.38 116.83 1mm4 h ARG 11 Ca 0.23 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 60.11 1mm4 h ARG 11 Cb 0.18 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1mm4 h ARG 11 CO -0.02 0.45 -0.54 1.49 -1.07 0.00 0.00 179.97 180.28 1mm4 h GLU 12 N 0.68 0.12 0.66 0.04 4.81 -1.52 -0.66 114.58 118.70 1mm4 h GLU 12 Ca 0.18 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 1mm4 h GLU 12 Cb -0.06 0.01 0.01 0.00 0.63 0.00 0.00 28.75 29.33 1mm4 h GLU 12 CO -0.04 0.63 -0.31 -0.97 -0.73 0.00 0.00 179.01 177.59 1mm4 h ASN 13 N 0.09 -0.75 0.17 1.04 -0.73 -0.67 -0.83 115.58 113.91 1mm4 h ASN 13 Ca -0.00 0.00 -0.14 0.00 1.87 0.00 0.00 56.30 58.03 1mm4 h ASN 13 Cb 0.99 0.19 -0.01 0.00 0.27 0.00 0.00 38.32 39.76 1mm4 h ASN 13 CO 0.08 -0.48 -0.50 0.16 -0.37 0.00 0.00 177.43 176.32 1mm4 h ILE 14 N -0.96 1.33 -0.89 2.57 3.07 -1.42 -2.26 117.51 118.95 1mm4 h ILE 14 Ca -0.09 -1.73 -0.01 0.00 1.55 0.00 0.00 64.86 64.58 1mm4 h ILE 14 Cb 0.70 1.77 -0.04 0.00 -0.27 0.00 0.00 36.82 38.98 1mm4 h ILE 14 CO 0.15 0.53 0.52 0.00 -1.05 0.00 0.00 178.15 178.29 1mm4 h ALA 15 N 1.17 1.14 0.00 0.16 0.00 -1.05 -1.78 119.26 118.90 1mm4 h ALA 15 Ca 0.01 -0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.61 1mm4 h ALA 15 Cb 0.98 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1mm4 h ALA 15 CO 0.08 0.62 -0.89 0.37 0.00 0.00 0.00 179.25 179.43 1mm4 h GLN 16 N 1.23 0.25 -0.31 0.00 4.15 -1.07 -2.33 115.11 117.03 1mm4 h GLN 16 Ca 0.32 -0.27 -0.01 0.00 0.77 0.00 0.00 58.65 59.46 1mm4 h GLN 16 Cb -0.02 0.08 -0.01 0.00 0.21 0.00 0.00 27.48 27.74 1mm4 h GLN 16 CO -0.06 0.99 0.17 1.15 -1.93 0.00 0.00 178.83 179.15 1mm4 h THR 17 N 0.14 1.14 0.00 2.39 2.02 -0.99 -2.18 112.91 115.43 1mm4 h THR 17 Ca -0.05 -0.36 -0.13 0.00 0.77 0.00 0.00 66.41 66.63 1mm4 h THR 17 Cb 1.53 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 68.73 1mm4 h THR 17 CO 0.14 0.14 -0.64 -0.50 0.37 0.00 0.00 175.52 175.03 1mm4 h TRP 18 N 0.38 0.00 0.94 3.16 -0.00 -1.39 -3.11 115.95 115.92 1mm4 h TRP 18 Ca 0.11 0.00 -0.05 0.00 -0.00 0.00 0.00 58.89 58.95 1mm4 h TRP 18 Cb 0.07 0.00 0.01 0.00 -0.00 0.00 0.00 29.16 29.24 1mm4 h TRP 18 CO -0.03 0.64 -0.45 0.37 -0.00 0.00 0.00 178.44 178.97 1mm4 h GLN 19 N 0.00 -1.21 -3.13 0.49 -0.00 -1.08 -3.37 115.11 106.81 1mm4 h GLN 19 Ca -0.01 0.08 -0.62 0.00 -0.00 0.00 0.00 58.65 58.10 1mm4 h GLN 19 Cb 1.18 0.28 -0.41 0.00 0.00 0.00 0.00 27.48 28.53 1mm4 h GLN 19 CO 0.08 -0.81 -0.63 -0.65 0.00 0.00 0.00 178.83 176.83 1mm4 s GLN 20 N -5.80 2.13 0.65 1.69 -1.52 -0.85 -5.10 119.66 110.86 1mm4 s GLN 20 Ca -0.19 -2.94 -0.17 0.00 -1.95 0.00 0.00 55.36 50.11 1mm4 s GLN 20 Cb 0.02 -3.19 -0.05 0.00 -0.22 0.00 0.00 33.01 29.58 1mm4 s GLN 20 CO 0.58 -1.23 0.71 -2.30 -0.25 0.00 0.00 175.29 172.80 1mm4 n PRO 21 N 2.50 0.53 -0.01 2.91 -0.02 -1.18 -4.82 135.00 134.92 1mm4 n PRO 21 Ca 0.15 0.22 -0.01 0.00 -2.02 0.00 0.00 63.50 61.84 1mm4 n PRO 21 Cb 0.35 -1.94 -0.00 0.00 -0.02 0.00 0.00 33.50 31.88 1mm4 n PRO 21 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1mm4 n GLU 22 N -0.82 0.05 -3.88 -0.52 1.02 -1.26 -5.10 120.64 110.13 1mm4 n GLU 22 Ca 0.12 0.17 -0.07 0.00 -0.02 0.00 0.00 57.16 57.35 1mm4 n GLU 22 Cb 0.49 -0.74 -0.02 0.00 -0.02 0.00 0.00 31.44 31.14 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 -1.16 -0.10 -0.03 -0.32 3.76 -1.26 -5.01 115.29 111.16 1mm4 s HIS 23 Ca -0.02 -0.35 0.05 0.00 -0.15 0.00 0.00 55.06 54.58 1mm4 s HIS 23 Cb 0.00 0.65 -0.03 0.00 1.11 0.00 0.00 32.58 34.32 1mm4 s HIS 23 CO 0.03 -1.22 -0.16 0.71 -0.85 0.00 0.00 174.74 173.24 1mm4 s TYR 24 N -3.86 2.63 -0.05 1.40 2.02 -1.07 -4.61 117.35 113.83 1mm4 s TYR 24 Ca 0.13 -0.21 -0.02 0.00 -0.37 0.00 0.00 57.07 56.60 1mm4 s TYR 24 Cb -0.05 -1.58 0.03 0.00 -0.40 0.00 0.00 41.96 39.96 1mm4 s TYR 24 CO 0.07 0.17 0.08 0.34 -1.57 0.00 0.00 175.55 174.65 1mm4 s ASP 25 N -0.85 0.56 0.01 2.29 2.15 -1.05 -2.07 116.67 117.71 1mm4 s ASP 25 Ca 0.12 0.15 -0.01 0.00 0.43 0.00 0.00 52.55 53.24 1mm4 s ASP 25 Cb -0.11 0.01 -0.04 0.00 -0.30 0.00 0.00 42.92 42.49 1mm4 s ASP 25 CO 0.01 -0.20 0.14 -0.76 -0.17 0.00 0.00 175.17 174.19 1mm4 s LEU 26 N 1.72 4.13 -0.12 -1.34 1.02 -0.89 -2.26 118.68 120.94 1mm4 s LEU 26 Ca -0.02 0.23 0.02 0.00 0.02 0.00 0.00 54.13 54.38 1mm4 s LEU 26 Cb -0.12 -2.51 0.01 0.00 0.02 0.00 0.00 46.19 43.59 1mm4 s LEU 26 CO -0.04 0.25 -0.17 -0.47 0.02 0.00 0.00 176.35 175.93 1mm4 s TYR 27 N -1.30 2.21 0.00 0.29 6.14 0.41 -2.59 117.35 122.52 1mm4 s TYR 27 Ca 0.27 -1.08 -0.07 0.00 0.64 0.00 0.00 57.07 56.83 1mm4 s TYR 27 Cb -0.12 -1.56 0.00 0.00 0.42 0.00 0.00 41.96 40.70 1mm4 s TYR 27 CO 0.18 -0.53 0.13 0.96 0.64 0.00 0.00 175.55 176.93 1mm4 s ILE 28 N 0.96 0.08 1.18 3.14 -4.36 -1.05 -0.96 121.20 120.19 1mm4 s ILE 28 Ca -0.06 -0.67 -0.19 0.00 -0.26 0.00 0.00 60.65 59.47 1mm4 s ILE 28 Cb -0.15 -0.42 0.28 0.00 1.25 0.00 0.00 42.46 43.42 1mm4 s ILE 28 CO -0.02 -0.37 1.13 -2.16 0.24 0.00 0.00 174.94 173.75 1mm4 s PRO 29 N -1.34 -1.05 -0.01 0.37 0.04 -1.26 -2.35 135.00 129.41 1mm4 s PRO 29 Ca -0.14 -0.08 -0.00 0.00 0.04 0.00 0.00 61.00 60.81 1mm4 s PRO 29 Cb -0.07 -1.62 -0.00 0.00 0.04 0.00 0.00 34.50 32.84 1mm4 s PRO 29 CO 0.01 -3.59 -0.01 0.00 0.04 0.00 0.00 177.00 173.46 1mm4 n ALA 30 N -4.67 2.12 -2.40 8.56 0.00 -1.25 -4.62 120.51 118.24 1mm4 n ALA 30 Ca 0.13 -0.03 -0.31 0.00 0.00 