#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mm5 n ASN 2 N 0.00 0.69 0.01 6.12 4.13 -1.26 -5.04 115.26 119.92 1mm5 n ASN 2 Ca 0.00 -2.12 -0.08 0.00 1.68 0.00 0.00 54.58 54.07 1mm5 n ASN 2 Cb 0.00 0.62 -0.06 0.00 -1.54 0.00 0.00 39.78 38.80 1mm5 n ASN 2 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1mm5 h ALA 3 N 1.40 -0.15 0.00 5.41 0.00 -2.06 -3.26 119.26 120.60 1mm5 h ALA 3 Ca -0.15 -0.19 -0.12 0.00 0.00 0.00 0.00 54.91 54.44 1mm5 h ALA 3 Cb 0.62 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.45 1mm5 h ALA 3 CO 0.24 -0.17 -0.57 -0.44 0.00 0.00 0.00 179.25 178.30 1mm5 h ASP 4 N -0.97 0.00 -0.97 0.00 3.32 -1.99 -3.15 116.42 112.65 1mm5 h ASP 4 Ca -0.02 0.00 0.13 0.00 0.02 0.00 0.00 57.03 57.16 1mm5 h ASP 4 Cb 0.44 0.00 -0.09 0.00 0.22 0.00 0.00 39.33 39.90 1mm5 h ASP 4 CO 0.03 0.57 0.60 -0.33 -1.72 0.00 0.00 179.24 178.38 1mm5 h GLU 5 N 0.00 0.88 -0.02 3.56 4.39 -1.97 0.28 114.58 121.70 1mm5 h GLU 5 Ca -0.01 -0.05 -0.13 0.00 0.34 0.00 0.00 59.36 59.51 1mm5 h GLU 5 Cb 1.09 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.52 1mm5 h GLU 5 CO 0.07 0.59 -0.59 -1.49 -1.16 0.00 0.00 179.01 176.43 1mm5 h TRP 6 N 0.91 0.09 -0.00 4.33 6.55 -1.59 -3.07 115.95 123.17 1mm5 h TRP 6 Ca 0.50 -0.03 -0.20 0.00 0.95 0.00 0.00 58.89 60.10 1mm5 h TRP 6 Cb 0.55 -0.02 -0.01 0.00 -0.86 0.00 0.00 29.16 28.83 1mm5 h TRP 6 CO -0.02 0.65 -0.88 1.98 -1.05 0.00 0.00 178.44 179.12 1mm5 h MET 7 N 0.05 0.27 0.35 0.49 4.05 -0.98 -2.79 114.93 116.36 1mm5 h MET 7 Ca -0.01 -0.28 -0.02 0.00 -0.28 0.00 0.00 59.70 59.12 1mm5 h MET 7 Cb 1.06 0.08 0.00 0.00 -0.80 0.00 0.00 31.60 31.94 1mm5 h MET 7 CO 0.08 0.99 -0.18 1.15 0.23 0.00 0.00 176.91 179.18 1mm5 h THR 8 N 0.15 0.64 -0.10 -0.77 2.02 -0.48 -1.94 112.91 112.43 1mm5 h THR 8 Ca -0.05 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.07 1mm5 h THR 8 Cb 1.50 0.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.54 1mm5 h THR 8 CO 0.14 0.00 -0.19 0.00 0.37 0.00 0.00 175.52 175.84 1mm5 h THR 9 N -0.48 1.19 -0.07 3.16 1.03 -1.63 -2.30 112.91 113.80 1mm5 h THR 9 Ca -0.04 -0.86 -0.05 0.00 -0.01 0.00 0.00 66.41 65.45 1mm5 h THR 9 Cb 0.38 1.32 -0.01 0.00 -1.07 0.00 0.00 68.15 68.77 1mm5 h THR 9 CO 0.07 0.26 -0.20 0.15 -0.01 0.00 0.00 175.52 175.79 1mm5 h PHE 10 N 0.15 0.12 -0.74 0.00 3.04 -1.18 -2.57 116.94 115.76 1mm5 h PHE 10 Ca 0.03 -0.01 0.07 0.00 3.98 0.00 0.00 57.97 62.04 1mm5 h PHE 10 Cb 0.43 -0.03 -0.05 0.00 2.56 0.00 0.00 35.95 38.86 1mm5 h PHE 10 CO 0.00 0.31 0.49 0.00 -2.02 0.00 0.00 178.31 177.09 1mm5 h ARG 11 N 0.11 0.73 -0.86 1.11 3.08 -0.76 -1.38 114.38 116.41 1mm5 h ARG 11 Ca 0.02 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 60.01 1mm5 h ARG 11 Cb 0.42 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 30.26 1mm5 h ARG 11 CO 0.03 0.48 0.46 0.93 -1.07 0.00 0.00 179.97 180.80 1mm5 h GLU 12 N 0.75 1.21 -0.35 0.04 5.08 -1.57 -2.00 114.58 117.74 1mm5 h GLU 12 Ca 0.33 -0.15 -0.05 0.00 -1.00 0.00 0.00 59.36 58.49 1mm5 h GLU 12 Cb 0.30 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.30 1mm5 h GLU 12 CO -0.11 0.89 -0.00 -0.91 -1.00 0.00 0.00 179.01 177.88 1mm5 h ASN 13 N 1.20 0.51 0.17 1.42 -0.26 -1.35 -2.45 115.58 114.83 1mm5 h ASN 13 Ca 0.30 -0.10 -0.14 0.00 -0.56 0.00 0.00 56.30 55.81 1mm5 h ASN 13 Cb 0.05 -0.13 -0.01 0.00 -1.06 0.00 0.00 38.32 37.16 1mm5 h ASN 13 CO -0.05 0.58 -0.50 0.40 -1.06 0.00 0.00 177.43 176.81 1mm5 h ILE 14 N 0.52 1.33 -0.23 2.81 1.08 -1.09 -2.24 117.51 119.70 1mm5 h ILE 14 Ca 0.11 -1.74 -0.01 0.00 -0.39 0.00 0.00 64.86 62.83 1mm5 h ILE 14 Cb 0.34 1.78 -0.01 0.00 -3.07 0.00 0.00 36.82 35.86 1mm5 h ILE 14 CO 0.01 0.53 0.09 0.00 -0.69 0.00 0.00 178.15 178.08 1mm5 h ALA 15 N 1.17 0.29 -0.13 1.87 0.00 -0.91 0.28 119.26 121.83 1mm5 h ALA 15 Ca 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 1mm5 h ALA 15 Cb 0.99 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 1mm5 h ALA 15 CO 0.09 -0.10 0.01 1.96 0.00 0.00 0.00 179.25 181.20 1mm5 h GLN 16 N 0.21 0.23 -0.52 0.00 7.50 -1.48 -2.79 115.11 118.26 1mm5 h GLN 16 Ca 0.07 -0.07 -0.00 0.00 0.50 0.00 0.00 58.65 59.16 1mm5 h GLN 16 Cb 0.19 -0.02 -0.03 0.00 0.05 0.00 0.00 27.48 27.67 1mm5 h GLN 16 CO -0.01 0.45 0.32 1.79 -1.50 0.00 0.00 178.83 179.89 1mm5 h THR 17 N -0.02 1.14 0.23 -0.54 1.35 -1.36 0.13 112.91 113.84 1mm5 h THR 17 Ca 0.04 -0.30 -0.01 0.00 -0.55 0.00 0.00 66.41 65.59 1mm5 h THR 17 Cb 0.34 0.40 0.00 0.00 -1.73 0.00 0.00 68.15 67.17 1mm5 h THR 17 CO 0.01 0.15 -0.11 -0.50 -0.25 0.00 0.00 175.52 174.81 1mm5 h TRP 18 N 0.71 -0.29 -0.75 4.73 -0.00 -0.76 -3.42 115.95 116.17 1mm5 h TRP 18 Ca 0.19 -0.01 -0.09 0.00 -0.00 0.00 0.00 58.89 58.98 1mm5 h TRP 18 Cb -0.05 0.10 -0.16 0.00 -0.00 0.00 0.00 29.16 29.05 1mm5 h TRP 18 CO 0.00 -0.18 -0.38 1.14 -0.00 0.00 0.00 178.44 179.03 1mm5 s GLN 19 N -6.12 0.80 -0.42 0.49 0.00 -1.04 -5.11 119.66 108.26 1mm5 s GLN 19 Ca -0.15 -0.77 -0.21 0.00 -0.00 0.00 0.00 55.36 54.24 1mm5 s GLN 19 Cb 0.05 -0.03 0.02 0.00 0.00 0.00 0.00 33.01 33.05 1mm5 s GLN 19 CO 0.65 -1.00 0.63 1.14 0.00 0.00 0.00 175.29 176.72 1mm5 s GLN 20 N 0.96 3.36 0.27 9.60 -2.07 0.43 -4.84 119.66 127.38 1mm5 s GLN 20 Ca 0.27 -0.29 -0.29 0.00 -1.82 0.00 0.00 55.36 53.23 1mm5 s GLN 20 Cb 0.04 -3.92 -0.14 0.00 -1.09 0.00 0.00 33.01 27.90 1mm5 s GLN 20 CO -0.07 -0.94 1.16 -2.30 -1.32 0.00 0.00 175.29 171.82 1mm5 n PRO 21 N 6.20 1.60 -2.90 9.60 -0.02 -1.26 -4.97 135.00 143.25 1mm5 n PRO 21 Ca -0.02 0.57 -0.10 0.00 -2.02 0.00 0.00 63.50 