#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 1.13 0.65 6.12 0.01 -1.26 -4.99 114.94 116.60 1mm4 s ASN 2 Ca 0.00 -0.99 0.39 0.00 -0.71 0.00 0.00 52.86 51.55 1mm4 s ASN 2 Cb 0.00 0.69 2.15 0.00 0.41 0.00 0.00 41.25 44.50 1mm4 s ASN 2 CO 0.00 -0.33 2.25 0.00 -1.51 0.00 0.00 177.10 177.51 1mm4 h ALA 3 N 7.76 1.19 0.11 0.60 0.00 -2.05 0.15 119.26 127.02 1mm4 h ALA 3 Ca -0.05 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.85 1mm4 h ALA 3 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1mm4 h ALA 3 CO 0.26 -0.09 -0.05 -0.44 0.00 0.00 0.00 179.25 178.93 1mm4 h ASP 4 N 0.00 -0.12 0.40 0.00 5.19 -1.99 -2.33 116.42 117.57 1mm4 h ASP 4 Ca 0.01 -0.25 -0.03 0.00 -0.62 0.00 0.00 57.03 56.13 1mm4 h ASP 4 Cb 0.18 0.03 -0.00 0.00 0.18 0.00 0.00 39.33 39.71 1mm4 h ASP 4 CO -0.00 0.47 -0.16 -0.08 -3.12 0.00 0.00 179.24 176.34 1mm4 h GLU 5 N -0.99 0.00 -0.08 3.56 4.57 -1.89 -2.45 114.58 117.29 1mm4 h GLU 5 Ca -0.01 0.00 -0.10 0.00 -1.18 0.00 0.00 59.36 58.07 1mm4 h GLU 5 Cb 0.36 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.96 1mm4 h GLU 5 CO 0.02 0.16 -0.33 -1.49 -1.18 0.00 0.00 179.01 176.20 1mm4 h TRP 6 N 0.00 0.50 -0.35 0.92 -0.00 -0.80 -2.64 115.95 113.57 1mm4 h TRP 6 Ca -0.00 -0.21 -0.01 0.00 -0.00 0.00 0.00 58.89 58.67 1mm4 h TRP 6 Cb 0.41 -0.08 -0.02 0.00 -0.00 0.00 0.00 29.16 29.47 1mm4 h TRP 6 CO 0.00 0.94 0.19 0.52 -0.00 0.00 0.00 178.44 180.10 1mm4 h MET 7 N -0.09 0.50 -0.87 0.49 2.86 -1.16 0.38 114.93 117.03 1mm4 h MET 7 Ca -0.02 -0.06 0.01 0.00 -2.06 0.00 0.00 59.70 57.57 1mm4 h MET 7 Cb 0.97 -0.10 -0.04 0.00 0.06 0.00 0.00 31.60 32.49 1mm4 h MET 7 CO 0.07 0.42 0.57 1.79 1.06 0.00 0.00 176.91 180.82 1mm4 h THR 8 N 0.44 1.21 0.02 2.22 1.35 -1.51 -2.03 112.91 114.61 1mm4 h THR 8 Ca 0.12 -0.40 -0.21 0.00 -0.55 0.00 0.00 66.41 65.38 1mm4 h THR 8 Cb 0.07 -0.05 -0.02 0.00 -1.73 0.00 0.00 68.15 66.41 1mm4 h THR 8 CO -0.02 0.21 -0.95 0.71 -0.25 0.00 0.00 175.52 175.22 1mm4 h THR 9 N 1.16 1.60 -0.45 6.82 1.35 -1.10 -3.24 112.91 119.05 1mm4 h THR 9 Ca 0.32 -3.00 -0.04 0.00 -0.55 0.00 0.00 66.41 63.14 1mm4 h THR 9 Cb -0.11 2.67 -0.02 0.00 -1.73 0.00 0.00 68.15 68.96 1mm4 h THR 9 CO -0.07 0.86 0.12 -0.26 -0.25 0.00 0.00 175.52 175.92 1mm4 h PHE 10 N 0.04 0.67 -0.30 4.73 -1.00 0.43 -2.17 116.94 119.34 1mm4 h PHE 10 Ca -0.04 -0.05 0.01 0.00 2.81 0.00 0.00 57.97 60.71 1mm4 h PHE 10 Cb 1.64 -0.20 -0.02 0.00 3.61 0.00 0.00 35.95 40.98 1mm4 h PHE 10 CO 0.02 0.57 0.20 -0.09 -1.61 0.00 0.00 178.31 177.39 1mm4 h ARG 11 N 0.65 0.35 -0.07 1.51 2.43 -1.42 -0.89 114.38 116.94 1mm4 h ARG 11 Ca 0.15 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 59.21 1mm4 h ARG 11 Cb 0.22 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.68 1mm4 h ARG 11 CO -0.01 0.23 -0.35 0.93 -1.51 0.00 0.00 179.97 179.26 1mm4 h GLU 12 N 0.36 0.13 0.02 0.20 3.07 -1.52 0.00 114.58 116.86 1mm4 h GLU 12 Ca 0.12 -0.05 -0.14 0.00 -0.50 0.00 0.00 59.36 58.78 1mm4 h GLU 12 Cb 0.02 -0.01 0.01 0.00 -0.84 0.00 0.00 28.75 27.94 1mm4 h GLU 12 CO -0.03 0.47 -0.57 -0.97 -1.40 0.00 0.00 179.01 176.52 1mm4 h ASN 13 N 0.12 0.46 -0.44 1.42 -0.73 -1.19 -2.42 115.58 112.79 1mm4 h ASN 13 Ca 0.01 -0.80 -0.12 0.00 1.87 0.00 0.00 56.30 57.26 1mm4 h ASN 13 Cb 0.69 -0.14 -0.02 0.00 0.27 0.00 0.00 38.32 39.12 1mm4 h ASN 13 CO 0.05 1.21 -0.17 0.40 -0.37 0.00 0.00 177.43 178.55 1mm4 h ILE 14 N -0.23 1.27 -0.04 2.57 1.08 -1.28 -2.78 117.51 118.09 1mm4 h ILE 14 Ca -0.08 -1.31 -0.11 0.00 -0.39 0.00 0.00 64.86 62.97 1mm4 h ILE 14 Cb 1.32 1.08 -0.01 0.00 -3.07 0.00 0.00 36.82 36.13 1mm4 h ILE 14 CO 0.11 0.45 -0.46 0.00 -0.69 0.00 0.00 178.15 177.56 1mm4 h ALA 15 N 0.98 1.15 -0.05 1.87 0.00 -1.08 -0.70 119.26 121.43 1mm4 h ALA 15 Ca 0.12 -0.43 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1mm4 h ALA 15 Cb 0.72 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 1mm4 h ALA 15 CO 0.06 0.60 0.01 0.37 0.00 0.00 0.00 179.25 180.28 1mm4 h GLN 16 N 0.08 0.08 -0.03 0.00 4.15 -1.22 -2.64 115.11 115.54 1mm4 h GLN 16 Ca 0.00 -0.02 -0.15 0.00 0.77 0.00 0.00 58.65 59.25 1mm4 h GLN 16 Cb 0.85 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.52 1mm4 h GLN 16 CO 0.06 0.32 -0.66 1.79 -1.93 0.00 0.00 178.83 178.41 1mm4 h THR 17 N -0.18 1.44 -0.20 2.39 1.35 -1.46 -1.09 112.91 115.16 1mm4 h THR 17 Ca 0.01 -2.18 -0.01 0.00 -0.55 0.00 0.00 66.41 63.69 1mm4 h THR 17 Cb 0.28 2.15 -0.01 0.00 -1.73 0.00 0.00 68.15 68.84 1mm4 h THR 17 CO 0.00 0.63 0.08 -0.25 -0.25 0.00 0.00 175.52 175.73 1mm4 h TRP 18 N 0.08 0.26 0.00 4.73 2.91 -1.04 -3.28 115.95 119.62 1mm4 h TRP 18 Ca -0.01 -0.00 -0.01 0.00 1.13 0.00 0.00 58.89 59.99 1mm4 h TRP 18 Cb 1.18 -0.09 -0.00 0.00 -0.51 0.00 0.00 29.16 29.74 1mm4 h TRP 18 CO 0.01 0.21 -0.65 1.04 -1.03 0.00 0.00 178.44 178.02 1mm4 n GLN 19 N -4.46 0.47 -2.48 2.65 6.02 -1.00 -4.95 117.38 113.63 1mm4 n GLN 19 Ca -0.00 0.47 -0.35 0.00 -0.01 0.00 0.00 57.00 57.11 1mm4 n GLN 19 Cb 0.12 -1.65 -0.03 0.00 1.02 0.00 0.00 30.24 29.70 1mm4 n GLN 19 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 1mm4 s GLN 20 N -2.37 3.86 1.13 -1.09 -0.21 -0.42 -5.02 119.66 115.53 1mm4 s GLN 20 Ca -0.18 1.48 -0.17 0.00 0.02 0.00 0.00 55.36 56.50 1mm4 s GLN 20 Cb 0.03 -2.26 0.18 0.00 1.00 0.00 0.00 33.01 31.96 1mm4 s GLN 20 CO 0.27 -0.40 0.29 -2.30 -2.12 0.00 0.00 175.29 171.04 1mm4 n PRO 21 N -0.67 -2.39 -1.21 2.91 -0.02 -1.26 -4.57 135.00 127.79 1mm4 n PRO 21 Ca 0.08 -0.70 -0.04 0.00 -2.02 0.00 0.00 63.50 60.82 1mm4 n PRO 21 Cb 0.51 -1.65 -0.02 0.00 -0.02 0.00 0.00 33.50 32.32 1mm4 n PRO 21 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1mm4 n GLU 22 N -2.58 0.23 -2.03 -0.52 2.13 -1.26 -4.91 120.64 