0.00 0.00 53.44 53.23 1mm4 n ALA 30 Cb 0.59 0.48 -0.14 0.00 0.00 0.00 0.00 19.45 20.39 1mm4 n ALA 30 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1mm4 s ILE 31 N -2.01 2.55 -0.05 0.00 1.09 -1.26 -5.07 121.20 116.45 1mm4 s ILE 31 Ca -0.01 -1.09 -0.01 0.00 -1.10 0.00 0.00 60.65 58.44 1mm4 s ILE 31 Cb 0.00 -2.00 -0.00 0.00 -1.06 0.00 0.00 42.46 39.40 1mm4 s ILE 31 CO 0.02 0.47 -0.02 0.71 -0.10 0.00 0.00 174.94 176.02 1mm4 h THR 32 N 4.23 0.00 -2.93 2.92 1.35 -2.02 -3.48 112.91 112.99 1mm4 h THR 32 Ca -0.46 -0.46 -0.20 0.00 -0.55 0.00 0.00 66.41 64.75 1mm4 h THR 32 Cb 1.14 0.00 -0.31 0.00 -1.73 0.00 0.00 68.15 67.26 1mm4 h THR 32 CO 0.47 0.00 -0.49 0.86 -0.25 0.00 0.00 175.52 176.12 1mm4 s TRP 33 N -1.33 -0.39 1.14 4.73 -0.11 -1.26 -5.16 118.94 116.57 1mm4 s TRP 33 Ca -0.02 0.90 -0.14 0.00 1.22 0.00 0.00 56.10 58.07 1mm4 s TRP 33 Cb 0.00 0.03 0.27 0.00 -1.50 0.00 0.00 33.47 32.27 1mm4 s TRP 33 CO 0.02 -0.29 1.04 -3.38 -4.62 0.00 0.00 176.95 169.73 1mm4 s HIS 34 N 1.73 1.40 0.05 5.86 -3.43 -1.26 -4.97 115.29 114.68 1mm4 s HIS 34 Ca -0.05 1.00 -0.29 0.00 -0.80 0.00 0.00 55.06 54.92 1mm4 s HIS 34 Cb -0.11 -3.16 -0.04 0.00 -1.43 0.00 0.00 32.58 27.84 1mm4 s HIS 34 CO -0.09 -3.69 0.93 0.00 -2.00 0.00 0.00 174.74 169.90 1mm4 s ALA 35 N -2.65 3.23 -0.22 -1.38 0.00 -1.26 -5.02 121.76 114.46 1mm4 s ALA 35 Ca 0.68 0.50 -0.33 0.00 0.00 0.00 0.00 51.96 52.81 1mm4 s ALA 35 Cb -0.21 -3.25 0.15 0.00 0.00 0.00 0.00 23.12 19.81 1mm4 s ALA 35 CO 0.61 -0.10 1.23 1.03 0.00 0.00 0.00 175.76 178.53 1mm4 s ARG 36 N 0.45 0.26 -0.72 0.00 1.81 -1.26 -5.11 118.95 114.38 1mm4 s ARG 36 Ca 0.47 -0.04 -0.26 0.00 -1.72 0.00 0.00 55.73 54.19 1mm4 s ARG 36 Cb -0.22 0.12 0.04 0.00 -0.45 0.00 0.00 34.95 34.44 1mm4 s ARG 36 CO 0.28 -0.10 1.22 -0.06 -0.68 0.00 0.00 175.30 175.96 1mm4 s PHE 37 N -1.81 2.36 0.11 -0.53 0.40 -1.26 -5.01 117.98 112.24 1mm4 s PHE 37 Ca 0.08 -0.12 -0.00 0.00 -0.60 0.00 0.00 56.93 56.29 1mm4 s PHE 37 Cb -0.01 -4.57 -0.04 0.00 0.51 0.00 0.00 43.02 38.91 1mm4 s PHE 37 CO -0.05 -1.99 0.27 0.00 0.70 0.00 0.00 175.22 174.16 1mm4 s ALA 38 N 5.42 3.95 -0.54 5.36 0.00 -1.26 -5.06 121.76 129.62 1mm4 s ALA 38 Ca 0.33 -0.86 -0.19 0.00 0.00 0.00 0.00 51.96 51.24 1mm4 s ALA 38 Cb -0.10 -1.87 0.07 0.00 0.00 0.00 0.00 23.12 21.22 1mm4 s ALA 38 CO 0.15 0.68 0.68 0.71 0.00 0.00 0.00 175.76 177.98 1mm4 s TYR 39 N -1.64 3.00 -0.04 0.00 2.02 -1.26 -5.04 117.35 114.40 1mm4 s TYR 39 Ca 0.36 -0.66 0.03 0.00 -0.37 0.00 0.00 57.07 56.43 1mm4 s TYR 39 Cb -0.12 -3.76 -0.03 0.00 -0.40 0.00 0.00 41.96 37.65 1mm4 s TYR 39 CO 0.28 -1.17 -0.12 0.34 -1.57 0.00 0.00 175.55 173.31 1mm4 s ASP 40 N 3.06 4.22 -0.17 2.29 -1.08 -1.26 -5.03 116.67 118.71 1mm4 s ASP 40 Ca 0.15 -0.17 -0.12 0.00 -0.52 0.00 0.00 52.55 51.89 1mm4 s ASP 40 Cb -0.21 -0.93 -0.22 0.00 -1.46 0.00 0.00 42.92 40.11 1mm4 s ASP 40 CO 0.10 0.33 0.24 0.29 0.52 0.00 0.00 175.17 176.65 1mm4 n LYS 41 N 2.12 0.68 -2.64 4.34 5.02 -1.26 -5.07 118.16 121.34 1mm4 n LYS 41 Ca -0.17 0.37 -0.02 0.00 -2.02 0.00 0.00 58.31 56.47 1mm4 n LYS 41 Cb 0.52 -1.70 -0.02 0.00 -0.02 0.00 0.00 35.03 33.82 1mm4 n LYS 41 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1mm4 n GLU 42 N -3.85 -3.85 -2.14 1.97 -0.58 -1.26 -5.07 120.64 105.86 1mm4 n GLU 42 Ca -0.34 3.01 -0.06 0.00 -0.42 0.00 0.00 57.16 59.35 1mm4 n GLU 42 Cb 0.91 -5.17 -0.00 0.00 -0.57 0.00 0.00 31.44 26.60 1mm4 n GLU 42 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1mm4 n LYS 43 N 1.07 1.45 -0.29 3.49 4.76 -1.26 -5.13 118.16 122.24 1mm4 n LYS 43 Ca -0.16 -0.72 -0.22 0.00 -2.87 0.00 0.00 58.31 54.34 1mm4 n LYS 43 Cb 0.25 0.11 0.21 0.00 -1.84 0.00 0.00 35.03 33.76 1mm4 n LYS 43 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1mm4 n THR 44 N -0.62 0.00 -2.08 -0.18 -1.04 -1.26 -4.82 114.28 104.28 1mm4 n THR 44 Ca -0.02 -0.08 0.00 0.00 -2.04 0.00 0.00 64.05 61.92 1mm4 n THR 44 Cb 0.13 -0.82 0.00 0.00 -1.82 0.00 0.00 70.33 67.82 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 -4.94 -8.71 -2.19 8.00 9.92 -1.26 -4.84 116.55 112.53 1mm4 n ASP 45 Ca 0.10 1.46 -0.25 0.00 -0.53 0.00 0.00 54.79 55.57 1mm4 n ASP 45 Cb 0.44 -4.84 0.15 0.00 -0.64 0.00 0.00 41.12 36.22 1mm4 n ASP 45 CO 0.00 0.00 0.00 -2.11 0.13 0.00 0.00 177.20 175.22 1mm4 n ARG 46 N 1.75 2.28 -2.61 -1.24 1.85 -1.26 -4.90 116.66 112.53 1mm4 n ARG 46 Ca 0.00 -2.91 -0.41 0.00 -1.00 0.00 0.00 57.85 53.53 1mm4 n ARG 46 Cb 0.00 -2.14 -0.03 0.00 -1.05 0.00 0.00 32.46 29.24 1mm4 n ARG 46 CO 0.00 0.00 0.00 -0.47 -0.01 0.00 0.00 177.63 177.15 1mm4 s TYR 47 N -3.24 2.43 -0.01 2.89 5.04 -1.26 -5.00 117.35 118.20 1mm4 s TYR 47 Ca 0.56 -0.37 -0.19 0.00 -2.44 0.00 0.00 57.07 54.62 1mm4 s TYR 47 Cb 0.46 -4.59 -0.05 0.00 0.35 0.00 0.00 41.96 38.12 1mm4 s TYR 47 CO 0.08 -1.97 0.55 -0.80 -1.34 0.00 0.00 175.55 172.07 1mm4 s ASN 48 N 4.05 6.93 0.34 4.32 -0.87 -1.26 -5.07 114.94 123.37 1mm4 s ASN 48 Ca 0.36 1.10 -0.13 0.00 -1.57 0.00 0.00 52.86 52.63 1mm4 s ASN 48 Cb -0.07 -2.34 -0.08 0.00 -0.02 0.00 0.00 41.25 38.74 1mm4 s ASN 48 CO 0.07 0.14 0.72 -0.70 -2.57 0.00 0.00 177.10 174.76 1mm4 s GLU 49 N -0.31 3.90 -0.42 -0.60 2.12 -1.26 -5.06 118.70 117.09 1mm4 s GLU 49 Ca 0.29 0.55 0.04 0.00 0.36 0.00 0.00 54.97 56.21 1mm4 s GLU 49 Cb -0.18 -2.45 0.18 0.00 0.26 0.00 0.00 34.13 31.94 1mm4 s GLU 49 CO 0.16 0.12 0.36 