61.93 1mm5 n PRO 21 Cb 0.48 -2.05 -0.01 0.00 -0.02 0.00 0.00 33.50 31.90 1mm5 n PRO 21 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1mm5 n GLU 22 N 1.10 0.50 -3.41 -0.52 0.28 -1.26 -4.95 120.64 112.39 1mm5 n GLU 22 Ca 0.10 -2.28 -0.32 0.00 -0.16 0.00 0.00 57.16 54.50 1mm5 n GLU 22 Cb 0.31 -1.50 -0.05 0.00 1.43 0.00 0.00 31.44 31.63 1mm5 n GLU 22 CO 0.00 0.00 0.00 -1.01 -0.16 0.00 0.00 177.13 175.96 1mm5 s HIS 23 N 0.60 3.44 -0.44 -1.84 3.76 -1.26 -4.94 115.29 114.62 1mm5 s HIS 23 Ca 0.31 0.90 -0.12 0.00 -0.15 0.00 0.00 55.06 56.00 1mm5 s HIS 23 Cb 0.04 -2.27 0.07 0.00 1.11 0.00 0.00 32.58 31.53 1mm5 s HIS 23 CO -0.11 0.28 0.31 0.71 -0.85 0.00 0.00 174.74 175.08 1mm5 s TYR 24 N -1.79 3.30 -0.10 1.40 1.51 -1.02 -4.51 117.35 116.14 1mm5 s TYR 24 Ca 0.47 -1.26 0.01 0.00 -1.01 0.00 0.00 57.07 55.27 1mm5 s TYR 24 Cb -0.11 -3.02 -0.02 0.00 -0.11 0.00 0.00 41.96 38.69 1mm5 s TYR 24 CO 0.21 -0.82 -0.12 -0.51 -1.11 0.00 0.00 175.55 173.20 1mm5 s ASP 25 N 2.29 4.17 0.03 2.29 -0.00 -1.07 -2.15 116.67 122.23 1mm5 s ASP 25 Ca 0.03 -0.23 0.00 0.00 -0.00 0.00 0.00 52.55 52.35 1mm5 s ASP 25 Cb -0.23 -1.36 -0.04 0.00 -0.00 0.00 0.00 42.92 41.29 1mm5 s ASP 25 CO 0.04 0.24 0.13 -0.76 -0.00 0.00 0.00 175.17 174.83 1mm5 s LEU 26 N -0.10 4.09 -0.01 1.23 1.02 -1.03 -1.28 118.68 122.61 1mm5 s LEU 26 Ca -0.01 0.18 0.00 0.00 0.02 0.00 0.00 54.13 54.32 1mm5 s LEU 26 Cb -0.14 -2.57 0.01 0.00 0.02 0.00 0.00 46.19 43.52 1mm5 s LEU 26 CO 0.03 0.22 0.00 -0.31 0.02 0.00 0.00 176.35 176.32 1mm5 s TYR 27 N -1.35 0.14 -0.22 0.29 2.02 0.01 -1.84 117.35 116.39 1mm5 s TYR 27 Ca 0.28 0.02 -0.15 0.00 -0.37 0.00 0.00 57.07 56.86 1mm5 s TYR 27 Cb -0.12 -0.19 0.07 0.00 -0.40 0.00 0.00 41.96 41.31 1mm5 s TYR 27 CO 0.20 -0.05 0.56 0.96 -1.57 0.00 0.00 175.55 175.65 1mm5 s ILE 28 N 0.50 -0.01 1.07 2.71 -4.36 -0.63 -0.65 121.20 119.82 1mm5 s ILE 28 Ca -0.04 0.03 -0.16 0.00 -0.26 0.00 0.00 60.65 60.21 1mm5 s ILE 28 Cb -0.07 -0.81 0.10 0.00 1.25 0.00 0.00 42.46 42.93 1mm5 s ILE 28 CO -0.01 0.01 0.19 -2.65 0.24 0.00 0.00 174.94 172.72 1mm5 n PRO 29 N 3.85 -1.25 0.13 0.37 -0.02 -1.26 -0.58 135.00 136.24 1mm5 n PRO 29 Ca -0.19 -0.34 0.00 0.00 -2.02 0.00 0.00 63.50 60.95 1mm5 n PRO 29 Cb 0.57 -1.78 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 1mm5 n PRO 29 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1mm5 n ALA 30 N -4.21 1.69 -3.72 3.55 0.00 -1.15 -4.54 120.51 112.13 1mm5 n ALA 30 Ca 0.03 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.26 1mm5 n ALA 30 Cb 0.59 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.87 1mm5 n ALA 30 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1mm5 s ILE 31 N -1.67 0.34 0.28 0.00 1.01 -1.24 -5.07 121.20 114.85 1mm5 s ILE 31 Ca 0.00 0.08 0.09 0.00 0.00 0.00 0.00 60.65 60.81 1mm5 s ILE 31 Cb 0.00 -0.46 -0.06 0.00 0.01 0.00 0.00 42.46 41.96 1mm5 s ILE 31 CO 0.00 0.22 -0.11 0.28 0.00 0.00 0.00 174.94 175.33 1mm5 s THR 32 N 1.53 1.97 -0.21 2.92 -1.32 -1.26 -1.81 115.64 117.46 1mm5 s THR 32 Ca -0.02 -2.21 -0.24 0.00 -1.21 0.00 0.00 61.69 58.01 1mm5 s THR 32 Cb -0.13 -2.41 -0.01 0.00 -1.51 0.00 0.00 72.50 68.44 1mm5 s THR 32 CO -0.03 -0.34 0.77 0.86 -2.21 0.00 0.00 174.62 173.67 1mm5 s TRP 33 N -2.81 3.36 -0.06 9.09 -0.00 -1.25 -5.03 118.94 122.23 1mm5 s TRP 33 Ca 0.29 1.11 -0.22 0.00 -0.00 0.00 0.00 56.10 57.28 1mm5 s TRP 33 Cb 0.01 -2.97 -0.04 0.00 -0.00 0.00 0.00 33.47 30.47 1mm5 s TRP 33 CO 0.13 -0.29 0.63 -1.01 -0.00 0.00 0.00 176.95 176.40 1mm5 s HIS 34 N 2.38 3.59 0.39 5.86 3.76 -1.26 -5.03 115.29 124.98 1mm5 s HIS 34 Ca 0.34 1.15 0.08 0.00 -0.15 0.00 0.00 55.06 56.48 1mm5 s HIS 34 Cb -0.16 -2.70 -0.03 0.00 1.11 0.00 0.00 32.58 30.80 1mm5 s HIS 34 CO 0.10 0.16 0.29 0.00 -0.85 0.00 0.00 174.74 174.44 1mm5 s ALA 35 N 0.54 3.85 -0.05 -1.40 0.00 -1.26 -5.04 121.76 118.40 1mm5 s ALA 35 Ca 0.33 -1.87 0.13 0.00 0.00 0.00 0.00 51.96 50.55 1mm5 s ALA 35 Cb -0.17 -0.89 -0.17 0.00 0.00 0.00 0.00 23.12 21.89 1mm5 s ALA 35 CO 0.16 -0.13 0.90 -0.09 0.00 0.00 0.00 175.76 176.60 1mm5 h ARG 36 N 1.22 0.00 -2.58 0.00 2.43 -2.01 -3.37 114.38 110.07 1mm5 h ARG 36 Ca -0.43 0.00 -0.58 0.00 -0.81 0.00 0.00 59.98 58.16 1mm5 h ARG 36 Cb 1.26 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 30.75 1mm5 h ARG 36 CO 0.61 0.52 2.24 1.19 -1.51 0.00 0.00 179.97 183.02 1mm5 n PHE 37 N -3.07 1.94 -3.03 2.20 3.01 -1.26 -4.91 117.46 112.35 1mm5 n PHE 37 Ca -0.10 -2.59 -0.12 0.00 1.01 0.00 0.00 57.45 55.66 1mm5 n PHE 37 Cb 0.94 -2.00 0.04 0.00 -0.01 0.00 0.00 39.48 38.45 1mm5 n PHE 37 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1mm5 n ALA 38 N 2.49 0.76 -2.26 4.37 0.00 -1.26 -4.99 120.51 119.62 1mm5 n ALA 38 Ca 0.64 -1.29 -0.33 0.00 0.00 0.00 0.00 53.44 52.46 1mm5 n ALA 38 Cb 0.40 0.35 -0.04 0.00 0.00 0.00 0.00 19.45 20.16 1mm5 n ALA 38 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1mm5 s TYR 39 N -1.21 2.18 -0.10 0.00 5.04 -1.26 -4.92 117.35 117.07 1mm5 s TYR 39 Ca 0.37 -0.14 0.02 0.00 -2.44 0.00 0.00 57.07 54.89 1mm5 s TYR 39 Cb -0.03 -4.30 0.01 0.00 0.35 0.00 0.00 41.96 37.99 1mm5 s TYR 39 CO 0.24 -1.64 -0.17 0.16 -1.34 0.00 0.00 175.55 172.80 1mm5 s ASP 40 N 6.26 2.51 0.00 4.32 1.47 -1.26 -4.96 116.67 125.01 1mm5 s ASP 40 Ca 0.62 -0.45 0.00 0.00 1.18 0.00 0.00 52.55 53.90 1mm5 s ASP 40 Cb -0.02 -1.14 0.00 0.00 -0.34 0.00 0.00 42.92 41.43 1mm5 s ASP 40 CO 0.03 0.04 0.00 0.29 0.68 0.00 0.00 175.17 176.21 1mm5 n LYS 41 N 4.04 0.00 0.14 2.11 4.76 -1.26 -5.10 118.16 122.85 