111.70 1mm4 n GLU 22 Ca 0.04 -0.78 -0.39 0.00 0.66 0.00 0.00 57.16 56.70 1mm4 n GLU 22 Cb 0.51 0.46 0.00 0.00 0.27 0.00 0.00 31.44 32.68 1mm4 n GLU 22 CO 0.00 0.00 0.00 -1.01 -0.41 0.00 0.00 177.13 175.71 1mm4 s HIS 23 N 0.02 2.73 -0.46 4.31 3.76 -1.26 -4.87 115.29 119.52 1mm4 s HIS 23 Ca 0.02 1.41 -0.16 0.00 -0.15 0.00 0.00 55.06 56.17 1mm4 s HIS 23 Cb 0.08 -3.66 0.06 0.00 1.11 0.00 0.00 32.58 30.16 1mm4 s HIS 23 CO -0.02 -2.17 0.43 -0.47 -0.85 0.00 0.00 174.74 171.67 1mm4 s TYR 24 N -1.30 3.19 -0.10 1.40 5.04 -0.81 -4.46 117.35 120.31 1mm4 s TYR 24 Ca 0.60 -0.73 -0.04 0.00 -2.44 0.00 0.00 57.07 54.46 1mm4 s TYR 24 Cb -0.37 -3.12 -0.04 0.00 0.35 0.00 0.00 41.96 38.78 1mm4 s TYR 24 CO 0.47 -0.80 0.06 0.34 -1.34 0.00 0.00 175.55 174.28 1mm4 s ASP 25 N 2.38 5.72 -0.12 4.32 -1.08 -0.90 -0.43 116.67 126.56 1mm4 s ASP 25 Ca 0.07 0.28 -0.03 0.00 -0.52 0.00 0.00 52.55 52.35 1mm4 s ASP 25 Cb -0.22 -1.73 0.05 0.00 -1.46 0.00 0.00 42.92 39.56 1mm4 s ASP 25 CO 0.09 0.39 0.07 -0.22 0.52 0.00 0.00 175.17 176.01 1mm4 s LEU 26 N -0.91 0.40 -0.23 -1.34 2.96 -0.35 -2.49 118.68 116.71 1mm4 s LEU 26 Ca 0.14 -0.37 -0.11 0.00 -0.22 0.00 0.00 54.13 53.57 1mm4 s LEU 26 Cb -0.12 -0.27 -0.05 0.00 0.50 0.00 0.00 46.19 46.26 1mm4 s LEU 26 CO 0.03 -0.30 0.19 -0.31 -1.32 0.00 0.00 176.35 174.64 1mm4 s TYR 27 N 2.10 3.34 -0.09 5.38 1.51 -0.83 -2.10 117.35 126.66 1mm4 s TYR 27 Ca 0.03 0.29 -0.28 0.00 -1.01 0.00 0.00 57.07 56.10 1mm4 s TYR 27 Cb -0.15 -2.28 0.06 0.00 -0.11 0.00 0.00 41.96 39.48 1mm4 s TYR 27 CO -0.07 0.09 0.64 0.96 -1.11 0.00 0.00 175.55 176.06 1mm4 s ILE 28 N 0.98 0.01 0.38 2.71 -4.36 -1.07 -1.74 121.20 118.11 1mm4 s ILE 28 Ca 0.09 -0.05 -0.05 0.00 -0.26 0.00 0.00 60.65 60.38 1mm4 s ILE 28 Cb -0.13 -0.94 0.08 0.00 1.25 0.00 0.00 42.46 42.72 1mm4 s ILE 28 CO 0.04 -0.03 0.19 -2.65 0.24 0.00 0.00 174.94 172.73 1mm4 n PRO 29 N 1.35 -1.34 -3.20 0.37 -0.02 -1.26 -1.58 135.00 129.32 1mm4 n PRO 29 Ca -0.18 -0.32 -0.24 0.00 -2.02 0.00 0.00 63.50 60.74 1mm4 n PRO 29 Cb 0.57 -0.52 -0.07 0.00 -0.02 0.00 0.00 33.50 33.45 1mm4 n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mm4 n ALA 30 N -2.96 2.48 -2.28 3.55 0.00 -1.26 -4.07 120.51 115.96 1mm4 n ALA 30 Ca -0.04 -3.44 -0.12 0.00 0.00 0.00 0.00 53.44 49.84 1mm4 n ALA 30 Cb 0.13 -0.81 -0.10 0.00 0.00 0.00 0.00 19.45 18.67 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 -1.21 0.87 0.33 0.00 -1.09 -1.26 -5.04 121.20 113.79 1mm4 s ILE 31 Ca 0.35 -1.88 0.03 0.00 -2.23 0.00 0.00 60.65 56.92 1mm4 s ILE 31 Cb 0.17 -1.62 -0.05 0.00 -1.58 0.00 0.00 42.46 39.37 1mm4 s ILE 31 CO -0.11 -0.76 0.08 0.42 -1.23 0.00 0.00 174.94 173.35 1mm4 s THR 32 N -3.23 0.90 0.22 2.92 -4.23 -1.26 -5.17 115.64 105.79 1mm4 s THR 32 Ca 0.11 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.56 1mm4 s THR 32 Cb 0.02 -2.66 -0.02 0.00 1.34 0.00 0.00 72.50 71.18 1mm4 s THR 32 CO -0.02 0.00 0.27 0.86 -0.54 0.00 0.00 174.62 175.19 1mm4 s TRP 33 N -3.39 0.81 -0.43 3.99 -0.00 -1.26 -5.01 118.94 113.64 1mm4 s TRP 33 Ca 0.34 -1.09 -0.15 0.00 -0.00 0.00 0.00 56.10 55.20 1mm4 s TRP 33 Cb 0.07 -0.24 0.02 0.00 -0.00 0.00 0.00 33.47 33.32 1mm4 s TRP 33 CO 0.15 -0.78 0.59 0.72 -0.00 0.00 0.00 176.95 177.63 1mm4 n HIS 34 N -0.31 -3.41 -1.49 5.86 8.25 -1.26 -4.99 115.22 117.88 1mm4 n HIS 34 Ca 0.00 1.37 -0.31 0.00 -0.26 0.00 0.00 57.72 58.53 1mm4 n HIS 34 Cb 0.64 -4.04 0.07 0.00 1.12 0.00 0.00 29.99 27.78 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 -2.59 2.41 -0.06 -1.41 0.00 -1.26 -5.02 121.76 113.83 1mm4 s ALA 35 Ca 0.24 0.02 -0.02 0.00 0.00 0.00 0.00 51.96 52.19 1mm4 s ALA 35 Cb -0.07 -3.17 -0.01 0.00 0.00 0.00 0.00 23.12 19.87 1mm4 s ALA 35 CO 0.75 -1.54 0.12 0.00 0.00 0.00 0.00 175.76 175.10 1mm4 h ARG 36 N -0.95 -0.08 -7.22 0.00 3.08 -2.06 -3.46 114.38 103.69 1mm4 h ARG 36 Ca -0.45 0.01 -0.52 0.00 0.07 0.00 0.00 59.98 59.09 1mm4 h ARG 36 Cb 1.24 0.02 0.13 0.00 0.08 0.00 0.00 29.97 31.44 1mm4 h ARG 36 CO 0.56 -0.05 0.36 -0.06 -1.07 0.00 0.00 179.97 179.71 1mm4 s PHE 37 N -1.71 2.33 -0.45 3.04 0.40 -1.26 -4.99 117.98 115.34 1mm4 s PHE 37 Ca -0.01 1.59 -0.16 0.00 -0.60 0.00 0.00 56.93 57.75 1mm4 s PHE 37 Cb 0.00 -3.27 0.05 0.00 0.51 0.00 0.00 43.02 40.32 1mm4 s PHE 37 CO 0.04 -2.11 0.40 0.00 0.70 0.00 0.00 175.22 174.25 1mm4 s ALA 38 N -2.34 3.50 1.12 5.36 0.00 -1.26 -5.07 121.76 123.07 1mm4 s ALA 38 Ca 0.68 -1.89 -0.12 0.00 0.00 0.00 0.00 51.96 50.63 1mm4 s ALA 38 Cb -0.23 -3.05 0.26 0.00 0.00 0.00 0.00 23.12 20.10 1mm4 s ALA 38 CO 0.46 -1.66 1.05 0.71 0.00 0.00 0.00 175.76 176.32 1mm4 s TYR 39 N 1.81 1.39 0.21 0.00 1.51 -1.26 -5.04 117.35 115.97 1mm4 s TYR 39 Ca 0.06 1.32 0.07 0.00 -1.01 0.00 0.00 57.07 57.51 1mm4 s TYR 39 Cb -0.21 -3.15 -0.04 0.00 -0.11 0.00 0.00 41.96 38.45 1mm4 s TYR 39 CO 0.09 -3.68 0.13 0.34 -1.11 0.00 0.00 175.55 171.32 1mm4 s ASP 40 N -2.53 5.31 -0.17 2.29 2.15 -1.26 -4.90 116.67 117.57 1mm4 s ASP 40 Ca 0.68 -0.27 -0.11 0.00 0.43 0.00 0.00 52.55 53.28 1mm4 s ASP 40 Cb -0.25 -1.30 0.04 0.00 -0.30 0.00 0.00 42.92 41.11 1mm4 s ASP 40 CO 0.63 0.02 0.23 0.29 -0.17 0.00 0.00 175.17 176.18 1mm4 n LYS 41 N -0.69 -4.61 -2.93 4.34 4.76 -1.26 -4.94 118.16 112.84 1mm4 n LYS 41 Ca -0.08 3.46 -0.40 0.00 -2.87 0.00 0.00 58.31 58.41 1mm4 n LYS 41 Cb 0.56 -4.98 -0.04 0.00 -1.84 0.00 0.00 35.03 28.74 1mm4 n LYS 41 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1mm4 s GLU 42 N -0.68 4.48 0.00 1.97 2.02 -1.26 -4.92 118.70 120.31 1mm4 s GLU 42 Ca -0.26 1.07 0.00 0.00 0.02 0.00 0.00 54.97 55.79 1mm4 s GLU 42 Cb 0.02 -3.44 0.00 0.00 0.10 0.00 0.00 34.13 30.81 1mm4 s GLU 42 CO 0.71 0.05 0.00 1.17 0.02 0.00 0.00 175.26 177.21 1mm4 n