0.54 -0.54 0.00 0.00 175.26 175.90 1mm4 n ARG 50 N -0.63 0.26 -0.20 4.30 5.12 -1.26 -5.14 116.66 119.12 1mm4 n ARG 50 Ca 0.03 -3.20 -0.09 0.00 -1.93 0.00 0.00 57.85 52.65 1mm4 n ARG 50 Cb 0.53 -1.65 0.09 0.00 -1.16 0.00 0.00 32.46 30.27 1mm4 n ARG 50 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1mm4 n PRO 51 N 2.71 -1.43 -4.03 5.56 -0.02 -1.26 -5.03 135.00 131.51 1mm4 n PRO 51 Ca 0.29 -0.44 -0.23 0.00 -2.02 0.00 0.00 63.50 61.10 1mm4 n PRO 51 Cb 0.48 -0.75 -0.17 0.00 -0.02 0.00 0.00 33.50 33.04 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 -1.31 0.97 0.24 6.00 0.52 -1.26 -5.03 118.94 119.06 1mm4 s TRP 52 Ca 0.20 -0.35 0.02 0.00 0.02 0.00 0.00 56.10 55.99 1mm4 s TRP 52 Cb -0.04 -0.88 -0.04 0.00 -1.15 0.00 0.00 33.47 31.37 1mm4 s TRP 52 CO 0.17 -0.32 0.17 0.20 0.02 0.00 0.00 176.95 177.20 1mm4 s GLY 53 N 1.39 1.74 0.00 0.98 0.00 -1.26 -3.12 107.32 107.05 1mm4 s GLY 53 Ca -0.03 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 42.87 1mm4 s GLY 53 CO -0.03 -1.43 0.00 0.61 0.00 0.00 0.00 173.10 172.25 1mm4 n GLY 54 N -0.39 2.53 3.04 0.20 0.00 -1.07 -5.01 105.19 104.48 1mm4 n GLY 54 Ca 0.04 -1.07 -0.18 0.00 0.00 0.00 0.00 46.02 44.80 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 0.48 0.03 -0.02 0.00 -0.14 -1.72 107.32 105.96 1mm4 s GLY 55 Ca 0.00 -0.48 -0.11 0.00 0.00 0.00 0.00 44.72 44.13 1mm4 s GLY 55 CO 0.00 -0.43 0.24 -1.36 0.00 0.00 0.00 173.10 171.55 1mm4 s PHE 56 N -0.42 -0.03 -1.78 1.90 0.08 -1.07 -0.44 117.98 116.22 1mm4 s PHE 56 Ca 0.02 -0.10 0.00 0.00 0.12 0.00 0.00 56.93 56.97 1mm4 s PHE 56 Cb -0.05 0.03 0.00 0.00 -0.57 0.00 0.00 43.02 42.43 1mm4 s PHE 56 CO -0.00 -0.43 0.00 0.41 -0.10 0.00 0.00 175.22 175.10 1mm4 n GLY 57 N 0.81 -1.03 3.37 4.36 0.00 -0.96 -0.56 105.19 111.19 1mm4 n GLY 57 Ca -0.20 -0.89 -0.21 0.00 0.00 0.00 0.00 46.02 44.72 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 1.78 0.01 0.99 1.02 -0.86 -2.52 118.68 119.10 1mm4 s LEU 58 Ca 0.00 -1.64 0.01 0.00 0.02 0.00 0.00 54.13 52.53 1mm4 s LEU 58 Cb 0.00 0.20 -0.01 0.00 0.02 0.00 0.00 46.19 46.40 1mm4 s LEU 58 CO 0.00 -0.94 -0.05 -0.44 0.02 0.00 0.00 176.35 174.94 1mm4 s SER 59 N -3.44 0.56 -0.05 2.29 0.01 -1.26 -2.60 113.70 109.21 1mm4 s SER 59 Ca 0.33 -0.19 -0.01 0.00 1.31 0.00 0.00 55.95 57.40 1mm4 s SER 59 Cb 0.04 -0.03 -0.03 0.00 0.21 0.00 0.00 66.02 66.20 1mm4 s SER 59 CO 0.19 -0.02 0.01 -0.60 0.41 0.00 0.00 173.24 173.23 1mm4 s ARG 60 N -0.46 2.92 -0.11 12.44 3.52 -0.13 -4.74 118.95 132.39 1mm4 s ARG 60 Ca -0.02 -0.48 -0.02 0.00 -0.13 0.00 0.00 55.73 55.08 1mm4 s ARG 60 Cb -0.04 -2.76 -0.03 0.00 -1.56 0.00 0.00 34.95 30.57 1mm4 s ARG 60 CO -0.00 0.67 -0.03 1.67 -0.81 0.00 0.00 175.30 176.81 1mm4 s TRP 61 N -0.98 3.07 -0.14 5.12 1.48 -1.26 -0.48 118.94 125.74 1mm4 s TRP 61 Ca 0.16 -0.02 -0.03 0.00 -1.06 0.00 0.00 56.10 55.15 1mm4 s TRP 61 Cb -0.11 -1.84 -0.02 0.00 -1.16 0.00 0.00 33.47 30.33 1mm4 s TRP 61 CO 0.06 0.25 -0.06 0.34 -4.06 0.00 0.00 176.95 173.48 1mm4 s ASP 62 N -0.37 4.62 0.30 -2.66 3.68 0.44 -4.98 116.67 117.70 1mm4 s ASP 62 Ca 0.06 -0.16 0.23 0.00 2.13 0.00 0.00 52.55 54.81 1mm4 s ASP 62 Cb -0.12 -1.70 1.10 0.00 -1.45 0.00 0.00 42.92 40.75 1mm4 s ASP 62 CO 0.02 0.18 1.69 1.21 0.13 0.00 0.00 175.17 178.41 1mm4 n GLU 63 N 3.42 0.17 -0.71 4.34 2.13 -1.26 -1.96 120.64 126.77 1mm4 n GLU 63 Ca -0.18 0.55 -0.08 0.00 0.66 0.00 0.00 57.16 58.12 1mm4 n GLU 63 Cb 0.53 -1.93 0.17 0.00 0.27 0.00 0.00 31.44 30.48 1mm4 n GLU 63 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1mm4 n LYS 64 N -2.26 2.50 -2.65 5.31 3.00 -1.26 -4.86 118.16 117.93 1mm4 n LYS 64 Ca 0.00 -1.98 -0.07 0.00 -0.00 0.00 0.00 58.31 56.25 1mm4 n LYS 64 Cb 0.12 -1.86 0.04 0.00 0.00 0.00 0.00 35.03 33.33 1mm4 n LYS 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1mm4 n GLY 65 N -0.18 0.15 3.18 3.14 0.00 -0.83 -5.06 105.19 105.60 1mm4 n GLY 65 Ca 0.30 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.92 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 -3.48 1.57 -0.25 1.61 2.47 -1.08 -4.83 114.94 110.94 1mm4 s ASN 66 Ca 0.04 -0.77 -0.04 0.00 0.42 0.00 0.00 52.86 52.51 1mm4 s ASN 66 Cb -0.02 -0.02 0.09 0.00 -1.45 0.00 0.00 41.25 39.85 1mm4 s ASN 66 CO 0.30 -0.21 0.12 0.26 -3.72 0.00 0.00 177.10 173.85 1mm4 s TRP 67 N -2.14 0.33 -0.10 0.43 0.51 -0.88 -0.42 118.94 116.67 1mm4 s TRP 67 Ca 0.04 -0.73 -0.28 0.00 -2.12 0.00 0.00 56.10 53.01 1mm4 s TRP 67 Cb -0.05 -0.86 -0.02 0.00 -0.81 0.00 0.00 33.47 31.74 1mm4 s TRP 67 CO 0.01 -0.73 0.94 -1.58 -0.51 0.00 0.00 176.95 175.08 1mm4 s HIS 68 N 2.10 3.52 -0.32 -1.98 2.46 0.37 -2.36 115.29 119.08 1mm4 s HIS 68 Ca 0.07 1.51 -0.04 0.00 0.47 0.00 0.00 55.06 57.07 1mm4 s HIS 68 Cb -0.16 -3.11 0.05 0.00 -0.13 0.00 0.00 32.58 29.22 1mm4 s HIS 68 CO -0.28 -0.18 0.05 0.20 -2.47 0.00 0.00 174.74 172.06 1mm4 s GLY 69 N 1.07 1.80 -0.08 1.59 0.00 -0.65 -0.96 107.32 110.09 1mm4 s GLY 69 Ca 0.46 -1.76 0.03 0.00 0.00 0.00 0.00 44.72 43.46 1mm4 s GLY 69 CO 0.18 0.73 -0.19 1.08 0.00 0.00 0.00 173.10 174.90 1mm4 s LEU 70 N 1.32 1.92 0.06 0.66 1.02 -1.07 -1.66 118.68 120.94 1mm4 s LEU 70 Ca -0.03 -0.45 -0.12 0.00 0.02 0.00 0.00 54.13 53.54 1mm4 s LEU 70 Cb -0.20 -1.18 0.01 0.00 0.02 0.00 0.00 46.19 44.85 1mm4 s LEU 70 CO 0.01 0.11 0.27 -0.31 0.02 0.00 0.00 176.35 176.45 1mm4 s TYR 71 N 0.44 -0.02 -0.12 