1mm5 n LYS 41 Ca -0.20 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.24 1mm5 n LYS 41 Cb 0.52 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.71 1mm5 n LYS 41 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 1mm5 n GLU 42 N -1.79 0.00 -1.21 1.97 1.02 -1.26 -4.95 120.64 114.43 1mm5 n GLU 42 Ca 0.00 0.00 -0.26 0.00 -0.02 0.00 0.00 57.16 56.88 1mm5 n GLU 42 Cb 0.00 0.00 0.15 0.00 -0.02 0.00 0.00 31.44 31.57 1mm5 n GLU 42 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1mm5 n LYS 43 N -3.24 2.30 -1.43 3.49 4.01 -1.26 -4.23 118.16 117.80 1mm5 n LYS 43 Ca 0.00 -2.94 0.02 0.00 -0.51 0.00 0.00 58.31 54.88 1mm5 n LYS 43 Cb 0.00 -2.15 0.08 0.00 -0.51 0.00 0.00 35.03 32.44 1mm5 n LYS 43 CO 0.00 0.00 0.00 0.25 -1.11 0.00 0.00 177.40 176.54 1mm5 n THR 44 N -1.01 0.94 -3.72 -0.18 -2.24 -1.26 -4.94 114.28 101.87 1mm5 n THR 44 Ca 0.58 -2.07 -0.28 0.00 -2.27 0.00 0.00 64.05 60.02 1mm5 n THR 44 Cb 1.37 0.55 -0.11 0.00 -2.10 0.00 0.00 70.33 70.05 1mm5 n THR 44 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1mm5 n ASP 45 N -0.17 3.02 0.06 3.42 8.00 -1.26 -4.82 116.55 124.81 1mm5 n ASP 45 Ca 0.12 -3.23 0.00 0.00 0.71 0.00 0.00 54.79 52.39 1mm5 n ASP 45 Cb 0.97 -0.72 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 1mm5 n ASP 45 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 1mm5 n ARG 46 N 1.65 0.00 -3.87 -1.24 3.00 -1.26 -5.13 116.66 109.81 1mm5 n ARG 46 Ca 0.23 0.00 -0.09 0.00 -0.00 0.00 0.00 57.85 58.00 1mm5 n ARG 46 Cb 0.38 -0.42 -0.07 0.00 0.00 0.00 0.00 32.46 32.34 1mm5 n ARG 46 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 1mm5 s TYR 47 N -2.00 0.18 0.81 -0.14 2.02 -1.26 -5.17 117.35 111.79 1mm5 s TYR 47 Ca 0.00 -0.61 -0.12 0.00 -0.37 0.00 0.00 57.07 55.97 1mm5 s TYR 47 Cb 0.00 -0.08 0.07 0.00 -0.40 0.00 0.00 41.96 41.56 1mm5 s TYR 47 CO 0.00 -0.54 1.10 -0.80 -1.57 0.00 0.00 175.55 173.74 1mm5 s ASN 48 N -2.87 4.42 0.22 2.29 0.01 -1.26 -5.06 114.94 112.69 1mm5 s ASN 48 Ca 0.05 1.29 0.03 0.00 -0.71 0.00 0.00 52.86 53.53 1mm5 s ASN 48 Cb 0.05 -2.02 -0.03 0.00 0.41 0.00 0.00 41.25 39.66 1mm5 s ASN 48 CO -0.11 -2.01 0.36 -1.61 -1.51 0.00 0.00 177.10 172.22 1mm5 s GLU 49 N -5.16 3.45 -0.36 -0.60 2.02 -1.26 -5.09 118.70 111.71 1mm5 s GLU 49 Ca 0.61 -0.62 0.01 0.00 0.02 0.00 0.00 54.97 54.99 1mm5 s GLU 49 Cb -0.14 -2.88 0.14 0.00 0.10 0.00 0.00 34.13 31.35 1mm5 s GLU 49 CO 0.54 0.43 0.25 1.03 0.02 0.00 0.00 175.26 177.53 1mm5 s ARG 50 N -3.71 0.58 0.78 1.61 1.81 -1.26 -5.14 118.95 113.62 1mm5 s ARG 50 Ca 0.35 -1.25 -0.15 0.00 -1.72 0.00 0.00 55.73 52.96 1mm5 s ARG 50 Cb -0.10 -1.16 -0.03 0.00 -0.45 0.00 0.00 34.95 33.21 1mm5 s ARG 50 CO 0.30 -1.21 0.43 -2.30 -0.68 0.00 0.00 175.30 171.83 1mm5 n PRO 51 N 4.04 0.14 -1.14 3.54 -0.02 -1.26 -4.91 135.00 135.40 1mm5 n PRO 51 Ca 0.12 0.09 -0.20 0.00 -2.02 0.00 0.00 63.50 61.50 1mm5 n PRO 51 Cb 0.39 -1.78 0.18 0.00 -0.02 0.00 0.00 33.50 32.27 1mm5 n PRO 51 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 1mm5 n TRP 52 N -2.65 2.61 -2.29 6.00 8.01 -1.10 -5.00 117.44 123.03 1mm5 n TRP 52 Ca 0.09 -1.83 -0.32 0.00 -1.31 0.00 0.00 57.50 54.12 1mm5 n TRP 52 Cb 0.51 -0.85 -0.02 0.00 -2.01 0.00 0.00 31.31 28.93 1mm5 n TRP 52 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.69 176.88 1mm5 s GLY 53 N -1.62 2.03 0.09 6.99 0.00 -1.26 -4.63 107.32 108.92 1mm5 s GLY 53 Ca 0.54 0.19 0.10 0.00 0.00 0.00 0.00 44.72 45.55 1mm5 s GLY 53 CO 0.08 0.47 -0.24 -0.32 0.00 0.00 0.00 173.10 173.09 1mm5 s GLY 54 N -3.14 1.55 0.04 0.20 0.00 -1.00 -4.98 107.32 99.99 1mm5 s GLY 54 Ca 0.59 -1.36 0.04 0.00 0.00 0.00 0.00 44.72 43.99 1mm5 s GLY 54 CO 0.34 -1.30 -0.04 -0.32 0.00 0.00 0.00 173.10 171.78 1mm5 s GLY 55 N -1.78 1.82 0.20 0.20 0.00 0.17 -2.60 107.32 105.34 1mm5 s GLY 55 Ca 0.14 -1.06 -0.14 0.00 0.00 0.00 0.00 44.72 43.67 1mm5 s GLY 55 CO 0.06 -0.96 0.44 -1.36 0.00 0.00 0.00 173.10 171.28 1mm5 s PHE 56 N -1.12 0.17 0.11 1.90 0.08 0.56 -0.81 117.98 118.87 1mm5 s PHE 56 Ca 0.20 -0.53 -0.24 0.00 0.12 0.00 0.00 56.93 56.48 1mm5 s PHE 56 Cb -0.11 0.20 0.06 0.00 -0.57 0.00 0.00 43.02 42.61 1mm5 s PHE 56 CO 0.11 -0.89 0.59 0.20 -0.10 0.00 0.00 175.22 175.14 1mm5 s GLY 57 N -2.94 -0.56 0.06 4.36 0.00 -0.40 -2.60 107.32 105.23 1mm5 s GLY 57 Ca 0.15 0.60 0.07 0.00 0.00 0.00 0.00 44.72 45.54 1mm5 s GLY 57 CO 0.02 0.28 -0.18 1.08 0.00 0.00 0.00 173.10 174.29 1mm5 s LEU 58 N -2.38 2.21 0.11 0.66 2.01 -1.07 -2.59 118.68 117.63 1mm5 s LEU 58 Ca -0.02 -0.55 -0.02 0.00 0.01 0.00 0.00 54.13 53.55 1mm5 s LEU 58 Cb -0.01 -0.79 -0.05 0.00 0.01 0.00 0.00 46.19 45.36 1mm5 s LEU 58 CO -0.07 0.07 0.30 -0.55 1.01 0.00 0.00 176.35 177.11 1mm5 s SER 59 N -1.41 6.42 0.17 2.29 0.15 -1.26 -2.15 113.70 117.90 1mm5 s SER 59 Ca 0.04 0.41 -0.22 0.00 0.70 0.00 0.00 55.95 56.89 1mm5 s SER 59 Cb -0.09 -2.02 0.06 0.00 -1.71 0.00 0.00 66.02 62.27 1mm5 s SER 59 CO 0.02 0.09 0.59 -0.60 1.20 0.00 0.00 173.24 174.55 1mm5 s ARG 60 N -2.70 1.31 -0.03 5.44 3.52 0.46 -4.72 118.95 122.24 1mm5 s ARG 60 Ca 0.38 -0.54 0.05 0.00 -0.13 0.00 0.00 55.73 55.49 1mm5 s ARG 60 Cb -0.12 0.58 -0.01 0.00 -1.56 0.00 0.00 34.95 33.84 1mm5 s ARG 60 CO 0.27 -0.57 -0.18 1.67 -0.81 0.00 0.00 175.30 175.68 1mm5 s TRP 61 N -3.77 1.66 -0.12 5.12 1.48 -1.26 -1.16 118.94 120.90 1mm5 s TRP 61 Ca 0.02 -0.40 -0.10 0.00 -1.06 0.00 0.00 56.10 54.56 1mm5 s TRP 61 Cb -0.01 -1.10 -0.05 0.00 -1.16 0.00 0.00 33.47 31.15 1mm5 s TRP 61 CO -0.11 -0.10 0.21 0.34 -4.06 0.00 0.00 176.95 173.22 1mm5 