LYS 43 N 3.71 0.00 0.12 1.61 3.00 -1.26 -4.75 118.16 120.58 1mm4 n LYS 43 Ca 0.01 0.00 -0.03 0.00 -0.00 0.00 0.00 58.31 58.29 1mm4 n LYS 43 Cb 0.51 -0.65 0.15 0.00 0.00 0.00 0.00 35.03 35.04 1mm4 n LYS 43 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.40 179.19 1mm4 h THR 44 N 0.00 1.43 0.00 3.15 1.35 -2.03 -3.46 112.91 113.35 1mm4 h THR 44 Ca 0.00 -2.10 0.00 0.00 -0.55 0.00 0.00 66.41 63.76 1mm4 h THR 44 Cb 0.93 2.11 0.00 0.00 -1.73 0.00 0.00 68.15 69.46 1mm4 h THR 44 CO 0.00 0.61 0.00 0.47 -0.25 0.00 0.00 175.52 176.35 1mm4 n ASP 45 N -3.82 0.00 -4.89 5.36 8.00 -1.26 -4.68 116.55 115.26 1mm4 n ASP 45 Ca -0.02 0.00 -0.33 0.00 0.71 0.00 0.00 54.79 55.15 1mm4 n ASP 45 Cb 0.62 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.67 1mm4 n ASP 45 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1mm4 s ARG 46 N 0.00 3.59 -0.06 -1.24 3.00 -1.26 -5.10 118.95 117.88 1mm4 s ARG 46 Ca 0.00 -0.09 0.03 0.00 0.00 0.00 0.00 55.73 55.67 1mm4 s ARG 46 Cb 0.00 -3.02 0.01 0.00 0.00 0.00 0.00 34.95 31.94 1mm4 s ARG 46 CO 0.00 0.60 -0.14 1.52 0.00 0.00 0.00 175.30 177.27 1mm4 s TYR 47 N -1.41 1.59 0.26 -0.53 1.13 -1.26 -5.14 117.35 111.98 1mm4 s TYR 47 Ca 0.32 -0.55 0.11 0.00 -1.41 0.00 0.00 57.07 55.53 1mm4 s TYR 47 Cb -0.13 -1.12 -0.05 0.00 -1.10 0.00 0.00 41.96 39.56 1mm4 s TYR 47 CO 0.19 -0.25 -0.10 1.21 -2.51 0.00 0.00 175.55 174.10 1mm4 s ASN 48 N 0.44 4.10 0.14 -0.18 3.84 -1.26 -5.14 114.94 116.89 1mm4 s ASN 48 Ca -0.12 -0.80 -0.03 0.00 0.21 0.00 0.00 52.86 52.12 1mm4 s ASN 48 Cb -0.14 -0.60 -0.05 0.00 -0.55 0.00 0.00 41.25 39.91 1mm4 s ASN 48 CO 0.04 0.03 0.35 -1.61 -2.79 0.00 0.00 177.10 173.12 1mm4 s GLU 49 N -3.51 3.57 0.13 0.43 0.41 -1.26 -5.11 118.70 113.36 1mm4 s GLU 49 Ca 0.30 -0.20 -0.01 0.00 -0.41 0.00 0.00 54.97 54.65 1mm4 s GLU 49 Cb -0.06 -2.88 -0.04 0.00 -1.78 0.00 0.00 34.13 29.37 1mm4 s GLU 49 CO 0.17 0.48 0.30 1.03 -0.49 0.00 0.00 175.26 176.75 1mm4 s ARG 50 N -2.77 3.50 1.07 1.61 0.52 -1.26 -5.09 118.95 116.54 1mm4 s ARG 50 Ca 0.40 -0.36 -0.17 0.00 -0.52 0.00 0.00 55.73 55.08 1mm4 s ARG 50 Cb -0.12 -2.93 0.09 0.00 0.52 0.00 0.00 34.95 32.50 1mm4 s ARG 50 CO 0.26 0.51 0.14 -2.30 0.02 0.00 0.00 175.30 173.93 1mm4 n PRO 51 N -0.12 -1.25 -3.94 3.54 -0.02 -1.26 -5.00 135.00 126.95 1mm4 n PRO 51 Ca -0.05 -0.34 -0.31 0.00 -2.02 0.00 0.00 63.50 60.78 1mm4 n PRO 51 Cb 0.52 -1.75 -0.04 0.00 -0.02 0.00 0.00 33.50 32.21 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 -2.28 3.46 0.00 6.00 0.23 -1.26 -5.02 118.94 120.06 1mm4 s TRP 52 Ca 0.56 0.22 0.00 0.00 -2.03 0.00 0.00 56.10 54.86 1mm4 s TRP 52 Cb -0.15 -1.74 0.00 0.00 0.03 0.00 0.00 33.47 31.62 1mm4 s TRP 52 CO 0.67 0.58 0.00 0.41 0.96 0.00 0.00 176.95 179.56 1mm4 n GLY 53 N 0.35 2.48 0.00 0.98 0.00 -1.26 -4.19 105.19 103.54 1mm4 n GLY 53 Ca -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 0.87 3.10 -0.02 0.00 -1.07 -5.04 105.19 103.04 1mm4 n GLY 54 Ca 0.00 -2.15 -0.13 0.00 0.00 0.00 0.00 46.02 43.74 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 0.62 -0.06 -0.02 0.00 -0.71 -1.22 107.32 105.92 1mm4 s GLY 55 Ca 0.00 -0.96 -0.07 0.00 0.00 0.00 0.00 44.72 43.68 1mm4 s GLY 55 CO 0.00 -1.03 0.20 -0.11 0.00 0.00 0.00 173.10 172.16 1mm4 s PHE 56 N -2.05 -0.18 0.00 1.90 -0.71 -1.06 -1.96 117.98 113.92 1mm4 s PHE 56 Ca -0.03 0.42 0.00 0.00 -1.04 0.00 0.00 56.93 56.28 1mm4 s PHE 56 Cb -0.05 0.06 0.00 0.00 -1.21 0.00 0.00 43.02 41.81 1mm4 s PHE 56 CO -0.01 -0.15 0.00 0.41 -1.34 0.00 0.00 175.22 174.13 1mm4 n GLY 57 N 2.65 1.61 3.58 1.99 0.00 -1.04 -2.58 105.19 111.39 1mm4 n GLY 57 Ca -0.15 -0.75 -0.27 0.00 0.00 0.00 0.00 46.02 44.84 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 2.08 0.25 0.99 1.02 -0.34 -2.12 118.68 120.56 1mm4 s LEU 58 Ca 0.00 -1.66 -0.17 0.00 0.02 0.00 0.00 54.13 52.31 1mm4 s LEU 58 Cb 0.00 -0.27 0.01 0.00 0.02 0.00 0.00 46.19 45.95 1mm4 s LEU 58 CO 0.00 -0.90 0.59 -0.44 0.02 0.00 0.00 176.35 175.61 1mm4 s SER 59 N -3.68 -0.19 0.09 2.29 0.01 -1.26 -2.58 113.70 108.38 1mm4 s SER 59 Ca 0.19 -0.72 0.04 0.00 1.31 0.00 0.00 55.95 56.78 1mm4 s SER 59 Cb 0.02 0.65 -0.03 0.00 0.21 0.00 0.00 66.02 66.87 1mm4 s SER 59 CO 0.12 -1.22 -0.11 -0.13 0.41 0.00 0.00 173.24 172.31 1mm4 s ARG 60 N -3.95 0.84 -0.03 12.44 0.52 -0.74 -4.68 118.95 123.34 1mm4 s ARG 60 Ca 0.15 -1.10 0.01 0.00 -0.52 0.00 0.00 55.73 54.27 1mm4 s ARG 60 Cb -0.03 -0.60 0.02 0.00 0.52 0.00 0.00 34.95 34.86 1mm4 s ARG 60 CO 0.06 0.10 -0.03 1.67 0.02 0.00 0.00 175.30 177.13 1mm4 s TRP 61 N -2.15 0.50 0.00 -0.53 -2.14 -1.26 -0.71 118.94 112.66 1mm4 s TRP 61 Ca 0.03 -0.10 0.08 0.00 2.66 0.00 0.00 56.10 58.78 1mm4 s TRP 61 Cb -0.05 -0.47 -0.02 0.00 -3.10 0.00 0.00 33.47 29.83 1mm4 s TRP 61 CO 0.01 -0.12 -0.25 0.34 -2.66 0.00 0.00 176.95 174.27 1mm4 s ASP 62 N 0.71 2.91 0.57 -2.66 -1.08 0.46 -4.96 116.67 112.62 1mm4 s ASP 62 Ca -0.08 -0.48 0.35 0.00 -0.52 0.00 0.00 52.55 51.82 1mm4 s ASP 62 Cb -0.11 -0.30 1.91 0.00 -1.46 0.00 0.00 42.92 42.95 1mm4 s ASP 62 CO -0.01 0.28 2.07 -0.08 0.52 0.00 0.00 175.17 177.95 1mm4 h GLU 63 N 5.30 0.00 -0.92 4.34 4.81 -2.01 -0.85 114.58 125.25 1mm4 h GLU 63 Ca -0.43 0.00 -0.15 0.00 -0.13 0.00 0.00 59.36 58.65 1mm4 h GLU 63 Cb 1.13 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.42 1mm4 h GLU 63 CO 0.46 0.00 0.20 1.17 -0.73 0.00 0.00 179.01 180.11 1mm4 n LYS 64 N -2.80 2.15 -3.08 1.92 4.81 -1.26 -4.85 118.16 115.05 1mm4 n LYS 64 Ca -0.02 -1.52 -0.13 0.00 -0.87 0.00 0.00 58.31 55.76 1mm4 n LYS 64 Cb 0.13 -1.70 0.06 0.00 0.02 0.00 0.00 35.03 33.54 1mm4 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mm4 n GLY 65 N -0.06 -0.12 2.90 3.14 0.00 -0.35 -5.01 105.19 