0.29 2.02 -0.50 -2.02 117.35 117.43 1mm4 s TYR 71 Ca -0.17 -0.23 -0.04 0.00 -0.37 0.00 0.00 57.07 56.27 1mm4 s TYR 71 Cb -0.17 0.05 0.05 0.00 -0.40 0.00 0.00 41.96 41.49 1mm4 s TYR 71 CO 0.07 -0.53 0.08 0.00 -1.57 0.00 0.00 175.55 173.61 1mm4 s ALA 72 N -3.05 0.32 0.17 3.71 0.00 0.28 -1.61 121.76 121.58 1mm4 s ALA 72 Ca -0.01 -0.10 0.07 0.00 0.00 0.00 0.00 51.96 51.92 1mm4 s ALA 72 Cb 0.01 -0.89 -0.04 0.00 0.00 0.00 0.00 23.12 22.20 1mm4 s ALA 72 CO -0.06 -0.92 -0.02 0.00 0.00 0.00 0.00 175.76 174.75 1mm4 s MET 73 N 2.16 2.33 0.08 0.00 0.23 -0.97 -2.59 119.30 120.55 1mm4 s MET 73 Ca 0.03 -1.12 0.04 0.00 -1.03 0.00 0.00 55.69 53.62 1mm4 s MET 73 Cb -0.15 -2.33 -0.03 0.00 -1.53 0.00 0.00 34.83 30.80 1mm4 s MET 73 CO -0.07 0.46 -0.12 0.00 -2.03 0.00 0.00 175.02 173.26 1mm4 s ALA 74 N -1.68 1.11 0.05 3.16 0.00 -0.70 -1.20 121.76 122.51 1mm4 s ALA 74 Ca 0.27 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.16 1mm4 s ALA 74 Cb -0.09 -0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 1mm4 s ALA 74 CO 0.18 0.06 -0.05 -0.06 0.00 0.00 0.00 175.76 175.89 1mm4 s PHE 75 N -1.79 0.59 -0.80 0.00 0.40 -1.07 -2.59 117.98 112.72 1mm4 s PHE 75 Ca 0.01 -0.79 -0.24 0.00 -0.60 0.00 0.00 56.93 55.30 1mm4 s PHE 75 Cb -0.07 -0.38 0.05 0.00 0.51 0.00 0.00 43.02 43.13 1mm4 s PHE 75 CO 0.01 -0.21 1.22 0.15 0.70 0.00 0.00 175.22 177.09 1mm4 s LYS 76 N -2.86 3.29 0.39 0.44 -0.14 -1.18 -0.40 119.74 119.27 1mm4 s LYS 76 Ca -0.00 -0.71 -0.06 0.00 -1.36 0.00 0.00 55.97 53.83 1mm4 s LYS 76 Cb -0.00 -4.51 0.10 0.00 -1.68 0.00 0.00 37.83 31.74 1mm4 s LYS 76 CO -0.04 -2.04 0.34 -3.47 -0.76 0.00 0.00 175.35 169.37 1mm4 n ASP 77 N 8.59 -1.37 -0.05 2.83 2.03 -0.70 -4.91 116.55 122.97 1mm4 n ASP 77 Ca 0.09 -0.70 0.15 0.00 0.52 0.00 0.00 54.79 54.86 1mm4 n ASP 77 Cb 0.48 -0.31 0.79 0.00 -0.72 0.00 0.00 41.12 41.36 1mm4 n ASP 77 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1mm4 n SER 78 N -3.59 0.19 -1.59 1.67 7.64 -1.26 -3.41 113.62 113.27 1mm4 n SER 78 Ca 0.05 -0.65 0.04 0.00 1.01 0.00 0.00 58.87 59.32 1mm4 n SER 78 Cb 0.18 -0.11 0.30 0.00 -1.01 0.00 0.00 64.21 63.57 1mm4 n SER 78 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 1mm4 n TRP 79 N -1.02 1.65 -2.50 1.43 -0.00 -1.26 -4.89 117.44 110.84 1mm4 n TRP 79 Ca 0.18 -0.61 -0.16 0.00 -0.00 0.00 0.00 57.50 56.91 1mm4 n TRP 79 Cb 0.21 -0.44 -0.00 0.00 -0.00 0.00 0.00 31.31 31.07 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 0.41 -4.58 -4.12 5.87 4.13 -1.22 -4.95 115.26 110.80 1mm4 n ASN 80 Ca 0.23 0.08 -0.10 0.00 1.68 0.00 0.00 54.58 56.47 1mm4 n ASN 80 Cb 1.00 -3.84 -0.10 0.00 -1.54 0.00 0.00 39.78 35.30 1mm4 n ASN 80 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1mm4 s LYS 81 N -5.12 0.70 -0.39 3.52 -0.14 -1.26 -5.01 119.74 112.05 1mm4 s LYS 81 Ca 0.03 -1.19 -0.23 0.00 -1.36 0.00 0.00 55.97 53.22 1mm4 s LYS 81 Cb -0.02 -0.08 0.01 0.00 -1.68 0.00 0.00 37.83 36.07 1mm4 s LYS 81 CO 0.04 -0.04 0.80 -1.58 -0.76 0.00 0.00 175.35 173.82 1mm4 s TRP 82 N -3.30 3.07 -0.09 3.18 0.51 -1.26 -1.71 118.94 119.33 1mm4 s TRP 82 Ca 0.06 0.47 -0.30 0.00 -2.12 0.00 0.00 56.10 54.21 1mm4 s TRP 82 Cb 0.03 -3.51 -0.02 0.00 -0.81 0.00 0.00 33.47 29.16 1mm4 s TRP 82 CO -0.05 -0.82 1.09 -2.00 -0.51 0.00 0.00 176.95 174.65 1mm4 s GLU 83 N 3.21 4.38 0.32 4.98 -6.30 0.46 -4.83 118.70 120.93 1mm4 s GLU 83 Ca 0.32 1.50 -0.27 0.00 -2.50 0.00 0.00 54.97 54.02 1mm4 s GLU 83 Cb -0.13 -3.56 -0.10 0.00 0.00 0.00 0.00 34.13 30.35 1mm4 s GLU 83 CO 0.19 -0.39 0.98 -1.25 0.02 0.00 0.00 175.26 174.81 1mm4 s PRO 84 N 2.18 4.55 -0.11 4.30 0.04 -1.26 -2.60 135.00 142.09 1mm4 s PRO 84 Ca 0.51 1.45 -0.02 0.00 0.04 0.00 0.00 61.00 62.98 1mm4 s PRO 84 Cb -0.21 -2.87 0.04 0.00 0.04 0.00 0.00 34.50 31.50 1mm4 s PRO 84 CO 0.19 0.23 0.01 0.42 0.04 0.00 0.00 177.00 177.88 1mm4 s ILE 85 N -1.50 0.46 -0.06 0.56 1.01 -0.34 -4.26 121.20 117.07 1mm4 s ILE 85 Ca 0.50 -0.10 -0.11 0.00 0.00 0.00 0.00 60.65 60.93 1mm4 s ILE 85 Cb -0.22 -0.71 -0.05 0.00 0.01 0.00 0.00 42.46 41.49 1mm4 s ILE 85 CO 0.28 0.12 0.28 0.00 0.00 0.00 0.00 174.94 175.63 1mm4 s ALA 86 N 1.92 3.78 -0.13 9.38 0.00 -1.07 -2.29 121.76 133.36 1mm4 s ALA 86 Ca 0.03 -0.41 -0.10 0.00 0.00 0.00 0.00 51.96 51.48 1mm4 s ALA 86 Cb -0.14 -2.19 0.04 0.00 0.00 0.00 0.00 23.12 20.83 1mm4 s ALA 86 CO -0.06 0.54 0.33 0.20 0.00 0.00 0.00 175.76 176.77 1mm4 s GLY 87 N -1.04 -0.24 -0.04 0.00 0.00 -0.64 -1.18 107.32 104.18 1mm4 s GLY 87 Ca 0.20 1.06 -0.26 0.00 0.00 0.00 0.00 44.72 45.71 1mm4 s GLY 87 CO 0.09 1.06 0.58 -2.52 0.00 0.00 0.00 173.10 172.31 1mm4 s TYR 88 N 0.63 -0.53 0.11 1.90 1.13 0.43 -1.41 117.35 119.62 1mm4 s TYR 88 Ca -0.04 0.89 -0.23 0.00 -1.41 0.00 0.00 57.07 56.29 1mm4 s TYR 88 Cb -0.05 0.32 0.08 0.00 -1.10 0.00 0.00 41.96 41.21 1mm4 s TYR 88 CO -0.04 -0.55 1.07 0.41 -2.51 0.00 0.00 175.55 173.93 1mm4 n GLY 89 N 1.03 0.49 3.29 5.49 0.00 -0.66 -0.42 105.19 114.41 1mm4 n GLY 89 Ca -0.20 -1.11 -0.27 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.20 2.00 0.02 1.61 0.51 -0.77 -1.64 118.94 118.46 1mm4 s TRP 90 Ca 0.24 -0.39 -0.21 0.00 -2.12 0.00 0.00 56.10 53.62 1mm4 s TRP 90 Cb -0.02 -1.18 0.05 0.00 -0.81 0.00 0.00 33.47 31.51 1mm4 s TRP 90 CO 0.03 0.13 0.48 -1.83 -0.51 0.00 0.00 176.95 175.25 1mm4 s GLU 91 N -1.32 0.94 -0.15 4.98 -1.05 -0.99 -1.85 118.70 119.26 