s ASP 62 N -0.17 6.44 0.63 -2.66 3.68 0.49 -4.87 116.67 120.21 1mm5 s ASP 62 Ca 0.01 0.52 0.29 0.00 2.13 0.00 0.00 52.55 55.50 1mm5 s ASP 62 Cb -0.09 -2.12 1.55 0.00 -1.45 0.00 0.00 42.92 40.81 1mm5 s ASP 62 CO 0.01 0.31 1.91 -0.33 0.13 0.00 0.00 175.17 177.20 1mm5 h GLU 63 N 5.44 0.00 -1.24 4.34 4.39 -2.01 -0.14 114.58 125.36 1mm5 h GLU 63 Ca -0.50 0.00 -0.31 0.00 0.34 0.00 0.00 59.36 58.89 1mm5 h GLU 63 Cb 1.21 0.00 -0.16 0.00 -0.10 0.00 0.00 28.75 29.70 1mm5 h GLU 63 CO 0.64 0.00 0.40 1.17 -1.16 0.00 0.00 179.01 180.06 1mm5 n LYS 64 N -3.27 1.77 -3.86 2.33 4.81 -1.26 -4.83 118.16 113.84 1mm5 n LYS 64 Ca 0.02 -1.64 -0.27 0.00 -0.87 0.00 0.00 58.31 55.55 1mm5 n LYS 64 Cb 0.50 -1.64 0.02 0.00 0.02 0.00 0.00 35.03 33.93 1mm5 n LYS 64 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1mm5 n GLY 65 N -0.05 -0.42 3.45 3.14 0.00 -0.08 -4.98 105.19 106.24 1mm5 n GLY 65 Ca 0.32 0.17 -0.23 0.00 0.00 0.00 0.00 46.02 46.28 1mm5 n GLY 65 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1mm5 s ASN 66 N -3.68 3.30 -0.22 1.61 -0.87 -1.09 -4.97 114.94 109.01 1mm5 s ASN 66 Ca 0.43 -1.06 -0.08 0.00 -1.57 0.00 0.00 52.86 50.57 1mm5 s ASN 66 Cb -0.22 -0.26 -0.04 0.00 -0.02 0.00 0.00 41.25 40.72 1mm5 s ASN 66 CO 0.83 -0.07 0.10 0.86 -2.57 0.00 0.00 177.10 176.25 1mm5 s TRP 67 N -2.67 3.22 0.28 2.20 -0.00 -0.98 -0.38 118.94 120.60 1mm5 s TRP 67 Ca 0.28 -0.02 0.11 0.00 -0.00 0.00 0.00 56.10 56.48 1mm5 s TRP 67 Cb -0.02 -2.19 -0.05 0.00 -0.00 0.00 0.00 33.47 31.20 1mm5 s TRP 67 CO 0.13 -0.03 -0.16 -1.01 -0.00 0.00 0.00 176.95 175.88 1mm5 s HIS 68 N 1.00 2.38 -0.29 5.86 3.76 -0.31 -1.76 115.29 125.93 1mm5 s HIS 68 Ca 0.05 -0.31 -0.16 0.00 -0.15 0.00 0.00 55.06 54.49 1mm5 s HIS 68 Cb -0.14 -1.04 0.13 0.00 1.11 0.00 0.00 32.58 32.65 1mm5 s HIS 68 CO 0.03 0.69 0.92 0.20 -0.85 0.00 0.00 174.74 175.74 1mm5 s GLY 69 N -3.54 -0.13 0.65 -2.22 0.00 -1.07 -0.40 107.32 100.61 1mm5 s GLY 69 Ca 0.30 2.98 -0.10 0.00 0.00 0.00 0.00 44.72 47.91 1mm5 s GLY 69 CO 0.16 2.53 1.02 1.08 0.00 0.00 0.00 173.10 177.89 1mm5 s LEU 70 N 1.36 3.09 -0.19 0.66 1.02 -0.91 -0.39 118.68 123.31 1mm5 s LEU 70 Ca -0.09 1.08 0.01 0.00 0.02 0.00 0.00 54.13 55.15 1mm5 s LEU 70 Cb -0.04 -3.94 0.02 0.00 0.02 0.00 0.00 46.19 42.26 1mm5 s LEU 70 CO -0.16 -1.14 -0.19 -0.31 0.02 0.00 0.00 176.35 174.58 1mm5 s TYR 71 N -3.20 2.84 -0.25 0.29 1.51 -1.00 -2.60 117.35 114.95 1mm5 s TYR 71 Ca 0.56 -1.73 0.02 0.00 -1.01 0.00 0.00 57.07 54.91 1mm5 s TYR 71 Cb -0.11 -1.92 0.06 0.00 -0.11 0.00 0.00 41.96 39.88 1mm5 s TYR 71 CO 0.50 -0.82 -0.08 0.00 -1.11 0.00 0.00 175.55 174.04 1mm5 s ALA 72 N 1.27 2.30 0.21 3.71 0.00 -1.07 -2.64 121.76 125.54 1mm5 s ALA 72 Ca 0.03 -1.60 -0.04 0.00 0.00 0.00 0.00 51.96 50.35 1mm5 s ALA 72 Cb -0.14 -1.52 -0.03 0.00 0.00 0.00 0.00 23.12 21.43 1mm5 s ALA 72 CO -0.12 -1.20 0.23 -1.64 0.00 0.00 0.00 175.76 173.03 1mm5 s MET 73 N 1.23 1.30 -0.21 0.00 -1.94 -1.08 -0.32 119.30 118.27 1mm5 s MET 73 Ca -0.07 -1.51 -0.11 0.00 -1.71 0.00 0.00 55.69 52.28 1mm5 s MET 73 Cb -0.19 0.33 0.07 0.00 2.01 0.00 0.00 34.83 37.04 1mm5 s MET 73 CO -0.06 -0.46 0.50 0.00 -0.01 0.00 0.00 175.02 175.00 1mm5 s ALA 74 N -4.12 -1.32 -0.31 3.03 0.00 -1.07 -0.78 121.76 117.19 1mm5 s ALA 74 Ca 0.34 1.83 -0.08 0.00 0.00 0.00 0.00 51.96 54.04 1mm5 s ALA 74 Cb 0.05 -1.10 0.01 0.00 0.00 0.00 0.00 23.12 22.08 1mm5 s ALA 74 CO 0.11 -0.31 0.12 0.12 0.00 0.00 0.00 175.76 175.80 1mm5 s PHE 75 N 1.49 3.18 -0.34 0.00 5.36 -1.07 -2.38 117.98 124.22 1mm5 s PHE 75 Ca -0.10 -0.87 0.01 0.00 -0.96 0.00 0.00 56.93 55.01 1mm5 s PHE 75 Cb -0.07 -2.31 0.11 0.00 -0.34 0.00 0.00 43.02 40.40 1mm5 s PHE 75 CO -0.15 -0.56 0.11 0.21 -1.46 0.00 0.00 175.22 173.37 1mm5 s LYS 76 N 1.54 0.96 0.80 10.12 2.20 -1.26 -2.23 119.74 131.87 1mm5 s LYS 76 Ca 0.03 -1.39 -0.04 0.00 -0.36 0.00 0.00 55.97 54.21 1mm5 s LYS 76 Cb -0.18 -2.29 0.16 0.00 -1.51 0.00 0.00 37.83 34.02 1mm5 s LYS 76 CO 0.04 -1.01 1.10 -0.51 -0.36 0.00 0.00 175.35 174.61 1mm5 s ASP 77 N 1.26 3.88 0.00 1.43 1.11 -1.26 -2.70 116.67 120.38 1mm5 s ASP 77 Ca 0.11 -0.36 0.31 0.00 0.18 0.00 0.00 52.55 52.80 1mm5 s ASP 77 Cb -0.19 0.16 1.67 0.00 1.07 0.00 0.00 42.92 45.63 1mm5 s ASP 77 CO -0.18 -2.20 2.12 -1.20 1.18 0.00 0.00 175.17 174.89 1mm5 n SER 78 N -3.11 0.07 0.00 0.27 7.64 -1.26 -4.28 113.62 112.95 1mm5 n SER 78 Ca 0.17 -0.60 0.00 0.00 1.01 0.00 0.00 58.87 59.45 1mm5 n SER 78 Cb 0.60 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 1mm5 n SER 78 CO 0.00 0.00 0.00 1.87 -3.01 0.00 0.00 175.04 173.90 1mm5 n TRP 79 N -1.10 0.00 -0.02 1.43 -0.00 -1.26 -5.11 117.44 111.39 1mm5 n TRP 79 Ca 0.19 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.69 1mm5 n TRP 79 Cb 0.19 0.30 0.00 0.00 -0.00 0.00 0.00 31.31 31.79 1mm5 n TRP 79 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1mm5 n ASN 80 N -2.38 -0.93 -4.43 5.87 2.85 -1.26 -5.06 115.26 109.91 1mm5 n ASN 80 Ca 0.00 -0.02 -0.21 0.00 -0.11 0.00 0.00 54.58 54.24 1mm5 n ASN 80 Cb 0.11 0.00 -0.10 0.00 1.24 0.00 0.00 39.78 41.02 1mm5 n ASN 80 CO 0.00 0.00 0.00 -1.59 -2.11 0.00 0.00 177.26 173.56 1mm5 s LYS 81 N -1.45 1.56 0.18 1.20 -2.85 -1.26 -4.57 119.74 112.55 1mm5 s LYS 81 Ca 0.00 -1.80 -0.31 0.00 -1.00 0.00 0.00 55.97 52.86 1mm5 s LYS 81 Cb 0.00 -1.12 -0.09 0.00 -2.06 0.00 0.00 37.83 34.55 1mm5 s LYS 81 CO 0.00 0.01 1.44 1.67 0.10 0.00 0.00 175.35 178.57 1mm5 s TRP 82 N -3.04 3.13 -0.32 1.78 -2.14 -1.24 -4.49 118.94 112.62 1mm5 s TRP 82 Ca 0.30 0.93 -0.01 0.00 