105.68 1mm4 n GLY 65 Ca 0.23 -0.05 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 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 -3.78 4.36 -0.69 1.61 3.84 -1.08 -4.82 114.94 114.37 1mm4 s ASN 66 Ca 0.11 -2.24 -0.11 0.00 0.21 0.00 0.00 52.86 50.82 1mm4 s ASN 66 Cb -0.05 -1.37 0.18 0.00 -0.55 0.00 0.00 41.25 39.47 1mm4 s ASN 66 CO 0.52 -0.35 0.60 0.86 -2.79 0.00 0.00 177.10 175.94 1mm4 s TRP 67 N 0.79 3.57 0.39 0.43 -0.11 -1.07 -0.40 118.94 122.54 1mm4 s TRP 67 Ca 0.13 -2.03 -0.26 0.00 1.22 0.00 0.00 56.10 55.15 1mm4 s TRP 67 Cb -0.21 -3.64 -0.09 0.00 -1.50 0.00 0.00 33.47 28.04 1mm4 s TRP 67 CO -0.10 -0.96 1.22 -1.58 -4.62 0.00 0.00 176.95 170.91 1mm4 s HIS 68 N 0.48 3.01 -0.13 5.86 5.65 0.11 -2.26 115.29 128.02 1mm4 s HIS 68 Ca 0.14 1.51 -0.00 0.00 0.25 0.00 0.00 55.06 56.95 1mm4 s HIS 68 Cb -0.17 -3.50 0.03 0.00 -1.18 0.00 0.00 32.58 27.75 1mm4 s HIS 68 CO -0.05 -1.57 -0.09 0.20 -0.65 0.00 0.00 174.74 172.58 1mm4 s GLY 69 N -0.94 0.94 -0.16 1.59 0.00 -0.94 -1.80 107.32 106.00 1mm4 s GLY 69 Ca 0.56 -0.69 -0.04 0.00 0.00 0.00 0.00 44.72 44.54 1mm4 s GLY 69 CO 0.43 0.74 0.20 1.08 0.00 0.00 0.00 173.10 175.55 1mm4 s LEU 70 N 1.63 -0.10 0.18 0.66 1.43 -1.07 -2.26 118.68 119.15 1mm4 s LEU 70 Ca 0.04 0.02 -0.13 0.00 -1.03 0.00 0.00 54.13 53.03 1mm4 s LEU 70 Cb -0.13 0.37 0.01 0.00 0.03 0.00 0.00 46.19 46.47 1mm4 s LEU 70 CO -0.09 -0.29 0.41 -0.72 0.23 0.00 0.00 176.35 175.89 1mm4 s TYR 71 N 2.32 0.12 -0.08 0.29 1.13 -1.06 -1.20 117.35 118.87 1mm4 s TYR 71 Ca 0.05 -0.48 -0.01 0.00 -1.41 0.00 0.00 57.07 55.22 1mm4 s TYR 71 Cb -0.14 0.18 0.03 0.00 -1.10 0.00 0.00 41.96 40.92 1mm4 s TYR 71 CO -0.10 -0.82 -0.02 0.00 -2.51 0.00 0.00 175.55 172.10 1mm4 s ALA 72 N -3.92 0.87 0.61 9.51 0.00 -1.07 -2.59 121.76 125.17 1mm4 s ALA 72 Ca 0.13 -0.24 -0.03 0.00 0.00 0.00 0.00 51.96 51.82 1mm4 s ALA 72 Cb 0.01 -0.79 0.04 0.00 0.00 0.00 0.00 23.12 22.38 1mm4 s ALA 72 CO -0.02 -0.44 0.88 -1.64 0.00 0.00 0.00 175.76 174.54 1mm4 s MET 73 N 1.89 2.52 -0.17 0.00 -1.94 0.44 -2.57 119.30 119.47 1mm4 s MET 73 Ca 0.05 -0.42 -0.14 0.00 -1.71 0.00 0.00 55.69 53.46 1mm4 s MET 73 Cb -0.12 -2.34 0.05 0.00 2.01 0.00 0.00 34.83 34.43 1mm4 s MET 73 CO -0.06 -0.88 0.43 0.00 -0.01 0.00 0.00 175.02 174.51 1mm4 s ALA 74 N -2.97 -1.08 -0.04 3.03 0.00 -0.36 -1.77 121.76 118.57 1mm4 s ALA 74 Ca 0.57 1.30 0.04 0.00 0.00 0.00 0.00 51.96 53.87 1mm4 s ALA 74 Cb -0.10 -0.76 -0.00 0.00 0.00 0.00 0.00 23.12 22.25 1mm4 s ALA 74 CO 0.42 -0.22 -0.15 -0.06 0.00 0.00 0.00 175.76 175.75 1mm4 s PHE 75 N 0.48 1.49 0.29 0.00 0.40 -1.07 -2.59 117.98 116.97 1mm4 s PHE 75 Ca -0.02 -0.42 -0.22 0.00 -0.60 0.00 0.00 56.93 55.67 1mm4 s PHE 75 Cb -0.04 -1.02 -0.09 0.00 0.51 0.00 0.00 43.02 42.38 1mm4 s PHE 75 CO -0.02 -0.15 0.84 0.21 0.70 0.00 0.00 175.22 176.79 1mm4 s LYS 76 N 0.11 4.35 0.34 0.44 2.36 -1.26 -0.87 119.74 125.21 1mm4 s LYS 76 Ca -0.04 1.05 0.03 0.00 -2.55 0.00 0.00 55.97 54.46 1mm4 s LYS 76 Cb -0.11 -2.73 0.03 0.00 -1.05 0.00 0.00 37.83 33.97 1mm4 s LYS 76 CO 0.02 0.28 0.22 -0.25 1.55 0.00 0.00 175.35 177.16 1mm4 n ASP 77 N 0.40 2.20 0.06 1.43 10.43 -1.26 -4.96 116.55 124.84 1mm4 n ASP 77 Ca 0.01 -2.20 -0.04 0.00 2.57 0.00 0.00 54.79 55.13 1mm4 n ASP 77 Cb 0.51 0.01 -0.08 0.00 1.84 0.00 0.00 41.12 43.40 1mm4 n ASP 77 CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 177.20 176.90 1mm4 h SER 78 N 0.46 0.00 0.00 -2.24 4.64 -1.98 -3.43 113.55 110.99 1mm4 h SER 78 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1mm4 h SER 78 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 1mm4 h SER 78 CO 0.35 0.80 -0.07 1.87 -0.87 0.00 0.00 176.83 178.92 1mm4 n TRP 79 N -3.19 0.00 0.00 4.77 -0.00 -1.26 -5.11 117.44 112.65 1mm4 n TRP 79 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.46 1mm4 n TRP 79 Cb 0.89 0.32 0.00 0.00 -0.00 0.00 0.00 31.31 32.52 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 -2.23 -1.19 -4.92 5.87 3.02 -1.26 -5.05 115.26 109.50 1mm4 n ASN 80 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.30 1mm4 n ASN 80 Cb 0.03 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.21 1mm4 n ASN 80 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1mm4 s LYS 81 N -1.78 2.27 -0.29 3.52 1.02 -1.26 -4.50 119.74 118.73 1mm4 s LYS 81 Ca 0.00 -1.94 -0.28 0.00 0.02 0.00 0.00 55.97 53.78 1mm4 s LYS 81 Cb 0.00 -2.20 -0.05 0.00 -0.52 0.00 0.00 37.83 35.06 1mm4 s LYS 81 CO 0.00 -0.64 2.27 -1.58 -0.92 0.00 0.00 175.35 174.48 1mm4 s TRP 82 N -2.74 1.14 0.09 3.18 0.51 -1.26 -4.33 118.94 115.53 1mm4 s TRP 82 Ca 0.39 0.81 -0.31 0.00 -2.12 0.00 0.00 56.10 54.87 1mm4 s TRP 82 Cb -0.03 -3.84 -0.09 0.00 -0.81 0.00 0.00 33.47 28.70 1mm4 s TRP 82 CO 0.24 -3.68 1.74 -1.83 -0.51 0.00 0.00 176.95 172.91 1mm4 s GLU 83 N 6.85 4.17 0.27 4.98 -1.05 -0.05 -4.73 118.70 129.14 1mm4 s GLU 83 Ca 1.00 2.45 -0.27 0.00 -0.15 0.00 0.00 54.97 58.00 1mm4 s GLU 83 Cb -0.29 -3.62 -0.09 0.00 -0.44 0.00 0.00 34.13 29.69 1mm4 s GLU 83 CO 0.33 -0.79 0.90 -1.25 0.95 0.00 0.00 175.26 175.40 1mm4 s PRO 84 N 2.76 4.63 -0.09 -4.83 0.04 -1.26 -2.61 135.00 133.64 1mm4 s PRO 84 Ca 0.77 1.31 -0.03 0.00 0.04 0.00 0.00 61.00 63.09 1mm4 s PRO 84 Cb -0.42 -3.01 0.04 0.00 0.04 0.00 0.00 34.50 31.15 1mm4 s PRO 84 CO 0.34 0.40 0.10 0.42 0.04 0.00 0.00 177.00 178.30 1mm4 s ILE 85 N -1.42 -0.15 0.03 0.56 1.09 -0.73 -4.71 121.20 115.88 1mm4 s ILE 85 Ca 0.45 0.24 -0.01 0.00 -1.10 0.00 0.00 60.65 60.23 1mm4 s ILE 85 Cb -0.21 -0.31 -0.04 0.00 -1.06 0.00 0.00 42.46 40.84 1mm4 s ILE 85 CO 0.26 0.04 0.18 0.00 -0.10 0.00 0.00 174.94 175.33 1mm4 s ALA 86 N 2.19 3.94 -0.28 9.38 0.00 -1.06 -0.42 121.76 135.50 1mm4 s ALA 86 Ca 0.04 -0.82 -0.21 0.00 0.00 0.00 0.00 51.96 50.96 1mm4 s ALA 86 Cb -0.13 -1.81 0.11 0.00 0.00 0.00 0.00 23.12 21.29 1mm4 s ALA 86 CO -0.05 0.79 0.92 0.20 0.00 0.00 0.00 175.76 177.61 1mm4 s GLY 87 N -2.24 -0.25 0.01 0.00 0.00 -1.07 -1.20 107.32 102.57 1mm4 s GLY 87 Ca 0.31 2.65 -0.24 0.00 0.00 0.00 0.00 44.72 47.44 1mm4 s GLY 87 CO 0.23 2.10 0.55 -2.52 0.00 0.00 0.00 173.10 173.46 1mm4 s TYR 88 N 0.75 -0.48 0.03 1.90 1.13 -0.36 -2.56 117.35 117.76 1mm4 s TYR 88 Ca -0.02 0.68 -0.09 0.00 -1.41 0.00 0.00 57.07 56.23 1mm4 s TYR 88 Cb -0.05 0.34 0.03 0.00 -1.10 0.00 0.00 41.96 41.18 1mm4 s TYR 88 CO -0.09 -0.60 0.40 0.41 -2.51 0.00 0.00 175.55 173.16 1mm4 n GLY 89 N 0.69 0.79 3.89 5.49 0.00 -0.96 -0.43 105.19 114.67 1mm4 n GLY 89 Ca -0.19 -0.96 -0.35 0.00 0.00 0.00 0.00 46.02 44.52 1mm4 n GLY 89 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1mm4 s TRP 90 N -3.74 3.58 -0.02 1.61 -0.00 0.43 -2.22 118.94 118.58 1mm4 s TRP 90 Ca 0.09 0.54 0.01 0.00 -0.00 0.00 0.00 56.10 56.75 1mm4 s TRP 90 Cb -0.01 -1.96 0.01 0.00 -0.00 0.00 0.00 33.47 31.51 1mm4 s TRP 90 CO 0.01 0.64 -0.04 -1.21 -0.00 0.00 0.00 176.95 176.35 1mm4 s GLU 91 N -1.67 0.48 -0.04 5.86 0.41 -0.96 -0.57 118.70 122.21 1mm4 s GLU 91 Ca 0.26 -0.11 0.01 0.00 -0.41 0.00 0.00 54.97 54.72 1mm4 s GLU 91 Cb -0.13 -0.51 0.02 0.00 -1.78 0.00 0.00 34.13 31.73 1mm4 s GLU 91 CO 0.15 0.02 -0.05 -1.54 -0.49 0.00 0.00 175.26 173.34 1mm4 s SER 92 N 0.35 0.94 0.09 -0.19 1.04 -0.05 -2.59 113.70 113.29 1mm4 s SER 92 Ca -0.04 -0.13 0.10 0.00 0.48 0.00 0.00 55.95 56.36 1mm4 s SER 92 Cb -0.07 -0.43 -0.04 0.00 0.10 0.00 0.00 66.02 65.59 1mm4 s SER 92 CO -0.00 -0.03 -0.26 0.42 0.98 0.00 0.00 173.24 174.34 1mm4 s THR 93 N 0.77 2.24 0.24 2.02 -4.23 -1.26 -1.50 115.64 113.92 1mm4 s THR 93 Ca -0.11 -1.60 0.10 0.00 -1.18 0.00 0.00 61.69 58.91 1mm4 s THR 93 Cb -0.13 -1.94 -0.05 0.00 1.34 0.00 0.00 72.50 71.71 1mm4 s THR 93 CO 0.00 0.21 -0.19 0.26 -0.54 0.00 0.00 174.62 174.36 1mm4 s TRP 94 N -0.96 2.08 0.11 3.99 0.51 0.43 -4.93 118.94 120.18 1mm4 s TRP 94 Ca 0.13 -0.41 0.08 0.00 -2.12 0.00 0.00 56.10 53.78 1mm4 s TRP 94 Cb -0.10 -0.94 -0.04 0.00 -0.81 0.00 0.00 33.47 31.58 1mm4 s TRP 94 CO 0.05 0.56 -0.12 -0.98 -0.51 0.00 0.00 176.95 175.94 1mm4 s ARG 95 N -3.40 2.01 0.05 4.98 1.04 -1.26 -2.59 118.95 119.78 1mm4 s ARG 95 Ca 0.26 -1.09 -0.19 0.00 -1.04 0.00 0.00 55.73 53.68 1mm4 s ARG 95 Cb -0.04 -2.24 -0.15 0.00 -2.04 0.00 0.00 34.95 30.48 1mm4 s ARG 95 CO 0.11 0.50 1.31 -1.00 -0.04 0.00 0.00 175.30 176.18 1mm4 h PRO 96 N 3.61 0.47 0.00 3.89 0.13 -1.96 -3.47 132.00 134.66 1mm4 h PRO 96 Ca -0.49 -0.29 0.00 0.00 -0.87 0.00 0.00 66.00 64.35 1mm4 h PRO 96 Cb 1.17 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.33 1mm4 h PRO 96 CO 0.50 0.89 0.00 -0.11 -0.23 0.00 0.00 178.00 179.06 1mm4 n LEU 97 N -4.40 0.00 0.23 1.56 -0.00 -1.26 -4.95 117.00 108.18 1mm4 n LEU 97 Ca -0.06 0.00 0.14 0.00 -0.00 0.00 0.00 56.01 56.09 1mm4 n LEU 97 Cb 0.46 0.07 0.79 0.00 -0.00 0.00 0.00 43.42 44.74 1mm4 n LEU 97 CO 0.42 -0.07 1.13 0.00 -0.00 0.00 0.00 177.39 178.87 1mm4 h ALA 98 N 0.00 1.84 -2.15 1.96 0.00 -1.99 -3.45 119.26 115.46 1mm4 h ALA 98 Ca 0.00 -0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.58 1mm4 h ALA 98 Cb 0.00 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.77 1mm4 h ALA 98 CO 0.00 -0.16 -0.41 -3.47 0.00 0.00 0.00 179.25 175.21 1mm4 n ASP 99 N -4.06 -4.90 0.00 0.00 4.64 -1.26 -4.88 116.55 106.09 1mm4 n ASP 99 Ca -0.00 0.04 0.00 0.00 -1.38 0.00 0.00 54.79 53.45 1mm4 n ASP 99 Cb 0.22 -3.99 0.00 0.00 -1.04 0.00 0.00 41.12 36.31 1mm4 n ASP 99 CO 0.00 0.00 0.00 -0.62 -0.82 0.00 0.00 177.20 175.76 1mm4 n GLU 100 N -2.57 0.00 0.00 -0.67 1.02 -1.26 -5.07 120.64 112.08 1mm4 n GLU 100 Ca -0.19 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.95 1mm4 n GLU 100 Cb 0.64 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 32.06 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 0.00 0.00 -4.85 1.62 3.02 -1.26 -5.13 115.26 108.66 1mm4 n ASN 101 Ca 0.00 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.18 1mm4 n ASN 101 Cb 0.00 0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.14 1mm4 n ASN 101 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1mm4 s PHE 102 N -0.29 3.58 -0.24 3.10 0.08 -1.26 -4.70 117.98 118.25 1mm4 s PHE 102 Ca 0.00 0.56 -0.02 0.00 0.12 0.00 0.00 56.93 57.58 1mm4 s PHE 102 Cb 0.00 -2.03 0.01 0.00 -0.57 0.00 0.00 43.02 40.43 1mm4 s PHE 102 CO 0.00 0.64 -0.06 -1.01 -0.10 0.00 0.00 175.22 174.69 1mm4 s HIS 103 N -0.76 3.02 -0.05 0.36 3.76 -1.07 -4.51 115.29 116.03 1mm4 s HIS 103 Ca 0.15 -1.34 -0.01 0.00 -0.15 0.00 0.00 55.06 53.71 1mm4 s HIS 103 Cb -0.12 -2.07 0.03 0.00 1.11 0.00 0.00 32.58 31.52 1mm4 s HIS 103 CO 0.04 -0.67 0.02 -1.17 -0.85 0.00 0.00 174.74 172.11 1mm4 s LEU 104 N 1.38 0.57 0.00 0.89 0.20 -1.07 -2.54 118.68 118.11 1mm4 s LEU 104 Ca 0.02 -0.02 -0.07 0.00 0.69 0.00 0.00 54.13 54.75 1mm4 s LEU 104 Cb -0.16 -0.30 0.02 0.00 -0.43 0.00 0.00 46.19 45.33 1mm4 s LEU 104 CO -0.04 -0.19 0.33 0.61 -0.29 0.00 0.00 176.35 176.77 1mm4 n GLY 105 N 4.98 0.88 3.36 7.98 0.00 -1.07 -0.43 105.19 120.89 1mm4 n GLY 105 Ca -0.10 -0.95 -0.18 0.00 0.00 0.00 0.00 46.02 44.78 1mm4 n GLY 105 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mm4 s LEU 106 N 0.00 1.79 -0.25 0.99 1.43 -0.56 -2.41 118.68 119.67 1mm4 s LEU 106 Ca 0.08 -1.42 -0.28 0.00 -1.03 0.00 0.00 54.13 51.47 1mm4 s LEU 106 Cb -0.01 -0.06 0.16 0.00 0.03 0.00 0.00 46.19 46.31 1mm4 s LEU 106 CO 0.01 -0.73 1.21 -0.83 0.23 0.00 0.00 176.35 176.24 1mm4 s GLY 107 N -3.38 -0.01 0.11 -3.19 0.00 0.43 -0.87 107.32 100.41 1mm4 s GLY 107 Ca 0.36 