1mm4 s GLU 91 Ca 0.09 -0.17 -0.01 0.00 -0.15 0.00 0.00 54.97 54.72 1mm4 s GLU 91 Cb -0.09 0.43 -0.02 0.00 -0.44 0.00 0.00 34.13 34.01 1mm4 s GLU 91 CO 0.02 -0.31 -0.10 0.45 0.95 0.00 0.00 175.26 176.27 1mm4 s SER 92 N -1.72 4.17 -0.11 0.83 0.15 -1.07 -2.07 113.70 113.89 1mm4 s SER 92 Ca -0.08 -0.31 -0.02 0.00 0.70 0.00 0.00 55.95 56.24 1mm4 s SER 92 Cb -0.01 -1.66 -0.03 0.00 -1.71 0.00 0.00 66.02 62.61 1mm4 s SER 92 CO 0.01 0.14 -0.02 0.42 1.20 0.00 0.00 173.24 174.99 1mm4 s THR 93 N 0.54 4.11 0.09 6.45 -4.23 -1.26 -2.59 115.64 118.75 1mm4 s THR 93 Ca -0.07 -0.31 -0.11 0.00 -1.18 0.00 0.00 61.69 60.03 1mm4 s THR 93 Cb -0.15 -2.75 0.01 0.00 1.34 0.00 0.00 72.50 70.95 1mm4 s THR 93 CO 0.03 0.57 0.24 -1.66 -0.54 0.00 0.00 174.62 173.26 1mm4 s TRP 94 N -0.46 0.05 0.06 3.99 -2.14 -0.82 -4.95 118.94 114.66 1mm4 s TRP 94 Ca 0.08 -0.40 0.05 0.00 2.66 0.00 0.00 56.10 58.48 1mm4 s TRP 94 Cb -0.12 0.02 -0.03 0.00 -3.10 0.00 0.00 33.47 30.25 1mm4 s TRP 94 CO 0.02 -0.56 -0.14 -0.98 -2.66 0.00 0.00 176.95 172.63 1mm4 s ARG 95 N -3.60 0.85 0.28 3.25 1.70 -1.26 -1.81 118.95 118.36 1mm4 s ARG 95 Ca 0.03 -0.86 -0.04 0.00 -0.47 0.00 0.00 55.73 54.39 1mm4 s ARG 95 Cb 0.03 -0.86 0.06 0.00 -0.57 0.00 0.00 34.95 33.62 1mm4 s ARG 95 CO -0.10 0.20 0.14 -2.30 -1.08 0.00 0.00 175.30 172.16 1mm4 n PRO 96 N 1.57 -1.21 -1.19 3.89 -0.02 -1.26 -4.88 135.00 131.89 1mm4 n PRO 96 Ca -0.20 -0.24 -0.22 0.00 -2.02 0.00 0.00 63.50 60.82 1mm4 n PRO 96 Cb 0.54 -0.38 0.16 0.00 -0.02 0.00 0.00 33.50 33.80 1mm4 n PRO 96 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1mm4 n LEU 97 N 0.00 6.40 -0.01 2.45 7.94 -1.26 -4.55 117.00 127.97 1mm4 n LEU 97 Ca 0.02 -3.78 -0.02 0.00 -1.11 0.00 0.00 56.01 51.12 1mm4 n LEU 97 Cb 0.10 -0.81 -0.01 0.00 0.53 0.00 0.00 43.42 43.23 1mm4 n LEU 97 CO 0.06 1.18 -0.15 0.00 -1.11 0.00 0.00 177.39 177.37 1mm4 n ALA 98 N -1.10 1.85 -2.84 1.96 0.00 -1.26 -5.12 120.51 113.99 1mm4 n ALA 98 Ca 0.55 -0.24 -0.11 0.00 0.00 0.00 0.00 53.44 53.65 1mm4 n ALA 98 Cb 1.39 0.08 -0.07 0.00 0.00 0.00 0.00 19.45 20.85 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 -5.26 0.09 -0.72 0.00 1.11 -1.26 -5.08 116.67 105.54 1mm4 s ASP 99 Ca -0.07 -1.13 0.02 0.00 0.18 0.00 0.00 52.55 51.55 1mm4 s ASP 99 Cb 0.01 0.53 0.36 0.00 1.07 0.00 0.00 42.92 44.89 1mm4 s ASP 99 CO 0.10 -1.06 1.48 -0.62 1.18 0.00 0.00 175.17 176.25 1mm4 n GLU 100 N -0.36 3.71 -0.12 8.23 1.02 -1.26 -4.56 120.64 127.29 1mm4 n GLU 100 Ca -0.00 -4.38 -0.26 0.00 -0.02 0.00 0.00 57.16 52.50 1mm4 n GLU 100 Cb 0.63 -2.31 -0.09 0.00 -0.02 0.00 0.00 31.44 29.66 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 -0.34 1.75 -4.51 1.62 4.13 -1.26 -4.98 115.26 111.67 1mm4 n ASN 101 Ca 0.43 0.28 -0.33 0.00 1.68 0.00 0.00 54.58 56.63 1mm4 n ASN 101 Cb 0.39 -0.70 -0.12 0.00 -1.54 0.00 0.00 39.78 37.80 1mm4 n ASN 101 CO 0.00 0.00 0.00 0.72 0.28 0.00 0.00 177.26 178.26 1mm4 s PHE 102 N -2.45 2.89 0.30 3.10 -0.12 -1.26 -4.64 117.98 115.81 1mm4 s PHE 102 Ca -0.34 -0.19 0.10 0.00 -0.05 0.00 0.00 56.93 56.45 1mm4 s PHE 102 Cb 0.13 -1.77 -0.05 0.00 -0.63 0.00 0.00 43.02 40.70 1mm4 s PHE 102 CO 0.44 0.14 -0.06 -1.01 -0.05 0.00 0.00 175.22 174.68 1mm4 s HIS 103 N -0.36 2.51 -0.07 3.49 3.76 -0.87 -4.69 115.29 119.05 1mm4 s HIS 103 Ca 0.05 -0.35 0.00 0.00 -0.15 0.00 0.00 55.06 54.61 1mm4 s HIS 103 Cb -0.12 -1.26 0.02 0.00 1.11 0.00 0.00 32.58 32.33 1mm4 s HIS 103 CO 0.02 0.59 -0.05 -0.51 -0.85 0.00 0.00 174.74 173.94 1mm4 s LEU 104 N -3.64 1.13 0.08 0.89 1.02 -0.75 -0.42 118.68 116.99 1mm4 s LEU 104 Ca 0.32 -0.18 0.08 0.00 0.02 0.00 0.00 54.13 54.37 1mm4 s LEU 104 Cb -0.03 -0.60 -0.04 0.00 0.02 0.00 0.00 46.19 45.55 1mm4 s LEU 104 CO 0.18 -0.10 -0.17 -0.83 0.02 0.00 0.00 176.35 175.46 1mm4 s GLY 105 N 1.37 1.66 -0.20 -3.19 0.00 -0.61 -1.95 107.32 104.40 1mm4 s GLY 105 Ca -0.03 -1.26 -0.10 0.00 0.00 0.00 0.00 44.72 43.33 1mm4 s GLY 105 CO -0.03 -1.20 0.47 -2.27 0.00 0.00 0.00 173.10 170.07 1mm4 s LEU 106 N -1.84 -0.44 0.00 0.66 0.20 -1.07 -2.57 118.68 113.62 1mm4 s LEU 106 Ca 0.17 1.06 0.00 0.00 0.69 0.00 0.00 54.13 56.05 1mm4 s LEU 106 Cb -0.11 1.57 0.00 0.00 -0.43 0.00 0.00 46.19 47.22 1mm4 s LEU 106 CO 0.08 -0.21 0.00 0.61 -0.29 0.00 0.00 176.35 176.54 1mm4 n GLY 107 N 4.65 1.10 3.46 7.98 0.00 -1.07 -2.58 105.19 118.73 1mm4 n GLY 107 Ca -0.18 -0.62 -0.30 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.18 2.49 -0.12 1.61 0.40 -0.77 -0.43 117.98 118.99 1mm4 s PHE 108 Ca 0.00 -0.29 -0.01 0.00 -0.60 0.00 0.00 56.93 56.03 1mm4 s PHE 108 Cb 0.00 -1.35 0.04 0.00 0.51 0.00 0.00 43.02 42.22 1mm4 s PHE 108 CO 0.00 0.35 -0.02 0.99 0.70 0.00 0.00 175.22 177.24 1mm4 s THR 109 N -1.08 0.69 -0.09 0.64 2.01 -1.01 -1.85 115.64 114.95 1mm4 s THR 109 Ca 0.17 -0.24 -0.01 0.00 0.31 0.00 0.00 61.69 61.91 1mm4 s THR 109 Cb -0.10 -0.88 -0.03 0.00 0.01 0.00 0.00 72.50 71.49 1mm4 s THR 109 CO 0.08 0.17 -0.02 0.00 -0.69 0.00 0.00 174.62 174.17 1mm4 s ALA 110 N 1.83 3.20 0.29 7.40 0.00 0.44 -2.58 121.76 132.34 1mm4 s ALA 110 Ca 0.03 -0.83 0.04 0.00 0.00 0.00 0.00 51.96 51.21 1mm4 s ALA 110 Cb -0.14 -1.43 -0.03 0.00 0.00 0.00 0.00 23.12 21.52 1mm4 s ALA 110 CO -0.07 0.55 0.24 0.20 0.00 0.00 0.00 175.76 176.69 1mm4 s GLY 111 N -0.76 2.02 -0.11 0.00 0.00 0.45 -0.43 107.32 108.48 1mm4 s GLY 111 Ca 0.12 -1.93 -0.09 0.00 0.00 0.00 