2.66 0.00 0.00 56.10 59.98 1mm5 s TRP 82 Cb 0.04 -3.77 0.10 0.00 -3.10 0.00 0.00 33.47 26.74 1mm5 s TRP 82 CO 0.12 -2.66 0.12 -2.00 -2.66 0.00 0.00 176.95 169.87 1mm5 s GLU 83 N 0.50 0.69 0.66 3.25 2.12 -0.95 -4.92 118.70 120.05 1mm5 s GLU 83 Ca 0.63 -1.09 -0.14 0.00 0.36 0.00 0.00 54.97 54.73 1mm5 s GLU 83 Cb -0.40 -1.89 -0.00 0.00 0.26 0.00 0.00 34.13 32.10 1mm5 s GLU 83 CO 0.35 -1.01 1.08 -1.25 -0.54 0.00 0.00 175.26 173.89 1mm5 s PRO 84 N 1.55 2.89 -0.04 4.30 0.04 -1.26 -2.59 135.00 139.89 1mm5 s PRO 84 Ca 0.11 1.23 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1mm5 s PRO 84 Cb -0.18 -1.97 0.03 0.00 0.04 0.00 0.00 34.50 32.42 1mm5 s PRO 84 CO -0.24 -1.16 0.00 0.42 0.04 0.00 0.00 177.00 176.07 1mm5 s ILE 85 N -2.57 0.21 -0.08 0.56 1.09 0.04 -2.58 121.20 117.87 1mm5 s ILE 85 Ca 0.64 0.10 -0.02 0.00 -1.10 0.00 0.00 60.65 60.27 1mm5 s ILE 85 Cb -0.18 -0.32 0.04 0.00 -1.06 0.00 0.00 42.46 40.94 1mm5 s ILE 85 CO 0.44 0.17 0.05 0.00 -0.10 0.00 0.00 174.94 175.50 1mm5 s ALA 86 N 1.24 0.46 0.00 9.38 0.00 -0.96 -2.64 121.76 129.23 1mm5 s ALA 86 Ca -0.07 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 51.85 1mm5 s ALA 86 Cb -0.13 -0.76 0.00 0.00 0.00 0.00 0.00 23.12 22.22 1mm5 s ALA 86 CO -0.02 -0.64 0.00 0.41 0.00 0.00 0.00 175.76 175.51 1mm5 n GLY 87 N 5.23 3.89 3.52 0.00 0.00 -1.08 -2.59 105.19 114.15 1mm5 n GLY 87 Ca -0.05 -0.87 -0.13 0.00 0.00 0.00 0.00 46.02 44.97 1mm5 n GLY 87 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1mm5 s TYR 88 N -1.54 -0.71 0.19 1.61 -0.85 -0.71 -2.37 117.35 112.98 1mm5 s TYR 88 Ca 0.00 1.68 0.10 0.00 -0.52 0.00 0.00 57.07 58.33 1mm5 s TYR 88 Cb 0.00 0.28 -0.04 0.00 0.38 0.00 0.00 41.96 42.57 1mm5 s TYR 88 CO 0.00 -0.35 -0.20 0.20 -1.52 0.00 0.00 175.55 173.68 1mm5 s GLY 89 N 0.53 1.58 -0.23 5.49 0.00 0.48 -2.59 107.32 112.58 1mm5 s GLY 89 Ca -0.02 -1.61 -0.01 0.00 0.00 0.00 0.00 44.72 43.08 1mm5 s GLY 89 CO -0.02 -1.66 -0.09 0.86 0.00 0.00 0.00 173.10 172.19 1mm5 s TRP 90 N -2.05 3.00 0.20 1.90 -0.00 -0.69 -2.59 118.94 118.71 1mm5 s TRP 90 Ca 0.20 -1.50 -0.07 0.00 -0.00 0.00 0.00 56.10 54.73 1mm5 s TRP 90 Cb -0.06 -2.03 -0.02 0.00 -0.00 0.00 0.00 33.47 31.36 1mm5 s TRP 90 CO 0.09 -0.72 0.27 -1.21 -0.00 0.00 0.00 176.95 175.38 1mm5 s GLU 91 N 1.33 1.26 -0.18 5.86 2.02 -0.72 -1.15 118.70 127.12 1mm5 s GLU 91 Ca 0.02 -1.36 -0.01 0.00 0.02 0.00 0.00 54.97 53.64 1mm5 s GLU 91 Cb -0.16 0.36 0.05 0.00 0.10 0.00 0.00 34.13 34.48 1mm5 s GLU 91 CO -0.06 -0.46 -0.03 -1.12 0.02 0.00 0.00 175.26 173.61 1mm5 s SER 92 N -3.05 3.00 -0.08 -0.19 0.01 -0.47 -2.33 113.70 110.59 1mm5 s SER 92 Ca 0.26 -0.78 -0.14 0.00 1.31 0.00 0.00 55.95 56.61 1mm5 s SER 92 Cb 0.04 -0.88 -0.05 0.00 0.21 0.00 0.00 66.02 65.34 1mm5 s SER 92 CO 0.06 -0.22 0.33 0.42 0.41 0.00 0.00 173.24 174.25 1mm5 s THR 93 N 1.65 5.21 -0.14 1.44 -4.23 -1.26 -2.59 115.64 115.71 1mm5 s THR 93 Ca -0.01 0.66 -0.02 0.00 -1.18 0.00 0.00 61.69 61.13 1mm5 s THR 93 Cb -0.16 -3.65 0.05 0.00 1.34 0.00 0.00 72.50 70.08 1mm5 s THR 93 CO -0.07 0.50 0.03 0.26 -0.54 0.00 0.00 174.62 174.79 1mm5 s TRP 94 N -0.38 0.81 -0.13 3.99 0.52 0.43 -4.98 118.94 119.20 1mm5 s TRP 94 Ca 0.20 -0.54 -0.12 0.00 0.02 0.00 0.00 56.10 55.66 1mm5 s TRP 94 Cb -0.15 -0.91 -0.05 0.00 -1.15 0.00 0.00 33.47 31.22 1mm5 s TRP 94 CO 0.08 -0.49 0.27 1.03 0.02 0.00 0.00 176.95 177.86 1mm5 s ARG 95 N 1.93 4.02 -1.00 4.98 0.52 -1.26 -2.59 118.95 125.55 1mm5 s ARG 95 Ca 0.02 0.08 -0.23 0.00 -0.52 0.00 0.00 55.73 55.08 1mm5 s ARG 95 Cb -0.15 -3.34 -0.00 0.00 0.52 0.00 0.00 34.95 31.98 1mm5 s ARG 95 CO -0.07 0.44 1.74 -1.25 0.02 0.00 0.00 175.30 176.18 1mm5 s PRO 96 N -0.14 3.06 0.56 3.54 0.04 -1.26 -4.80 135.00 136.01 1mm5 s PRO 96 Ca 0.17 -0.81 0.25 0.00 0.04 0.00 0.00 61.00 60.64 1mm5 s PRO 96 Cb -0.13 -5.23 1.60 0.00 0.04 0.00 0.00 34.50 30.78 1mm5 s PRO 96 CO 0.05 -2.90 2.19 -0.07 0.04 0.00 0.00 177.00 176.32 1mm5 h LEU 97 N 15.51 0.00 -0.07 -3.56 3.38 -1.95 -2.53 115.31 126.08 1mm5 h LEU 97 Ca 0.17 0.00 0.02 0.00 0.09 0.00 0.00 57.88 58.16 1mm5 h LEU 97 Cb 0.99 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.72 1mm5 h LEU 97 CO 1.31 0.00 -0.06 0.00 0.09 0.00 0.00 178.44 179.78 1mm5 h ALA 98 N 1.97 -0.01 -2.21 1.53 0.00 -2.04 -3.47 119.26 115.03 1mm5 h ALA 98 Ca 0.02 0.03 0.18 0.00 0.00 0.00 0.00 54.91 55.13 1mm5 h ALA 98 Cb 0.09 0.13 -0.11 0.00 0.00 0.00 0.00 17.79 17.90 1mm5 h ALA 98 CO -0.00 -0.53 0.53 0.34 0.00 0.00 0.00 179.25 179.59 1mm5 s ASP 99 N -5.13 -0.22 0.49 0.00 2.15 -0.95 -5.15 116.67 107.86 1mm5 s ASP 99 Ca -0.14 -0.25 0.00 0.00 0.43 0.00 0.00 52.55 52.59 1mm5 s ASP 99 Cb 0.08 0.42 0.00 0.00 -0.30 0.00 0.00 42.92 43.12 1mm5 s ASP 99 CO 0.67 -0.74 0.00 -0.62 -0.17 0.00 0.00 175.17 174.31 1mm5 n GLU 100 N -0.40 -4.09 -0.14 4.34 1.02 -1.26 -4.62 120.64 115.50 1mm5 n GLU 100 Ca -0.07 3.07 0.11 0.00 -0.02 0.00 0.00 57.16 60.25 1mm5 n GLU 100 Cb 0.61 -3.52 0.29 0.00 -0.02 0.00 0.00 31.44 28.80 1mm5 n GLU 100 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 1mm5 n ASN 101 N -1.21 2.47 -4.62 1.62 4.13 -1.26 -4.53 115.26 111.86 1mm5 n ASN 101 Ca 0.00 -1.85 -0.43 0.00 1.68 0.00 0.00 54.58 53.97 1mm5 n ASN 101 Cb 0.08 -0.18 -0.03 0.00 -1.54 0.00 0.00 39.78 38.11 1mm5 n ASN 101 CO 0.00 0.00 0.00 0.33 0.28 0.00 0.00 177.26 177.87 1mm5 n PHE 102 N 0.85 2.18 -3.49 3.10 -0.00 -1.26 -4.50 117.46 114.33 1mm5 n PHE 102 Ca 0.17 -0.21 -0.38 0.00 -0.00 0.00 0.00 57.45 57.04 1mm5 n PHE 102 Cb 0.45 -2.75 -0.06 0.00 -0.00 0.00 