2.67 -0.17 0.00 0.00 0.00 0.00 44.72 47.59 1mm4 s GLY 107 CO 0.15 1.33 0.56 -0.12 0.00 0.00 0.00 173.10 175.02 1mm4 s PHE 108 N -0.69 3.71 -0.05 1.90 5.36 0.26 -1.83 117.98 126.64 1mm4 s PHE 108 Ca 0.04 1.18 0.03 0.00 -0.96 0.00 0.00 56.93 57.22 1mm4 s PHE 108 Cb -0.02 -2.44 0.01 0.00 -0.34 0.00 0.00 43.02 40.23 1mm4 s PHE 108 CO -0.06 0.51 -0.13 0.99 -1.46 0.00 0.00 175.22 175.07 1mm4 s THR 109 N -1.28 1.17 -0.25 0.12 2.01 -1.02 -0.43 115.64 115.97 1mm4 s THR 109 Ca 0.33 -0.53 -0.00 0.00 0.31 0.00 0.00 61.69 61.80 1mm4 s THR 109 Cb -0.17 -1.04 0.04 0.00 0.01 0.00 0.00 72.50 71.33 1mm4 s THR 109 CO 0.19 0.35 -0.09 0.00 -0.69 0.00 0.00 174.62 174.39 1mm4 s ALA 110 N 0.41 2.63 -0.13 7.40 0.00 0.43 -2.50 121.76 130.01 1mm4 s ALA 110 Ca -0.10 -1.54 -0.11 0.00 0.00 0.00 0.00 51.96 50.21 1mm4 s ALA 110 Cb -0.13 -1.62 -0.05 0.00 0.00 0.00 0.00 23.12 21.32 1mm4 s ALA 110 CO 0.03 -0.89 0.24 0.20 0.00 0.00 0.00 175.76 175.33 1mm4 s GLY 111 N 1.26 2.21 -0.08 0.00 0.00 -0.70 -1.22 107.32 108.79 1mm4 s GLY 111 Ca -0.02 -0.51 0.02 0.00 0.00 0.00 0.00 44.72 44.20 1mm4 s GLY 111 CO -0.05 0.09 -0.12 -1.34 0.00 0.00 0.00 173.10 171.68 1mm4 s VAL 112 N -0.25 1.18 -0.27 1.40 -7.23 -0.34 -0.42 120.40 114.47 1mm4 s VAL 112 Ca 0.16 -0.47 -0.06 0.00 -1.81 0.00 0.00 61.98 59.80 1mm4 s VAL 112 Cb -0.13 -1.11 0.00 0.00 0.56 0.00 0.00 36.38 35.71 1mm4 s VAL 112 CO 0.04 0.37 0.04 0.42 -0.31 0.00 0.00 175.10 175.67 1mm4 s THR 113 N 0.97 3.84 -0.04 5.32 -4.23 -1.07 -2.57 115.64 117.85 1mm4 s THR 113 Ca -0.08 -0.58 -0.00 0.00 -1.18 0.00 0.00 61.69 59.84 1mm4 s THR 113 Cb -0.15 -2.90 -0.03 0.00 1.34 0.00 0.00 72.50 70.76 1mm4 s THR 113 CO -0.00 0.20 0.01 0.00 -0.54 0.00 0.00 174.62 174.29 1mm4 s ALA 114 N 1.50 3.31 0.35 3.99 0.00 -1.26 -0.45 121.76 129.21 1mm4 s ALA 114 Ca 0.04 -0.88 0.00 0.00 0.00 0.00 0.00 51.96 51.12 1mm4 s ALA 114 Cb -0.16 -1.42 -0.00 0.00 0.00 0.00 0.00 23.12 21.53 1mm4 s ALA 114 CO 0.01 0.62 0.02 0.54 0.00 0.00 0.00 175.76 176.95 1mm4 n ARG 115 N 1.71 1.06 -1.95 0.00 5.12 -1.26 -4.90 116.66 116.43 1mm4 n ARG 115 Ca -0.16 -2.63 0.02 0.00 -1.93 0.00 0.00 57.85 53.15 1mm4 n ARG 115 Cb 0.53 0.80 0.03 0.00 -1.16 0.00 0.00 32.46 32.66 1mm4 n ARG 115 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 1mm4 n ASP 116 N -1.29 0.95 0.14 0.55 4.64 -1.26 -4.60 116.55 115.68 1mm4 n ASP 116 Ca -0.14 -2.02 -0.06 0.00 -1.38 0.00 0.00 54.79 51.20 1mm4 n ASP 116 Cb 0.46 -0.28 -0.03 0.00 -1.04 0.00 0.00 41.12 40.23 1mm4 n ASP 116 CO 0.00 0.00 0.00 -1.13 -0.82 0.00 0.00 177.20 175.25 1mm4 h ASN 117 N 1.46 -0.33 0.00 1.67 -1.24 -2.02 -3.46 115.58 111.66 1mm4 h ASN 117 Ca -0.23 0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.79 1mm4 h ASN 117 Cb 1.63 0.09 0.00 0.00 0.73 0.00 0.00 38.32 40.77 1mm4 h ASN 117 CO 0.09 -0.11 -0.58 1.87 -1.29 0.00 0.00 177.43 177.41 1mm4 n TRP 118 N -3.78 -0.12 -4.12 0.67 -0.00 -1.26 -5.11 117.44 103.71 1mm4 n TRP 118 Ca -0.05 0.02 -0.12 0.00 -0.00 0.00 0.00 57.50 57.35 1mm4 n TRP 118 Cb 0.15 0.17 -0.11 0.00 -0.00 0.00 0.00 31.31 31.53 1mm4 n TRP 118 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 177.69 178.90 1mm4 s ASN 119 N -5.09 1.03 -0.64 5.87 2.47 -1.26 -5.10 114.94 112.22 1mm4 s ASN 119 Ca 0.00 -0.80 -0.27 0.00 0.42 0.00 0.00 52.86 52.21 1mm4 s ASN 119 Cb 0.00 0.07 0.01 0.00 -1.45 0.00 0.00 41.25 39.88 1mm4 s ASN 119 CO 0.00 -0.35 1.47 -0.31 -3.72 0.00 0.00 177.10 174.19 1mm4 s TYR 120 N -2.62 2.13 -0.39 0.43 1.51 -1.26 -4.70 117.35 112.46 1mm4 s TYR 120 Ca 0.02 0.34 0.01 0.00 -1.01 0.00 0.00 57.07 56.43 1mm4 s TYR 120 Cb -0.02 -4.41 0.13 0.00 -0.11 0.00 0.00 41.96 37.55 1mm4 s TYR 120 CO -0.02 -2.10 0.19 0.42 -1.11 0.00 0.00 175.55 172.93 1mm4 s ILE 121 N 6.64 1.08 0.40 2.71 1.01 -1.26 -5.04 121.20 126.74 1mm4 s ILE 121 Ca 0.49 -2.10 -0.26 0.00 0.00 0.00 0.00 60.65 58.78 1mm4 s ILE 121 Cb -0.10 -1.78 -0.09 0.00 0.01 0.00 0.00 42.46 40.50 1mm4 s ILE 121 CO 0.20 -0.84 1.20 -2.16 0.00 0.00 0.00 174.94 173.34 1mm4 s PRO 122 N 0.82 4.05 -0.78 2.79 0.04 -1.26 -4.49 135.00 136.18 1mm4 s PRO 122 Ca 0.15 1.92 -0.08 0.00 0.04 0.00 0.00 61.00 63.04 1mm4 s PRO 122 Cb -0.22 -2.72 0.20 0.00 0.04 0.00 0.00 34.50 31.80 1mm4 s PRO 122 CO -0.07 -0.34 0.67 -1.17 0.04 0.00 0.00 177.00 176.13 1mm4 s LEU 123 N -2.43 5.97 0.61 -3.56 0.20 0.40 -4.83 118.68 115.03 1mm4 s LEU 123 Ca 0.56 -2.98 -0.17 0.00 0.69 0.00 0.00 54.13 52.24 1mm4 s LEU 123 Cb -0.33 -2.03 -0.03 0.00 -0.43 0.00 0.00 46.19 43.38 1mm4 s LEU 123 CO 0.41 -0.41 1.10 -2.16 -0.29 0.00 0.00 176.35 175.00 1mm4 s PRO 124 N -0.26 3.10 -0.20 0.98 0.04 -1.25 -2.59 135.00 134.81 1mm4 s PRO 124 Ca 0.20 1.41 -0.11 0.00 0.04 0.00 0.00 61.00 62.54 1mm4 s PRO 124 Cb -0.14 -1.99 0.06 0.00 0.04 0.00 0.00 34.50 32.48 1mm4 s PRO 124 CO -0.07 -1.02 0.49 0.14 0.04 0.00 0.00 177.00 176.58 1mm4 s VAL 125 N -2.19 -0.02 -0.23 -0.36 -7.23 0.44 -4.94 120.40 105.87 1mm4 s VAL 125 Ca 0.68 0.06 -0.11 0.00 -1.81 0.00 0.00 61.98 60.80 1mm4 s VAL 125 Cb -0.20 -0.72 -0.05 0.00 0.56 0.00 0.00 36.38 35.96 1mm4 s VAL 125 CO 0.36 0.03 0.17 -0.76 -0.31 0.00 0.00 175.10 174.59 1mm4 s LEU 126 N 1.42 4.13 -0.07 1.32 1.43 -1.26 -1.71 118.68 123.93 1mm4 s LEU 126 Ca -0.09 0.15 -0.11 0.00 -1.03 0.00 0.00 54.13 53.05 1mm4 s LEU 126 Cb -0.07 -2.13 0.02 0.00 0.03 0.00 0.00 46.19 44.04 1mm4 s LEU 126 CO -0.14 0.07 0.27 -0.76 0.23 0.00 0.00 176.35 176.02 1mm4 s LEU 127 N 0.99 0.98 0.48 1.79 1.02 -1.04 -4.97 118.68 117.93 1mm4 s LEU 127 Ca 0.08 0.34 -0.21 0.00 0.02 0.00 0.00 54.13 54.36 1mm4 s LEU 127 Cb -0.13 1.02 -0.08 0.00 0.02 0.00 0.00 46.19 47.02 1mm4 s LEU 127 CO 0.04 -0.23 1.06 -2.16 0.02 0.00 0.00 176.35 175.08 1mm4 s