0.00 44.72 42.82 1mm4 s GLY 111 CO 0.02 -1.42 0.29 0.14 0.00 0.00 0.00 173.10 172.13 1mm4 s VAL 112 N -3.65 -0.01 -0.04 1.40 1.01 -0.33 -1.83 120.40 116.96 1mm4 s VAL 112 Ca 0.40 0.03 0.06 0.00 0.00 0.00 0.00 61.98 62.47 1mm4 s VAL 112 Cb 0.04 -0.42 -0.01 0.00 0.00 0.00 0.00 36.38 35.98 1mm4 s VAL 112 CO 0.23 0.01 -0.22 0.42 0.00 0.00 0.00 175.10 175.54 1mm4 s THR 113 N 0.45 1.80 -0.11 3.92 -4.23 -1.07 -2.60 115.64 113.80 1mm4 s THR 113 Ca -0.02 -0.95 0.01 0.00 -1.18 0.00 0.00 61.69 59.54 1mm4 s THR 113 Cb -0.04 -1.51 0.02 0.00 1.34 0.00 0.00 72.50 72.31 1mm4 s THR 113 CO -0.02 0.51 -0.11 0.00 -0.54 0.00 0.00 174.62 174.46 1mm4 s ALA 114 N -0.29 1.47 -0.30 3.99 0.00 -1.26 -0.43 121.76 124.94 1mm4 s ALA 114 Ca 0.02 -0.61 -0.13 0.00 0.00 0.00 0.00 51.96 51.23 1mm4 s ALA 114 Cb -0.11 -0.85 0.17 0.00 0.00 0.00 0.00 23.12 22.33 1mm4 s ALA 114 CO 0.01 -0.24 0.96 -0.98 0.00 0.00 0.00 175.76 175.52 1mm4 s ARG 115 N 1.33 0.30 0.14 0.00 1.70 -1.26 -4.69 118.95 116.47 1mm4 s ARG 115 Ca -0.01 0.69 -0.25 0.00 -0.47 0.00 0.00 55.73 55.68 1mm4 s ARG 115 Cb -0.14 0.41 0.07 0.00 -0.57 0.00 0.00 34.95 34.72 1mm4 s ARG 115 CO -0.05 -0.17 1.00 0.34 -1.08 0.00 0.00 175.30 175.34 1mm4 s ASP 116 N 2.60 -0.14 -0.01 -2.89 2.15 -1.26 -5.00 116.67 112.11 1mm4 s ASP 116 Ca -0.00 -0.42 -0.02 0.00 0.43 0.00 0.00 52.55 52.54 1mm4 s ASP 116 Cb -0.08 0.46 -0.01 0.00 -0.30 0.00 0.00 42.92 43.00 1mm4 s ASP 116 CO -0.16 -0.86 -0.03 0.59 -0.17 0.00 0.00 175.17 174.53 1mm4 n ASN 117 N -0.56 0.20 0.01 -0.34 4.13 -1.26 -4.90 115.26 112.53 1mm4 n ASN 117 Ca -0.06 0.03 -0.01 0.00 1.68 0.00 0.00 54.58 56.23 1mm4 n ASN 117 Cb 0.61 -0.43 -0.00 0.00 -1.54 0.00 0.00 39.78 38.41 1mm4 n ASN 117 CO 0.00 0.00 0.00 -0.50 0.28 0.00 0.00 177.26 177.04 1mm4 h TRP 118 N -0.09 -0.04 -1.32 3.10 4.06 -2.09 -3.49 115.95 116.07 1mm4 h TRP 118 Ca 0.00 -0.00 0.14 0.00 2.06 0.00 0.00 58.89 61.08 1mm4 h TRP 118 Cb 0.09 0.01 -0.29 0.00 -1.00 0.00 0.00 29.16 27.98 1mm4 h TRP 118 CO -0.04 -0.03 0.69 1.21 -3.56 0.00 0.00 178.44 176.72 1mm4 s ASN 119 N -3.36 -0.24 0.06 -3.49 3.84 -1.26 -5.19 114.94 105.30 1mm4 s ASN 119 Ca -0.01 0.42 -0.28 0.00 0.21 0.00 0.00 52.86 53.20 1mm4 s ASN 119 Cb 0.00 0.41 0.09 0.00 -0.55 0.00 0.00 41.25 41.20 1mm4 s ASN 119 CO 0.02 -0.11 1.13 -0.47 -2.79 0.00 0.00 177.10 174.88 1mm4 s TYR 120 N -0.15 -0.09 -0.07 0.43 5.04 -1.26 -5.08 117.35 116.17 1mm4 s TYR 120 Ca 0.05 -0.11 -0.16 0.00 -2.44 0.00 0.00 57.07 54.42 1mm4 s TYR 120 Cb -0.04 0.59 -0.05 0.00 0.35 0.00 0.00 41.96 42.81 1mm4 s TYR 120 CO -0.09 -0.53 0.41 -1.50 -1.34 0.00 0.00 175.55 172.49 1mm4 s ILE 121 N -2.84 5.13 1.09 3.14 1.10 -1.26 -5.03 121.20 122.54 1mm4 s ILE 121 Ca 0.13 0.82 -0.17 0.00 -0.51 0.00 0.00 60.65 60.92 1mm4 s ILE 121 Cb 0.02 -3.73 0.10 0.00 0.15 0.00 0.00 42.46 39.00 1mm4 s ILE 121 CO -0.01 0.47 0.15 -0.81 -2.11 0.00 0.00 174.94 172.63 1mm4 n PRO 122 N 2.72 -1.36 -3.61 3.50 -0.04 -1.26 -4.95 135.00 130.00 1mm4 n PRO 122 Ca -0.11 -0.37 -0.39 0.00 -0.04 0.00 0.00 63.50 62.58 1mm4 n PRO 122 Cb 0.52 -1.76 -0.07 0.00 -0.04 0.00 0.00 33.50 32.15 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 -1.58 5.66 0.04 1.53 1.02 0.43 -4.92 118.68 120.87 1mm4 s LEU 123 Ca 0.57 -2.98 -0.30 0.00 0.02 0.00 0.00 54.13 51.44 1mm4 s LEU 123 Cb -0.15 -1.95 -0.04 0.00 0.02 0.00 0.00 46.19 44.07 1mm4 s LEU 123 CO 0.66 -0.38 1.04 -2.16 0.02 0.00 0.00 176.35 175.53 1mm4 s PRO 124 N -0.25 4.55 -0.07 1.29 0.04 -1.26 -2.59 135.00 136.70 1mm4 s PRO 124 Ca 0.19 1.54 -0.01 0.00 0.04 0.00 0.00 61.00 62.76 1mm4 s PRO 124 Cb -0.16 -3.41 0.03 0.00 0.04 0.00 0.00 34.50 31.00 1mm4 s PRO 124 CO -0.06 -0.05 -0.01 0.08 0.04 0.00 0.00 177.00 176.99 1mm4 s VAL 125 N 0.78 0.47 -0.06 -0.36 1.01 -0.76 -4.99 120.40 116.48 1mm4 s VAL 125 Ca 0.53 0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.52 1mm4 s VAL 125 Cb -0.24 -0.59 0.03 0.00 0.00 0.00 0.00 36.38 35.59 1mm4 s VAL 125 CO 0.29 0.26 0.06 -1.48 0.00 0.00 0.00 175.10 174.24 1mm4 s LEU 126 N 1.76 0.18 0.05 3.92 2.34 -1.26 -0.41 118.68 125.27 1mm4 s LEU 126 Ca 0.02 -0.03 -0.11 0.00 0.06 0.00 0.00 54.13 54.08 1mm4 s LEU 126 Cb -0.13 -0.16 0.01 0.00 -0.56 0.00 0.00 46.19 45.35 1mm4 s LEU 126 CO -0.05 -0.26 0.23 -0.76 -1.06 0.00 0.00 176.35 174.45 1mm4 s LEU 127 N 2.16 1.21 0.15 1.48 1.43 -1.06 -4.96 118.68 119.09 1mm4 s LEU 127 Ca 0.05 -0.37 -0.31 0.00 -1.03 0.00 0.00 54.13 52.46 1mm4 s LEU 127 Cb -0.13 1.11 -0.09 0.00 0.03 0.00 0.00 46.19 47.12 1mm4 s LEU 127 CO -0.04 -0.62 1.44 -2.16 0.23 0.00 0.00 176.35 175.21 1mm4 s PRO 128 N -2.86 4.29 0.39 1.29 0.04 -1.26 -2.40 135.00 134.49 1mm4 s PRO 128 Ca -0.03 2.19 0.06 0.00 0.04 0.00 0.00 61.00 63.26 1mm4 s PRO 128 Cb 0.00 -3.20 -0.07 0.00 0.04 0.00 0.00 34.50 31.27 1mm4 s PRO 128 CO -0.05 -0.47 0.02 -0.51 0.04 0.00 0.00 177.00 176.03 1mm4 s LEU 129 N 0.85 2.65 -0.18 -3.56 1.02 0.43 -2.61 118.68 117.28 1mm4 s LEU 129 Ca 0.65 -1.39 -0.08 0.00 0.02 0.00 0.00 54.13 53.33 1mm4 s LEU 129 Cb -0.39 -0.74 0.07 0.00 0.02 0.00 0.00 46.19 45.15 1mm4 s LEU 129 CO 0.33 -0.52 0.40 0.00 0.02 0.00 0.00 176.35 176.58 1mm4 s ALA 130 N -2.88 -1.06 0.27 4.21 0.00 0.18 -2.59 121.76 119.88 1mm4 s ALA 130 Ca 0.34 1.47 0.09 0.00 0.00 0.00 0.00 51.96 53.85 1mm4 s ALA 130 Cb 0.09 -1.13 -0.05 0.00 0.00 0.00 0.00 23.12 22.03 1mm4 s ALA 130 CO 0.17 -0.54 -0.13 -1.12 0.00 0.00 0.00 175.76 174.14 1mm4 s SER 131 N 2.07 3.11 -0.03 0.00 0.01 -1.06 -1.30 113.70 116.50 1mm4 s SER 131 Ca -0.05 -1.10 0.03 0.00 1.31 0.00 0.00 55.95 56.14 1mm4 s SER 131 Cb -0.10 -0.23 0.00 0.00 0.21 0.00 0.00 66.02 65.90 1mm4 s SER 131 CO -0.12 -0.16 -0.10 0.68 0.41 0.00 0.00 173.24 173.95 1mm4 s VAL 132 N -2.79 0.87 -0.38 3.43 -7.23 0.41 -1.57 120.40 113.14 1mm4 s VAL 132 Ca 0.28 -0.41 -0.18 0.00 -1.81 0.00 0.00 61.98 59.86 1mm4 s VAL 132 Cb -0.00 -0.77 0.01 0.00 0.56 0.00 0.00 36.38 36.18 1mm4 s VAL 132 CO 0.12 0.27 0.52 -0.83 -0.31 0.00 0.00 175.10 174.87 1mm4 s GLY 133 N 0.17 1.82 -0.13 2.32 0.00 0.44 -1.93 107.32 110.00 1mm4 s GLY 133 Ca -0.03 -1.15 -0.04 0.00 0.00 0.00 0.00 44.72 43.51 1mm4 s GLY 133 CO 0.01 1.29 0.14 -0.19 0.00 0.00 0.00 173.10 174.35 1mm4 s TYR 134 N 2.41 -0.07 0.00 1.90 2.02 -1.04 -2.05 117.35 120.52 1mm4 s TYR 134 Ca 0.18 0.23 0.00 0.00 -0.37 0.00 0.00 57.07 57.11 1mm4 s TYR 134 Cb -0.16 -0.43 0.00 0.00 -0.40 0.00 0.00 41.96 40.98 1mm4 s TYR 134 CO 0.14 -0.40 0.00 0.41 -1.57 0.00 0.00 175.55 174.13 1mm4 n GLY 135 N 5.31 1.03 0.00 0.71 0.00 -1.26 -2.56 105.19 108.42 1mm4 n GLY 135 Ca -0.05 -0.61 0.12 0.00 0.00 0.00 0.00 46.02 45.48 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 0.46 -4.30 1.61 -0.04 -1.26 -4.79 135.00 126.68 1mm4 n PRO 136 Ca 0.00 0.05 -0.26 0.00 -0.04 0.00 0.00 63.50 63.24 1mm4 n PRO 136 Cb 0.00 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 31.87 1mm4 n PRO 136 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1mm4 s VAL 137 N -2.41 3.19 -0.22 0.52 -7.23 -1.06 -3.40 120.40 109.79 1mm4 s VAL 137 Ca 0.26 -1.71 -0.02 0.00 -1.81 0.00 0.00 61.98 58.70 1mm4 s VAL 137 Cb 0.16 -2.59 0.07 0.00 0.56 0.00 0.00 36.38 34.58 1mm4 s VAL 137 CO 0.34 -0.14 0.04 -0.89 -0.31 0.00 0.00 175.10 174.14 1mm4 s THR 138 N -1.79 0.59 0.44 5.32 2.01 -0.52 -2.50 115.64 119.20 1mm4 s THR 138 Ca 0.26 -0.72 -0.23 0.00 0.31 0.00 0.00 61.69 61.30 1mm4 s THR 138 Cb -0.08 -1.16 -0.08 0.00 0.01 0.00 0.00 72.50 71.19 1mm4 s THR 138 CO 0.16 -0.29 1.14 0.12 -0.69 0.00 0.00 174.62 175.05 1mm4 s PHE 139 N 1.81 2.99 0.09 4.92 2.19 -0.81 -2.08 117.98 127.09 1mm4 s PHE 139 Ca 0.01 1.56 0.01 0.00 0.33 0.00 0.00 56.93 58.84 1mm4 s PHE 139 Cb -0.17 -3.33 -0.04 0.00 -1.31 0.00 0.00 43.02 38.17 1mm4 s PHE 139 CO -0.12 -1.29 -0.06 -1.14 1.83 0.00 0.00 175.22 174.45 1mm4 s GLN 140 N -2.60 0.82 0.04 10.12 0.74 -0.28 -0.44 119.66 128.05 1mm4 s GLN 140 Ca 0.61 -1.33 -0.27 0.00 0.05 0.00 0.00 55.36 54.43 1mm4 s GLN 140 Cb -0.27 -0.17 0.09 0.00 1.10 0.00 0.00 33.01 33.76 1mm4 s GLN 140 CO 0.34 -0.03 0.77 -1.64 -0.55 0.00 0.00 175.29 174.18 1mm4 s MET 141 N -3.84 1.00 -0.07 1.67 -1.94 -0.42 -2.23 119.30 113.48 1mm4 s MET 141 Ca 0.12 -0.29 0.01 0.00 -1.71 0.00 0.00 55.69 53.81 1mm4 s MET 141 Cb 0.06 0.46 0.02 0.00 2.01 0.00 0.00 34.83 37.38 1mm4 s MET 141 CO -0.05 -0.42 -0.06 0.99 -0.01 0.00 0.00 175.02 175.46 1mm4 s THR 142 N -3.07 0.78 -0.10 2.05 2.01 -0.74 -0.65 115.64 115.92 1mm4 s THR 142 Ca 0.02 -0.22 -0.10 0.00 0.31 0.00 0.00 61.69 61.70 1mm4 s THR 142 Cb -0.01 -0.79 0.03 0.00 0.01 0.00 0.00 72.50 71.74 1mm4 s THR 142 CO -0.08 0.30 0.29 -0.72 -0.69 0.00 0.00 174.62 173.71 1mm4 s TYR 143 N 1.18 -0.30 -0.42 4.92 -0.85 -1.07 -2.59 117.35 118.21 1mm4 s TYR 143 Ca -0.06 0.73 -0.20 0.00 -0.52 0.00 0.00 57.07 57.02 1mm4 s TYR 143 Cb -0.14 0.11 0.02 0.00 0.38 0.00 0.00 41.96 42.32 1mm4 s TYR 143 CO -0.02 -0.17 0.60 0.42 -1.52 0.00 0.00 175.55 174.86 1mm4 s ILE 144 N 0.02 4.89 0.90 -3.49 1.09 -1.26 -4.45 121.20 118.89 1mm4 s ILE 144 Ca -0.01 0.10 -0.14 0.00 -1.10 0.00 0.00 60.65 59.50 1mm4 s ILE 144 Cb -0.02 -4.15 0.00 0.00 -1.06 0.00 0.00 42.46 37.22 1mm4 s ILE 144 CO 0.01 -0.52 0.33 -2.65 -0.10 0.00 0.00 174.94 172.00 1mm4 n PRO 145 N 6.11 -0.13 0.00 2.79 -0.02 -1.26 -4.77 135.00 137.72 1mm4 n PRO 145 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 1mm4 n PRO 145 Cb 0.48 -1.77 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1mm4 n PRO 145 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mm4 n GLY 146 N 1.71 -1.00 3.63 -1.23 0.00 -1.26 -5.06 105.19 101.99 1mm4 n GLY 146 Ca 0.07 -1.97 -0.04 0.00 0.00 0.00 0.00 46.02 44.08 1mm4 n GLY 146 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1mm4 s THR 147 N 0.00 0.00 0.00 2.61 -1.32 -1.26 -5.04 115.64 110.63 1mm4 s THR 147 Ca 0.00 0.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.48 1mm4 s THR 147 Cb 0.00 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 1mm4 s THR 147 CO 0.00 0.00 0.00 0.00 -2.21 0.00 0.00 174.62 172.41 1mm4 n TYR 148 N 0.90 -0.09 0.10 9.09 9.36 -1.26 -5.06 117.16 130.20 1mm4 n TYR 148 Ca -0.05 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.17 1mm4 n TYR 148 Cb 0.58 0.37 0.00 0.00 -0.63 0.00 0.00 39.34 39.66 1mm4 n TYR 148 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37 1mm4 n ASN 149 N -2.23 -1.80 -0.11 2.98 5.15 -1.26 -4.99 115.26 113.00 1mm4 n ASN 149 Ca 0.00 0.42 -0.14 0.00 -0.60 0.00 0.00 54.58 54.26 1mm4 n ASN 149 Cb 0.00 1.92 -0.14 0.00 -0.53 0.00 0.00 39.78 41.03 1mm4 n ASN 149 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 1mm4 n ASN 150 N -2.86 1.10 0.00 1.20 3.02 -1.26 -5.02 115.26 111.44 1mm4 n ASN 150 Ca 0.00 -0.07 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 