0.00 39.48 37.12 1mm5 n PHE 102 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.76 175.75 1mm5 s HIS 103 N 6.62 3.62 0.18 -5.13 3.76 -0.68 -4.13 115.29 119.53 1mm5 s HIS 103 Ca 0.96 0.87 0.10 0.00 -0.15 0.00 0.00 55.06 56.84 1mm5 s HIS 103 Cb -0.41 -2.33 -0.04 0.00 1.11 0.00 0.00 32.58 30.90 1mm5 s HIS 103 CO 0.39 0.47 -0.14 -1.17 -0.85 0.00 0.00 174.74 173.44 1mm5 s LEU 104 N -0.42 2.81 -0.28 0.89 2.96 -1.07 -2.60 118.68 120.98 1mm5 s LEU 104 Ca 0.22 -0.66 -0.24 0.00 -0.22 0.00 0.00 54.13 53.23 1mm5 s LEU 104 Cb -0.15 -1.51 0.11 0.00 0.50 0.00 0.00 46.19 45.14 1mm5 s LEU 104 CO 0.10 0.11 0.94 -0.83 -1.32 0.00 0.00 176.35 175.35 1mm5 s GLY 105 N -2.76 -0.26 -0.00 7.98 0.00 0.17 -0.43 107.32 112.01 1mm5 s GLY 105 Ca 0.23 2.54 0.01 0.00 0.00 0.00 0.00 44.72 47.50 1mm5 s GLY 105 CO 0.13 1.88 -0.03 1.08 0.00 0.00 0.00 173.10 176.16 1mm5 s LEU 106 N 0.38 1.96 0.00 0.66 1.43 -1.07 -0.43 118.68 121.62 1mm5 s LEU 106 Ca 0.01 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.06 1mm5 s LEU 106 Cb -0.05 -0.16 0.00 0.00 0.03 0.00 0.00 46.19 46.01 1mm5 s LEU 106 CO -0.05 0.03 0.00 0.61 0.23 0.00 0.00 176.35 177.17 1mm5 n GLY 107 N 3.06 -1.48 3.69 -3.19 0.00 -1.07 -1.37 105.19 104.82 1mm5 n GLY 107 Ca -0.13 -1.07 -0.27 0.00 0.00 0.00 0.00 46.02 44.55 1mm5 n GLY 107 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mm5 s PHE 108 N -2.80 2.47 -0.08 1.61 0.40 -0.30 -2.10 117.98 117.17 1mm5 s PHE 108 Ca 0.00 -0.67 -0.02 0.00 -0.60 0.00 0.00 56.93 55.64 1mm5 s PHE 108 Cb 0.00 -1.84 0.04 0.00 0.51 0.00 0.00 43.02 41.73 1mm5 s PHE 108 CO 0.00 0.30 0.04 0.95 0.70 0.00 0.00 175.22 177.21 1mm5 s THR 109 N -2.68 0.11 -0.17 0.64 -4.23 -1.07 -1.70 115.64 106.54 1mm5 s THR 109 Ca 0.35 0.17 0.00 0.00 -1.18 0.00 0.00 61.69 61.03 1mm5 s THR 109 Cb 0.07 -0.41 0.03 0.00 1.34 0.00 0.00 72.50 73.53 1mm5 s THR 109 CO 0.19 0.12 -0.10 0.00 -0.54 0.00 0.00 174.62 174.29 1mm5 s ALA 110 N 2.07 1.75 0.06 3.99 0.00 -1.07 -2.28 121.76 126.29 1mm5 s ALA 110 Ca 0.04 -0.95 -0.05 0.00 0.00 0.00 0.00 51.96 51.00 1mm5 s ALA 110 Cb -0.13 -1.14 -0.02 0.00 0.00 0.00 0.00 23.12 21.84 1mm5 s ALA 110 CO -0.05 -0.64 0.08 0.20 0.00 0.00 0.00 175.76 175.35 1mm5 s GLY 111 N 1.52 0.26 -0.02 0.00 0.00 -1.05 -1.73 107.32 106.29 1mm5 s GLY 111 Ca 0.02 -0.83 -0.02 0.00 0.00 0.00 0.00 44.72 43.88 1mm5 s GLY 111 CO -0.09 -0.98 0.14 -1.34 0.00 0.00 0.00 173.10 170.83 1mm5 s VAL 112 N -3.60 5.17 -0.11 1.40 -7.23 -1.07 -0.42 120.40 114.54 1mm5 s VAL 112 Ca 0.04 -0.21 0.00 0.00 -1.81 0.00 0.00 61.98 60.00 1mm5 s VAL 112 Cb 0.05 -3.38 -0.02 0.00 0.56 0.00 0.00 36.38 33.59 1mm5 s VAL 112 CO -0.09 0.37 -0.11 0.42 -0.31 0.00 0.00 175.10 175.38 1mm5 s THR 113 N -1.24 3.26 -0.09 5.32 -4.23 -0.60 -2.28 115.64 115.78 1mm5 s THR 113 Ca 0.24 -0.61 -0.28 0.00 -1.18 0.00 0.00 61.69 59.87 1mm5 s THR 113 Cb -0.12 -2.36 -0.02 0.00 1.34 0.00 0.00 72.50 71.34 1mm5 s THR 113 CO 0.15 0.54 0.92 0.00 -0.54 0.00 0.00 174.62 175.69 1mm5 s ALA 114 N -0.00 3.37 0.24 3.99 0.00 -1.07 -1.60 121.76 126.69 1mm5 s ALA 114 Ca -0.03 0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.23 1mm5 s ALA 114 Cb -0.14 -3.30 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 1mm5 s ALA 114 CO 0.04 -0.47 0.11 1.03 0.00 0.00 0.00 175.76 176.47 1mm5 s ARG 115 N 1.68 1.33 -0.22 0.00 0.52 -1.26 -4.36 118.95 116.65 1mm5 s ARG 115 Ca 0.45 -1.71 0.00 0.00 -0.52 0.00 0.00 55.73 53.95 1mm5 s ARG 115 Cb -0.18 -0.04 0.03 0.00 0.52 0.00 0.00 34.95 35.27 1mm5 s ARG 115 CO 0.19 -0.34 -0.13 -0.51 0.02 0.00 0.00 175.30 174.52 1mm5 s ASP 116 N -3.25 3.78 0.26 0.23 -0.00 -1.26 -4.30 116.67 112.12 1mm5 s ASP 116 Ca 0.38 -0.81 0.00 0.00 -0.00 0.00 0.00 52.55 52.12 1mm5 s ASP 116 Cb 0.07 -1.57 0.00 0.00 -0.00 0.00 0.00 42.92 41.43 1mm5 s ASP 116 CO 0.13 -0.07 0.00 0.59 -0.00 0.00 0.00 175.17 175.82 1mm5 n ASN 117 N 4.62 -0.87 -0.03 0.27 5.03 -1.26 -5.00 115.26 118.01 1mm5 n ASN 117 Ca -0.18 0.46 -0.04 0.00 0.87 0.00 0.00 54.58 55.69 1mm5 n ASN 117 Cb 0.48 0.98 -0.03 0.00 -1.02 0.00 0.00 39.78 40.19 1mm5 n ASN 117 CO 0.00 0.00 0.00 1.87 -1.83 0.00 0.00 177.26 177.30 1mm5 n TRP 118 N -3.26 0.00 0.11 3.10 -0.00 -1.26 -5.03 117.44 111.10 1mm5 n TRP 118 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.50 1mm5 n TRP 118 Cb 0.00 -0.26 0.00 0.00 -0.00 0.00 0.00 31.31 31.05 1mm5 n TRP 118 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 1mm5 n ASN 119 N -2.61 -2.03 -2.66 5.87 5.15 -1.26 -5.05 115.26 112.67 1mm5 n ASN 119 Ca -0.11 0.53 -0.03 0.00 -0.60 0.00 0.00 54.58 54.36 1mm5 n ASN 119 Cb 0.64 2.09 0.10 0.00 -0.53 0.00 0.00 39.78 42.07 1mm5 n ASN 119 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1mm5 n TYR 120 N -2.99 -0.51 -2.88 1.20 4.19 -1.26 -4.94 117.16 109.97 1mm5 n TYR 120 Ca 0.00 -0.79 -0.43 0.00 3.31 0.00 0.00 57.90 59.99 1mm5 n TYR 120 Cb 0.00 1.20 -0.05 0.00 0.49 0.00 0.00 39.34 40.98 1mm5 n TYR 120 CO 0.00 0.00 0.00 0.96 0.91 0.00 0.00 176.86 178.73 1mm5 s ILE 121 N 0.05 4.50 0.82 2.97 -4.36 -1.26 -4.96 121.20 118.96 1mm5 s ILE 121 Ca 0.18 0.44 -0.11 0.00 -0.26 0.00 0.00 60.65 60.90 1mm5 s ILE 121 Cb 0.27 -4.44 0.09 0.00 1.25 0.00 0.00 42.46 39.62 1mm5 s ILE 121 CO -0.17 -0.91 1.10 -2.16 0.24 0.00 0.00 174.94 173.03 1mm5 s PRO 122 N 3.67 1.85 -0.31 0.37 0.04 -1.26 -4.30 135.00 135.06 1mm5 s PRO 122 Ca 0.32 1.15 -0.01 0.00 0.04 0.00 0.00 61.00 62.50 1mm5 s PRO 122 Cb -0.12 -1.85 0.10 0.00 0.04 0.00 0.00 34.50 32.67 1mm5 s PRO 122 CO 0.22 -1.92 0.10 -0.51 0.04 0.00 