PRO 128 N -0.46 3.79 -0.03 1.29 0.04 -1.26 -2.42 135.00 135.95 1mm4 s PRO 128 Ca -0.06 1.44 -0.20 0.00 0.04 0.00 0.00 61.00 62.22 1mm4 s PRO 128 Cb -0.04 -2.16 0.04 0.00 0.04 0.00 0.00 34.50 32.38 1mm4 s PRO 128 CO 0.02 -0.45 0.43 -1.17 0.04 0.00 0.00 177.00 175.86 1mm4 s LEU 129 N -3.38 0.37 0.29 -3.56 0.20 -0.76 -2.60 118.68 109.24 1mm4 s LEU 129 Ca 0.66 0.29 0.06 0.00 0.69 0.00 0.00 54.13 55.84 1mm4 s LEU 129 Cb -0.19 1.68 -0.06 0.00 -0.43 0.00 0.00 46.19 47.19 1mm4 s LEU 129 CO 0.23 -0.50 -0.04 0.00 -0.29 0.00 0.00 176.35 175.75 1mm4 s ALA 130 N -1.28 2.40 -0.07 5.97 0.00 -0.94 -0.43 121.76 127.41 1mm4 s ALA 130 Ca -0.13 -1.95 -0.03 0.00 0.00 0.00 0.00 51.96 49.86 1mm4 s ALA 130 Cb -0.04 0.24 0.04 0.00 0.00 0.00 0.00 23.12 23.36 1mm4 s ALA 130 CO 0.06 -0.10 0.09 -1.12 0.00 0.00 0.00 175.76 174.69 1mm4 s SER 131 N -3.47 1.21 -0.08 0.00 0.01 -1.01 -2.55 113.70 107.81 1mm4 s SER 131 Ca 0.31 0.04 -0.03 0.00 1.31 0.00 0.00 55.95 57.57 1mm4 s SER 131 Cb 0.05 -0.06 0.05 0.00 0.21 0.00 0.00 66.02 66.26 1mm4 s SER 131 CO 0.13 -0.26 0.17 0.68 0.41 0.00 0.00 173.24 174.36 1mm4 s VAL 132 N 2.19 -0.22 -0.94 3.43 -7.23 0.41 -2.59 120.40 115.45 1mm4 s VAL 132 Ca 0.04 0.30 0.00 0.00 -1.81 0.00 0.00 61.98 60.52 1mm4 s VAL 132 Cb -0.13 -0.30 0.00 0.00 0.56 0.00 0.00 36.38 36.52 1mm4 s VAL 132 CO -0.04 0.13 0.00 0.61 -0.31 0.00 0.00 175.10 175.48 1mm4 n GLY 133 N 5.04 -0.83 2.94 2.32 0.00 -1.05 -0.77 105.19 112.83 1mm4 n GLY 133 Ca -0.10 -0.77 -0.15 0.00 0.00 0.00 0.00 46.02 45.00 1mm4 n GLY 133 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mm4 s TYR 134 N -3.00 0.37 0.00 1.61 6.14 0.00 -2.60 117.35 119.88 1mm4 s TYR 134 Ca 0.00 -0.07 0.00 0.00 0.64 0.00 0.00 57.07 57.64 1mm4 s TYR 134 Cb 0.00 -0.25 0.00 0.00 0.42 0.00 0.00 41.96 42.13 1mm4 s TYR 134 CO 0.00 -0.01 0.00 0.41 0.64 0.00 0.00 175.55 176.59 1mm4 n GLY 135 N 3.01 2.64 0.26 8.97 0.00 -1.26 -2.13 105.19 116.68 1mm4 n GLY 135 Ca -0.13 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 45.65 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 -6.18 1.61 0.13 -1.92 -3.41 132.00 122.23 1mm4 h PRO 136 Ca 0.00 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.53 1mm4 h PRO 136 Cb 0.00 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.03 1mm4 h PRO 136 CO 0.00 0.12 0.61 0.08 -0.23 0.00 0.00 178.00 178.58 1mm4 s VAL 137 N -3.91 4.48 -0.18 1.56 1.01 -0.91 -2.49 120.40 119.96 1mm4 s VAL 137 Ca -0.01 0.87 -0.01 0.00 0.00 0.00 0.00 61.98 62.83 1mm4 s VAL 137 Cb 0.11 -4.42 0.05 0.00 0.00 0.00 0.00 36.38 32.12 1mm4 s VAL 137 CO 0.58 -0.78 -0.02 -0.89 0.00 0.00 0.00 175.10 173.99 1mm4 s THR 138 N 3.74 0.94 -0.20 3.92 2.01 -0.48 -0.81 115.64 124.76 1mm4 s THR 138 Ca 0.38 -0.66 -0.25 0.00 0.31 0.00 0.00 61.69 61.47 1mm4 s THR 138 Cb -0.10 -1.24 -0.01 0.00 0.01 0.00 0.00 72.50 71.15 1mm4 s THR 138 CO 0.25 -0.02 0.81 0.12 -0.69 0.00 0.00 174.62 175.09 1mm4 s PHE 139 N 1.69 3.38 0.23 4.92 5.36 0.05 -1.78 117.98 131.83 1mm4 s PHE 139 Ca -0.01 1.18 0.08 0.00 -0.96 0.00 0.00 56.93 57.22 1mm4 s PHE 139 Cb -0.16 -3.00 -0.04 0.00 -0.34 0.00 0.00 43.02 39.48 1mm4 s PHE 139 CO -0.07 -0.28 0.04 1.14 -1.46 0.00 0.00 175.22 174.58 1mm4 s GLN 140 N 2.34 2.46 -0.10 10.12 -2.07 -1.06 -0.45 119.66 130.90 1mm4 s GLN 140 Ca 0.36 -1.24 0.00 0.00 -1.82 0.00 0.00 55.36 52.66 1mm4 s GLN 140 Cb -0.16 -2.31 0.02 0.00 -1.09 0.00 0.00 33.01 29.47 1mm4 s GLN 140 CO 0.11 0.40 -0.08 -1.64 -1.32 0.00 0.00 175.29 172.75 1mm4 s MET 141 N -3.47 1.52 -0.20 9.60 -1.94 -1.06 -2.58 119.30 121.18 1mm4 s MET 141 Ca 0.30 -0.28 -0.09 0.00 -1.71 0.00 0.00 55.69 53.91 1mm4 s MET 141 Cb -0.08 -1.51 -0.05 0.00 2.01 0.00 0.00 34.83 35.20 1mm4 s MET 141 CO 0.21 -0.20 0.11 0.99 -0.01 0.00 0.00 175.02 176.12 1mm4 s THR 142 N 1.46 5.24 -0.14 2.05 2.01 0.34 -2.21 115.64 124.38 1mm4 s THR 142 Ca 0.00 0.13 -0.05 0.00 0.31 0.00 0.00 61.69 62.08 1mm4 s THR 142 Cb -0.13 -3.38 -0.03 0.00 0.01 0.00 0.00 72.50 68.96 1mm4 s THR 142 CO -0.05 0.45 0.02 -0.47 -0.69 0.00 0.00 174.62 173.87 1mm4 s TYR 143 N 0.37 3.17 -0.09 4.92 6.14 -1.07 -1.69 117.35 129.10 1mm4 s TYR 143 Ca 0.07 0.01 -0.16 0.00 0.64 0.00 0.00 57.07 57.63 1mm4 s TYR 143 Cb -0.11 -1.95 -0.05 0.00 0.42 0.00 0.00 41.96 40.26 1mm4 s TYR 143 CO -0.01 0.21 0.41 -1.50 0.64 0.00 0.00 175.55 175.29 1mm4 s ILE 144 N -0.05 5.16 0.59 3.14 1.10 -1.25 -4.26 121.20 125.63 1mm4 s ILE 144 Ca 0.04 0.81 -0.17 0.00 -0.51 0.00 0.00 60.65 60.83 1mm4 s ILE 144 Cb -0.13 -3.73 -0.03 0.00 0.15 0.00 0.00 42.46 38.72 1mm4 s ILE 144 CO 0.02 0.43 1.09 -2.16 -2.11 0.00 0.00 174.94 172.21 1mm4 s PRO 145 N -0.02 3.21 -0.55 3.50 0.04 -1.26 -4.79 135.00 135.13 1mm4 s PRO 145 Ca 0.23 1.37 -0.14 0.00 0.04 0.00 0.00 61.00 62.49 1mm4 s PRO 145 Cb -0.15 -2.01 0.14 0.00 0.04 0.00 0.00 34.50 32.52 1mm4 s PRO 145 CO 0.10 -0.92 0.49 0.20 0.04 0.00 0.00 177.00 176.91 1mm4 s GLY 146 N -2.41 2.14 0.11 0.56 0.00 -1.26 -4.82 107.32 101.63 1mm4 s GLY 146 Ca 0.67 -2.62 -0.19 0.00 0.00 0.00 0.00 44.72 42.58 1mm4 s GLY 146 CO 0.34 1.19 1.67 -0.84 0.00 0.00 0.00 173.10 175.46 1mm4 h THR 147 N 5.83 1.16 0.00 0.90 2.02 -1.95 -3.46 112.91 117.40 1mm4 h THR 147 Ca -0.24 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.47 1mm4 h THR 147 Cb 1.09 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.47 1mm4 h THR 147 CO 0.97 0.16 0.00 0.00 0.37 0.00 0.00 175.52 177.02 1mm4 n TYR 148 N -4.79 -2.97 -4.35 3.16 4.19 -1.26 -5.14 117.16 106.01 1mm4 n TYR 148 Ca -0.02 0.39 -0.32 0.00 3.31 0.00 0.00 57.90 61.25 1mm4 n TYR 148 Cb 0.11 1.34 -0.09 0.00 0.49 0.00 0.00 39.34 41.20 1mm4 n TYR 148 CO 0.00 0.00 0.00 1.21 0.91 0.00 0.00 176.86 178.98 1mm4 s ASN 