1mm4 n ASN 150 Cb 0.00 0.27 0.00 0.00 -0.61 0.00 0.00 39.78 39.44 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 2.04 0.93 7.00 7.41 0.00 -1.26 -4.94 105.19 116.37 1mm4 n GLY 151 Ca -0.39 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.11 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 1.07 -5.53 -4.56 1.61 4.05 -1.26 -4.73 115.26 105.90 1mm4 n ASN 152 Ca 0.00 0.00 -0.34 0.00 0.45 0.00 0.00 54.58 54.69 1mm4 n ASN 152 Cb 0.15 0.00 -0.11 0.00 1.23 0.00 0.00 39.78 41.05 1mm4 n ASN 152 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 1mm4 s VAL 153 N 0.00 4.28 0.21 3.44 -7.23 -1.26 -5.09 120.40 114.75 1mm4 s VAL 153 Ca 0.00 -0.22 -0.30 0.00 -1.81 0.00 0.00 61.98 59.65 1mm4 s VAL 153 Cb 0.00 -2.89 -0.08 0.00 0.56 0.00 0.00 36.38 33.96 1mm4 s VAL 153 CO 0.00 0.49 1.16 -0.31 -0.31 0.00 0.00 175.10 176.13 1mm4 s TYR 154 N 0.29 3.48 -0.11 2.82 1.51 -1.26 -4.97 117.35 119.11 1mm4 s TYR 154 Ca -0.00 1.52 -0.04 0.00 -1.01 0.00 0.00 57.07 57.53 1mm4 s TYR 154 Cb -0.13 -3.38 -0.04 0.00 -0.11 0.00 0.00 41.96 38.30 1mm4 s TYR 154 CO 0.02 -0.97 0.04 -0.06 -1.11 0.00 0.00 175.55 173.46 1mm4 s PHE 155 N -0.37 3.26 -0.13 2.71 0.08 -1.07 -5.00 117.98 117.46 1mm4 s PHE 155 Ca 0.50 0.23 -0.02 0.00 0.12 0.00 0.00 56.93 57.75 1mm4 s PHE 155 Cb -0.32 -1.87 -0.03 0.00 -0.57 0.00 0.00 43.02 40.23 1mm4 s PHE 155 CO 0.38 0.46 -0.04 0.00 -0.10 0.00 0.00 175.22 175.92 1mm4 s ALA 156 N -0.68 3.03 0.06 5.36 0.00 -1.26 -1.79 121.76 126.48 1mm4 s ALA 156 Ca 0.11 -0.83 0.00 0.00 0.00 0.00 0.00 51.96 51.24 1mm4 s ALA 156 Cb -0.12 -1.47 -0.04 0.00 0.00 0.00 0.00 23.12 21.50 1mm4 s ALA 156 CO 0.02 0.35 -0.04 -1.58 0.00 0.00 0.00 175.76 174.51 1mm4 s TRP 157 N -0.07 0.58 0.05 0.00 0.52 -0.94 -3.96 118.94 115.12 1mm4 s TRP 157 Ca 0.02 -0.87 0.03 0.00 0.02 0.00 0.00 56.10 55.30 1mm4 s TRP 157 Cb -0.13 -0.39 -0.03 0.00 -1.15 0.00 0.00 33.47 31.78 1mm4 s TRP 157 CO 0.03 -0.25 -0.10 1.41 0.02 0.00 0.00 176.95 178.05 1mm4 s MET 158 N -3.20 0.63 -0.18 4.98 1.75 -0.99 -1.13 119.30 121.16 1mm4 s MET 158 Ca 0.02 -0.82 -0.09 0.00 -1.25 0.00 0.00 55.69 53.55 1mm4 s MET 158 Cb 0.02 -0.48 0.07 0.00 2.84 0.00 0.00 34.83 37.28 1mm4 s MET 158 CO -0.06 0.10 0.42 -0.98 -0.65 0.00 0.00 175.02 173.85 1mm4 s ARG 159 N -1.63 0.39 0.01 4.11 1.70 -0.88 -2.52 118.95 120.12 1mm4 s ARG 159 Ca -0.07 0.85 -0.02 0.00 -0.47 0.00 0.00 55.73 56.02 1mm4 s ARG 159 Cb -0.10 0.04 -0.04 0.00 -0.57 0.00 0.00 34.95 34.28 1mm4 s ARG 159 CO 0.01 -0.18 0.17 -0.06 -1.08 0.00 0.00 175.30 174.16 1mm4 s PHE 160 N 1.63 3.49 -0.14 5.89 0.40 -1.07 -1.43 117.98 126.74 1mm4 s PHE 160 Ca -0.08 0.30 -0.02 0.00 -0.60 0.00 0.00 56.93 56.53 1mm4 s PHE 160 Cb -0.09 -1.79 -0.02 0.00 0.51 0.00 0.00 43.02 41.62 1mm4 s PHE 160 CO -0.13 0.62 -0.07 -0.65 0.70 0.00 0.00 175.22 175.69 1mm4 s GLN 161 N -2.04 3.56 -0.03 0.44 -0.21 -1.22 -2.09 119.66 118.08 1mm4 s GLN 161 Ca 0.28 -0.57 0.06 0.00 0.02 0.00 0.00 55.36 55.15 1mm4 s GLN 161 Cb -0.13 -2.82 -0.01 0.00 1.00 0.00 0.00 33.01 31.06 1mm4 s GLN 161 CO 0.20 0.24 -0.20 0.12 -2.12 0.00 0.00 175.29 173.53 1mm4 s PHE 162 N 0.33 1.86 0.21 0.91 5.36 -0.88 -4.91 117.98 120.86 1mm4 s PHE 162 Ca -0.06 -0.41 -0.12 0.00 -0.96 0.00 0.00 56.93 55.38 1mm4 s PHE 162 Cb -0.15 -1.21 -0.00 0.00 -0.34 0.00 0.00 43.02 41.32 1mm4 s PHE 162 CO 0.04 -0.08 0.42 -0.48 -1.46 0.00 0.00 175.22 173.65 1mm4 s LEU 163 N -0.33 0.49 -0.48 6.12 2.34 -1.26 -2.59 118.68 122.98 1mm4 s LEU 163 Ca 0.04 -0.87 0.03 0.00 0.06 0.00 0.00 54.13 53.39 1mm4 s LEU 163 Cb -0.09 1.60 0.13 0.00 -0.56 0.00 0.00 46.19 47.27 1mm4 s LEU 163 CO 0.00 -1.05 0.26 -1.83 -1.06 0.00 0.00 176.35 172.67 1mm4 s GLU 164 N -3.99 1.58 -0.28 1.48 -1.05 -1.26 -5.06 118.70 110.11 1mm4 s GLU 164 Ca 0.20 -2.28 -0.26 0.00 -0.15 0.00 0.00 54.97 52.47 1mm4 s GLU 164 Cb 0.01 -2.72 0.18 0.00 -0.44 0.00 0.00 34.13 31.15 1mm4 s GLU 164 CO 0.05 -1.15 1.33 -1.58 0.95 0.00 0.00 175.26 174.86 1mm4 s HIS 165 N 0.05 -0.13 0.01 4.83 2.46 -1.26 -5.09 115.29 116.16 1mm4 s HIS 165 Ca 0.18 0.30 -0.03 0.00 0.47 0.00 0.00 55.06 55.98 1mm4 s HIS 165 Cb -0.24 0.47 -0.01 0.00 -0.13 0.00 0.00 32.58 32.66 1mm4 s HIS 165 CO -0.01 -0.08 -0.06 1.58 -2.47 0.00 0.00 174.74 173.70 1mm4 n HIS 166 N 1.33 0.00 -3.10 3.88 -0.00 -1.26 -5.03 115.22 111.05 1mm4 n HIS 166 Ca -0.08 0.00 -0.22 0.00 0.46 0.00 0.00 57.72 57.88 1mm4 n HIS 166 Cb 0.57 -0.12 0.04 0.00 -0.12 0.00 0.00 29.99 30.36 1mm4 n HIS 166 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1mm4 n HIS 167 N -3.51 -2.07 -3.52 1.57 -0.00 -1.26 -4.98 115.22 101.43 1mm4 n HIS 167 Ca -0.05 0.60 -0.18 0.00 0.46 0.00 0.00 57.72 58.54 1mm4 n HIS 167 Cb 0.27 -4.50 -0.13 0.00 -0.12 0.00 0.00 29.99 25.50 1mm4 n HIS 167 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 1mm4 s HIS 168 N -3.19 -0.26 -0.23 1.57 5.04 -1.26 -5.02 115.29 111.93 1mm4 s HIS 168 Ca 0.35 0.29 -0.08 0.00 -1.54 0.00 0.00 55.06 54.08 1mm4 s HIS 168 Cb -0.15 -0.34 0.03 0.00 0.04 0.00 0.00 32.58 32.16 1mm4 s HIS 168 CO 0.43 -0.55 0.15 0.72 -2.34 0.00 0.00 174.74 173.15 1mm4 n HIS 169 N 5.32 -4.27 -0.76 3.88 8.25 -1.26 -5.28 115.22 121.10 1mm4 n HIS 169 Ca -0.05 2.27 0.00 0.00 -0.26 0.00 0.00 57.72 59.67 1mm4 n HIS 169 Cb 0.50 -3.94 0.00 0.00 1.12 0.00 0.00 29.99 27.66 1mm4 n HIS 169 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56