0.00 177.00 174.93 1mm5 s LEU 123 N -6.09 2.29 0.52 -3.56 2.01 -0.63 -4.87 118.68 108.35 1mm5 s LEU 123 Ca 0.62 -1.64 -0.21 0.00 0.01 0.00 0.00 54.13 52.91 1mm5 s LEU 123 Cb -0.18 -0.88 -0.06 0.00 0.01 0.00 0.00 46.19 45.08 1mm5 s LEU 123 CO 0.57 -0.41 1.17 -2.16 1.01 0.00 0.00 176.35 176.53 1mm5 s PRO 124 N 1.60 3.45 -0.08 1.29 0.04 -1.26 -1.56 135.00 138.49 1mm5 s PRO 124 Ca 0.10 1.76 -0.03 0.00 0.04 0.00 0.00 61.00 62.86 1mm5 s PRO 124 Cb -0.17 -2.18 0.05 0.00 0.04 0.00 0.00 34.50 32.23 1mm5 s PRO 124 CO -0.25 -0.80 0.15 0.08 0.04 0.00 0.00 177.00 176.22 1mm5 s VAL 125 N -1.61 -0.24 -0.13 -0.36 1.01 0.43 -4.95 120.40 114.55 1mm5 s VAL 125 Ca 0.69 0.36 -0.00 0.00 0.00 0.00 0.00 61.98 63.03 1mm5 s VAL 125 Cb -0.28 -0.28 -0.02 0.00 0.00 0.00 0.00 36.38 35.81 1mm5 s VAL 125 CO 0.33 0.15 -0.12 -1.48 0.00 0.00 0.00 175.10 173.97 1mm5 s LEU 126 N 2.28 2.75 -0.15 3.92 2.34 -1.26 -2.52 118.68 126.04 1mm5 s LEU 126 Ca 0.03 -0.32 -0.08 0.00 0.06 0.00 0.00 54.13 53.83 1mm5 s LEU 126 Cb -0.12 -1.62 0.06 0.00 -0.56 0.00 0.00 46.19 43.94 1mm5 s LEU 126 CO -0.05 0.16 0.36 -1.48 -1.06 0.00 0.00 176.35 174.28 1mm5 s LEU 127 N 0.38 0.03 0.05 1.48 2.34 -0.97 -5.00 118.68 116.99 1mm5 s LEU 127 Ca -0.10 0.78 -0.30 0.00 0.06 0.00 0.00 54.13 54.57 1mm5 s LEU 127 Cb -0.16 1.15 -0.05 0.00 -0.56 0.00 0.00 46.19 46.58 1mm5 s LEU 127 CO 0.05 -0.19 1.15 -2.16 -1.06 0.00 0.00 176.35 174.14 1mm5 s PRO 128 N 1.42 4.46 0.26 1.48 0.04 -1.26 -2.59 135.00 138.81 1mm5 s PRO 128 Ca -0.09 1.69 -0.10 0.00 0.04 0.00 0.00 61.00 62.54 1mm5 s PRO 128 Cb -0.09 -3.37 -0.01 0.00 0.04 0.00 0.00 34.50 31.07 1mm5 s PRO 128 CO -0.11 -0.21 0.45 -0.48 0.04 0.00 0.00 177.00 176.69 1mm5 s LEU 129 N 1.03 0.49 0.22 -3.56 0.05 -0.89 -2.61 118.68 113.40 1mm5 s LEU 129 Ca 0.57 -1.06 0.04 0.00 0.05 0.00 0.00 54.13 53.73 1mm5 s LEU 129 Cb -0.28 1.61 -0.05 0.00 -2.05 0.00 0.00 46.19 45.43 1mm5 s LEU 129 CO 0.29 -1.15 -0.02 0.00 -0.55 0.00 0.00 176.35 174.93 1mm5 s ALA 130 N -3.85 1.75 -0.11 1.48 0.00 -0.22 -2.60 121.76 118.21 1mm5 s ALA 130 Ca 0.25 -1.72 0.04 0.00 0.00 0.00 0.00 51.96 50.53 1mm5 s ALA 130 Cb 0.00 0.43 0.00 0.00 0.00 0.00 0.00 23.12 23.55 1mm5 s ALA 130 CO 0.11 -0.23 -0.23 -1.12 0.00 0.00 0.00 175.76 174.29 1mm5 s SER 131 N -3.28 3.05 -0.14 0.00 0.01 0.43 -2.59 113.70 111.18 1mm5 s SER 131 Ca 0.27 -0.56 -0.04 0.00 1.31 0.00 0.00 55.95 56.93 1mm5 s SER 131 Cb 0.05 -1.40 0.07 0.00 0.21 0.00 0.00 66.02 64.96 1mm5 s SER 131 CO 0.07 0.14 0.21 0.68 0.41 0.00 0.00 173.24 174.76 1mm5 s VAL 132 N 0.43 -0.33 0.37 3.43 -7.23 0.44 -0.66 120.40 116.86 1mm5 s VAL 132 Ca -0.17 0.14 0.05 0.00 -1.81 0.00 0.00 61.98 60.19 1mm5 s VAL 132 Cb -0.17 -0.49 -0.03 0.00 0.56 0.00 0.00 36.38 36.25 1mm5 s VAL 132 CO 0.07 -0.00 0.18 -0.83 -0.31 0.00 0.00 175.10 174.20 1mm5 s GLY 133 N 2.34 2.45 -0.30 2.32 0.00 -1.07 -0.44 107.32 112.63 1mm5 s GLY 133 Ca 0.04 -1.55 -0.14 0.00 0.00 0.00 0.00 44.72 43.07 1mm5 s GLY 133 CO -0.09 -1.69 0.85 -0.47 0.00 0.00 0.00 173.10 171.71 1mm5 s TYR 134 N -3.34 -0.91 0.00 1.90 6.14 0.48 -1.69 117.35 119.93 1mm5 s TYR 134 Ca 0.30 1.62 0.00 0.00 0.64 0.00 0.00 57.07 59.64 1mm5 s TYR 134 Cb 0.03 0.55 0.00 0.00 0.42 0.00 0.00 41.96 42.95 1mm5 s TYR 134 CO 0.19 -0.45 0.00 0.41 0.64 0.00 0.00 175.55 176.34 1mm5 n GLY 135 N 4.91 2.36 1.00 8.97 0.00 -1.26 -2.61 105.19 118.56 1mm5 n GLY 135 Ca -0.12 -0.41 0.01 0.00 0.00 0.00 0.00 46.02 45.50 1mm5 n GLY 135 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1mm5 n PRO 136 N 13.36 2.22 -4.09 1.61 -0.04 -1.26 -4.82 135.00 141.98 1mm5 n PRO 136 Ca 0.00 -1.04 -0.16 0.00 -0.04 0.00 0.00 63.50 62.26 1mm5 n PRO 136 Cb 0.00 -1.72 -0.15 0.00 -0.04 0.00 0.00 33.50 31.59 1mm5 n PRO 136 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1mm5 s VAL 137 N -1.54 0.34 0.04 0.52 0.11 -1.07 -4.81 120.40 113.99 1mm5 s VAL 137 Ca 0.18 -0.13 0.07 0.00 -2.93 0.00 0.00 61.98 59.17 1mm5 s VAL 137 Cb 0.14 -0.32 -0.03 0.00 -1.53 0.00 0.00 36.38 34.64 1mm5 s VAL 137 CO 0.05 0.12 -0.20 -0.89 -3.33 0.00 0.00 175.10 170.85 1mm5 s THR 138 N 0.21 1.63 0.02 5.04 2.01 -0.82 -0.38 115.64 123.35 1mm5 s THR 138 Ca -0.02 -1.20 0.04 0.00 0.31 0.00 0.00 61.69 60.83 1mm5 s THR 138 Cb -0.05 -1.42 -0.02 0.00 0.01 0.00 0.00 72.50 71.01 1mm5 s THR 138 CO -0.00 0.18 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.62 1mm5 s PHE 139 N -0.82 1.14 -0.07 4.92 0.08 0.42 -1.31 117.98 122.34 1mm5 s PHE 139 Ca 0.07 -0.30 -0.01 0.00 0.12 0.00 0.00 56.93 56.81 1mm5 s PHE 139 Cb -0.09 -0.69 0.03 0.00 -0.57 0.00 0.00 43.02 41.69 1mm5 s PHE 139 CO 0.02 0.01 -0.01 -1.14 -0.10 0.00 0.00 175.22 174.00 1mm5 s GLN 140 N -0.84 0.66 0.06 0.44 0.74 -0.19 -0.42 119.66 120.10 1mm5 s GLN 140 Ca 0.02 0.06 0.07 0.00 0.05 0.00 0.00 55.36 55.56 1mm5 s GLN 140 Cb -0.07 -0.94 -0.04 0.00 1.10 0.00 0.00 33.01 33.06 1mm5 s GLN 140 CO 0.01 -0.26 -0.16 -1.64 -0.55 0.00 0.00 175.29 172.69 1mm5 s MET 141 N 1.74 2.07 -0.03 1.67 -1.94 -1.07 -0.80 119.30 120.94 1mm5 s MET 141 Ca 0.02 -1.00 0.02 0.00 -1.71 0.00 0.00 55.69 53.01 1mm5 s MET 141 Cb -0.13 -2.23 0.01 0.00 2.01 0.00 0.00 34.83 34.50 1mm5 s MET 141 CO -0.04 0.53 -0.07 -0.08 -0.01 0.00 0.00 175.02 175.35 1mm5 s THR 142 N -1.02 0.66 -0.02 2.05 -1.32 -0.66 -1.06 115.64 114.27 1mm5 s THR 142 Ca 0.17 -0.26 0.01 0.00 -1.21 0.00 0.00 61.69 60.40 1mm5 s THR 142 Cb -0.11 -0.62 0.01 0.00 -1.51 0.00 0.00 72.50 70.28 1mm5 s THR 142 CO 0.08 0.23 -0.04 -0.72 -2.21 0.00 0.00 174.62 171.96 1mm5 s TYR 