149 N -1.34 4.95 0.82 2.98 3.84 -1.26 -5.02 114.94 119.90 1mm4 s ASN 149 Ca 0.00 -0.05 0.00 0.00 0.21 0.00 0.00 52.86 53.02 1mm4 s ASN 149 Cb 0.00 -1.25 0.00 0.00 -0.55 0.00 0.00 41.25 39.45 1mm4 s ASN 149 CO 0.00 0.28 0.00 -3.20 -2.79 0.00 0.00 177.10 171.39 1mm4 n ASN 150 N 1.46 -6.58 0.00 -4.21 2.85 -1.26 -4.99 115.26 102.53 1mm4 n ASN 150 Ca -0.15 0.39 0.00 0.00 -0.11 0.00 0.00 54.58 54.71 1mm4 n ASN 150 Cb 0.53 -1.10 0.00 0.00 1.24 0.00 0.00 39.78 40.45 1mm4 n ASN 150 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1mm4 n GLY 151 N -1.07 1.95 1.59 8.20 0.00 -1.26 -4.64 105.19 109.96 1mm4 n GLY 151 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 0.00 3.61 -4.59 1.61 4.05 -1.26 -4.57 115.26 114.10 1mm4 n ASN 152 Ca 0.00 -3.77 -0.33 0.00 0.45 0.00 0.00 54.58 50.93 1mm4 n ASN 152 Cb 0.00 -0.67 -0.11 0.00 1.23 0.00 0.00 39.78 40.23 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 -3.64 3.69 -0.10 3.44 -7.23 -1.26 -5.11 120.40 110.19 1mm4 s VAL 153 Ca 0.50 -0.64 0.01 0.00 -1.81 0.00 0.00 61.98 60.04 1mm4 s VAL 153 Cb 0.43 -2.56 -0.02 0.00 0.56 0.00 0.00 36.38 34.79 1mm4 s VAL 153 CO 0.02 0.48 -0.11 -0.72 -0.31 0.00 0.00 175.10 174.46 1mm4 s TYR 154 N -0.92 2.83 -0.15 2.82 1.13 -1.26 -3.97 117.35 117.83 1mm4 s TYR 154 Ca 0.15 -0.35 -0.05 0.00 -1.41 0.00 0.00 57.07 55.41 1mm4 s TYR 154 Cb -0.11 -1.78 -0.04 0.00 -1.10 0.00 0.00 41.96 38.94 1mm4 s TYR 154 CO 0.05 0.02 0.02 -0.06 -2.51 0.00 0.00 175.55 173.07 1mm4 s PHE 155 N -0.15 3.19 0.23 -3.49 0.40 -0.68 -4.98 117.98 112.50 1mm4 s PHE 155 Ca 0.00 0.03 0.05 0.00 -0.60 0.00 0.00 56.93 56.42 1mm4 s PHE 155 Cb -0.13 -1.96 -0.03 0.00 0.51 0.00 0.00 43.02 41.40 1mm4 s PHE 155 CO 0.03 0.22 0.27 0.00 0.70 0.00 0.00 175.22 176.45 1mm4 s ALA 156 N -0.04 3.78 0.10 5.36 0.00 -1.26 -0.50 121.76 129.20 1mm4 s ALA 156 Ca 0.04 -1.27 -0.18 0.00 0.00 0.00 0.00 51.96 50.55 1mm4 s ALA 156 Cb -0.13 -1.56 0.04 0.00 0.00 0.00 0.00 23.12 21.48 1mm4 s ALA 156 CO 0.02 0.31 0.45 -1.58 0.00 0.00 0.00 175.76 174.95 1mm4 s TRP 157 N -1.98 -0.29 -0.12 0.00 0.52 -1.07 -4.72 118.94 111.28 1mm4 s TRP 157 Ca 0.33 0.10 -0.01 0.00 0.02 0.00 0.00 56.10 56.54 1mm4 s TRP 157 Cb -0.09 0.30 -0.02 0.00 -1.15 0.00 0.00 33.47 32.51 1mm4 s TRP 157 CO 0.27 -0.69 -0.09 1.41 0.02 0.00 0.00 176.95 177.88 1mm4 s MET 158 N -3.34 3.30 -0.23 4.98 1.75 -0.61 -2.57 119.30 122.57 1mm4 s MET 158 Ca -0.00 -0.60 0.01 0.00 -1.25 0.00 0.00 55.69 53.84 1mm4 s MET 158 Cb 0.01 -2.70 0.04 0.00 2.84 0.00 0.00 34.83 35.01 1mm4 s MET 158 CO -0.09 0.34 -0.12 0.50 -0.65 0.00 0.00 175.02 175.01 1mm4 s ARG 159 N 0.05 2.66 -0.09 4.11 3.52 -0.74 -2.59 118.95 125.88 1mm4 s ARG 159 Ca -0.02 -1.07 0.00 0.00 -0.13 0.00 0.00 55.73 54.50 1mm4 s ARG 159 Cb -0.14 -2.84 -0.03 0.00 -1.56 0.00 0.00 34.95 30.38 1mm4 s ARG 159 CO 0.04 -0.41 -0.07 0.12 -0.81 0.00 0.00 175.30 174.17 1mm4 s PHE 160 N 1.24 2.94 -0.15 5.12 2.19 -0.89 -1.39 117.98 127.04 1mm4 s PHE 160 Ca -0.02 -0.07 0.01 0.00 0.33 0.00 0.00 56.93 57.18 1mm4 s PHE 160 Cb -0.17 -1.76 0.02 0.00 -1.31 0.00 0.00 43.02 39.80 1mm4 s PHE 160 CO -0.07 0.24 -0.17 -0.65 1.83 0.00 0.00 175.22 176.40 1mm4 s GLN 161 N -0.55 2.60 0.15 10.12 -0.21 -1.04 -1.21 119.66 129.52 1mm4 s GLN 161 Ca 0.08 -0.68 0.07 0.00 0.02 0.00 0.00 55.36 54.85 1mm4 s GLN 161 Cb -0.12 -2.26 -0.04 0.00 1.00 0.00 0.00 33.01 31.59 1mm4 s GLN 161 CO 0.02 -0.17 -0.03 0.12 -2.12 0.00 0.00 175.29 173.11 1mm4 s PHE 162 N 1.25 2.82 -0.01 0.91 5.36 0.43 -4.65 117.98 124.08 1mm4 s PHE 162 Ca 0.01 -0.14 0.04 0.00 -0.96 0.00 0.00 56.93 55.88 1mm4 s PHE 162 Cb -0.14 -1.39 -0.01 0.00 -0.34 0.00 0.00 43.02 41.14 1mm4 s PHE 162 CO -0.09 0.50 -0.12 -0.51 -1.46 0.00 0.00 175.22 173.54 1mm4 s LEU 163 N -2.73 2.03 -0.22 6.12 1.43 -1.26 -1.92 118.68 122.13 1mm4 s LEU 163 Ca 0.26 -0.22 -0.29 0.00 -1.03 0.00 0.00 54.13 52.85 1mm4 s LEU 163 Cb -0.10 -0.59 0.01 0.00 0.03 0.00 0.00 46.19 45.54 1mm4 s LEU 163 CO 0.17 0.13 1.04 -1.83 0.23 0.00 0.00 176.35 176.09 1mm4 s GLU 164 N -0.32 4.28 -0.25 1.70 1.03 -1.26 -4.84 118.70 119.04 1mm4 s GLU 164 Ca 0.04 1.36 0.09 0.00 0.03 0.00 0.00 54.97 56.50 1mm4 s GLU 164 Cb -0.05 -3.63 0.30 0.00 -0.80 0.00 0.00 34.13 29.95 1mm4 s GLU 164 CO -0.00 -0.60 1.40 1.58 -1.33 0.00 0.00 175.26 176.31 1mm4 n HIS 165 N 6.18 -1.51 0.00 4.83 -0.00 -1.26 -4.96 115.22 118.50 1mm4 n HIS 165 Ca 0.12 -1.38 0.00 0.00 0.46 0.00 0.00 57.72 56.91 1mm4 n HIS 165 Cb 0.46 1.27 0.00 0.00 -0.12 0.00 0.00 29.99 31.61 1mm4 n HIS 165 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1mm4 n HIS 166 N -1.13 -0.01 -1.55 1.57 -0.00 -1.26 -5.09 115.22 107.75 1mm4 n HIS 166 Ca -0.21 0.00 -0.37 0.00 -0.00 0.00 0.00 57.72 57.15 1mm4 n HIS 166 Cb 0.83 0.00 -0.04 0.00 -0.00 0.00 0.00 29.99 30.78 1mm4 n HIS 166 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1mm4 n HIS 167 N -0.71 1.36 -3.24 1.57 -0.00 -1.26 -4.92 115.22 108.02 1mm4 n HIS 167 Ca 0.00 0.14 -0.09 0.00 -0.00 0.00 0.00 57.72 57.77 1mm4 n HIS 167 Cb 0.00 -2.62 0.02 0.00 -0.00 0.00 0.00 29.99 27.39 1mm4 n HIS 167 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1mm4 n HIS 168 N 15.50 -2.15 -2.21 4.41 -0.00 -1.26 -5.07 115.22 124.43 1mm4 n HIS 168 Ca 0.39 -0.93 -0.04 0.00 0.46 0.00 0.00 57.72 57.61 1mm4 n HIS 168 Cb 0.50 -0.22 -0.03 0.00 -0.12 0.00 0.00 29.99 30.13 1mm4 n HIS 168 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 1mm4 n HIS 169 N -1.37 -0.14 1.09 1.57 8.25 -1.26 -5.25 115.22 118.11 1mm4 n HIS 169 Ca 0.04 -0.66 0.12 0.00 -0.26 0.00 0.00 57.72 56.96 1mm4 n HIS 169 Cb 0.26 0.41 0.17 0.00 1.12 0.00 0.00 29.99 31.95 1mm4 n HIS 169 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56