143 N 0.46 0.52 -0.47 9.09 -0.85 -1.07 -1.54 117.35 123.49 1mm5 s TYR 143 Ca -0.07 -0.10 0.04 0.00 -0.52 0.00 0.00 57.07 56.42 1mm5 s TYR 143 Cb -0.11 -0.46 0.12 0.00 0.38 0.00 0.00 41.96 41.90 1mm5 s TYR 143 CO 0.01 -0.10 0.22 0.96 -1.52 0.00 0.00 175.55 175.11 1mm5 s ILE 144 N 0.56 2.36 -0.15 -3.49 -4.36 -1.07 -4.52 121.20 110.52 1mm5 s ILE 144 Ca -0.06 -3.02 -0.38 0.00 -0.26 0.00 0.00 60.65 56.93 1mm5 s ILE 144 Cb -0.10 -2.66 -0.14 0.00 1.25 0.00 0.00 42.46 40.81 1mm5 s ILE 144 CO -0.00 -0.77 1.73 -2.65 0.24 0.00 0.00 174.94 173.48 1mm5 n PRO 145 N 3.40 1.53 0.00 0.37 -0.02 -1.26 -2.44 135.00 136.58 1mm5 n PRO 145 Ca 0.05 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1mm5 n PRO 145 Cb 0.34 -2.29 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 1mm5 n PRO 145 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1mm5 n GLY 146 N 4.01 0.00 2.98 -1.23 0.00 -1.26 -4.66 105.19 105.03 1mm5 n GLY 146 Ca 0.24 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.12 1mm5 n GLY 146 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1mm5 n THR 147 N -2.22 -5.73 -3.86 2.61 -1.04 -1.26 -4.81 114.28 97.97 1mm5 n THR 147 Ca 0.00 -0.61 -0.04 0.00 -2.04 0.00 0.00 64.05 61.36 1mm5 n THR 147 Cb 0.43 -4.94 0.02 0.00 -1.82 0.00 0.00 70.33 64.02 1mm5 n THR 147 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1mm5 s TYR 148 N -3.30 0.06 0.48 -1.42 2.02 -1.26 -4.94 117.35 108.98 1mm5 s TYR 148 Ca 0.11 -0.48 0.14 0.00 -0.37 0.00 0.00 57.07 56.47 1mm5 s TYR 148 Cb -0.01 0.71 1.14 0.00 -0.40 0.00 0.00 41.96 43.39 1mm5 s TYR 148 CO 0.60 -0.99 2.09 -0.91 -1.57 0.00 0.00 175.55 174.77 1mm5 h ASN 149 N 2.00 0.18 -0.32 2.29 2.35 -2.02 -1.50 115.58 118.55 1mm5 h ASN 149 Ca -0.28 -0.00 -0.14 0.00 -0.55 0.00 0.00 56.30 55.33 1mm5 h ASN 149 Cb 1.22 -0.04 -0.08 0.00 0.05 0.00 0.00 38.32 39.47 1mm5 h ASN 149 CO 0.35 0.12 -0.05 -3.20 -1.65 0.00 0.00 177.43 173.01 1mm5 n ASN 150 N -4.50 2.81 -4.69 5.81 2.85 -1.26 -5.01 115.26 111.28 1mm5 n ASN 150 Ca 0.02 -3.57 -0.29 0.00 -0.11 0.00 0.00 54.58 50.62 1mm5 n ASN 150 Cb 0.17 -0.61 -0.09 0.00 1.24 0.00 0.00 39.78 40.48 1mm5 n ASN 150 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1mm5 s GLY 151 N -2.39 2.65 -0.53 8.20 0.00 -0.57 -4.91 107.32 109.77 1mm5 s GLY 151 Ca 0.44 -1.66 -0.11 0.00 0.00 0.00 0.00 44.72 43.39 1mm5 s GLY 151 CO 0.02 -2.11 0.63 -2.01 0.00 0.00 0.00 173.10 169.64 1mm5 n ASN 152 N -1.11 -7.89 -4.45 1.64 4.05 -1.02 -4.61 115.26 101.87 1mm5 n ASN 152 Ca -0.09 0.33 -0.33 0.00 0.45 0.00 0.00 54.58 54.94 1mm5 n ASN 152 Cb 0.67 -5.34 -0.13 0.00 1.23 0.00 0.00 39.78 36.20 1mm5 n ASN 152 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1mm5 s VAL 153 N -2.73 3.14 0.06 3.44 1.01 -1.23 -4.95 120.40 119.13 1mm5 s VAL 153 Ca 0.17 -0.67 0.05 0.00 0.00 0.00 0.00 61.98 61.53 1mm5 s VAL 153 Cb -0.05 -2.27 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 1mm5 s VAL 153 CO 0.76 0.57 -0.09 -0.31 0.00 0.00 0.00 175.10 176.03 1mm5 s TYR 154 N -0.32 2.78 -0.09 5.22 2.02 -1.26 -2.60 117.35 123.10 1mm5 s TYR 154 Ca 0.03 -0.12 -0.04 0.00 -0.37 0.00 0.00 57.07 56.57 1mm5 s TYR 154 Cb -0.13 -1.51 0.05 0.00 -0.40 0.00 0.00 41.96 39.97 1mm5 s TYR 154 CO 0.03 0.38 0.18 0.12 -1.57 0.00 0.00 175.55 174.68 1mm5 s PHE 155 N -1.09 -0.22 -0.21 2.71 5.36 -0.59 -3.81 117.98 120.12 1mm5 s PHE 155 Ca 0.19 0.67 -0.08 0.00 -0.96 0.00 0.00 56.93 56.74 1mm5 s PHE 155 Cb -0.11 -0.20 -0.04 0.00 -0.34 0.00 0.00 43.02 42.33 1mm5 s PHE 155 CO 0.10 -0.28 0.09 0.00 -1.46 0.00 0.00 175.22 173.68 1mm5 s ALA 156 N 2.20 3.41 -0.06 11.12 0.00 -0.75 -1.65 121.76 136.03 1mm5 s ALA 156 Ca 0.01 -0.88 0.01 0.00 0.00 0.00 0.00 51.96 51.11 1mm5 s ALA 156 Cb -0.12 -2.08 0.02 0.00 0.00 0.00 0.00 23.12 20.94 1mm5 s ALA 156 CO -0.06 -0.09 -0.09 -1.58 0.00 0.00 0.00 175.76 173.94 1mm5 s TRP 157 N 0.87 1.20 0.37 0.00 0.52 0.02 -2.93 118.94 118.98 1mm5 s TRP 157 Ca 0.05 -0.44 -0.18 0.00 0.02 0.00 0.00 56.10 55.55 1mm5 s TRP 157 Cb -0.13 -0.94 -0.10 0.00 -1.15 0.00 0.00 33.47 31.15 1mm5 s TRP 157 CO 0.03 -0.27 0.84 -1.64 0.02 0.00 0.00 176.95 175.92 1mm5 s MET 158 N 0.89 4.12 0.02 4.98 -1.94 0.25 -1.03 119.30 126.59 1mm5 s MET 158 Ca -0.11 0.89 -0.00 0.00 -1.71 0.00 0.00 55.69 54.76 1mm5 s MET 158 Cb -0.15 -2.32 -0.02 0.00 2.01 0.00 0.00 34.83 34.36 1mm5 s MET 158 CO 0.01 0.07 -0.02 0.50 -0.01 0.00 0.00 175.02 175.57 1mm5 s ARG 159 N -3.06 0.27 0.05 2.03 3.52 -0.43 -1.61 118.95 119.73 1mm5 s ARG 159 Ca 0.58 -0.53 0.06 0.00 -0.13 0.00 0.00 55.73 55.70 1mm5 s ARG 159 Cb -0.10 0.10 -0.02 0.00 -1.56 0.00 0.00 34.95 33.37 1mm5 s ARG 159 CO 0.15 -0.04 -0.16 -0.06 -0.81 0.00 0.00 175.30 174.38 1mm5 s PHE 160 N -1.28 1.35 -0.24 5.12 0.40 -0.77 -1.95 117.98 120.62 1mm5 s PHE 160 Ca -0.14 -0.38 -0.10 0.00 -0.60 0.00 0.00 56.93 55.71 1mm5 s PHE 160 Cb -0.09 -0.79 -0.05 0.00 0.51 0.00 0.00 43.02 42.61 1mm5 s PHE 160 CO -0.01 0.06 0.14 -0.65 0.70 0.00 0.00 175.22 175.46 1mm5 s GLN 161 N -1.31 3.99 -0.04 0.44 -0.21 -1.26 -2.46 119.66 118.81 1mm5 s GLN 161 Ca 0.02 -0.31 -0.01 0.00 0.02 0.00 0.00 55.36 55.08 1mm5 s GLN 161 Cb -0.09 -3.49 0.03 0.00 1.00 0.00 0.00 33.01 30.46 1mm5 s GLN 161 CO 0.02 0.03 0.04 -0.06 -2.12 0.00 0.00 175.29 173.19 1mm5 s PHE 162 N 1.13 0.22 0.09 0.91 0.08 -0.92 -5.04 117.98 114.46 1mm5 s PHE 162 Ca 0.07 0.12 0.07 0.00 0.12 0.00 0.00 56.93 57.31 1mm5 s PHE 162 Cb -0.14 -0.52 -0.03 0.00 -0.57 0.00 0.00 43.02 41.75 1mm5 s PHE 162 CO 0.05 -0.21 -0.18 -0.48 -0.10 0.00 0.00 175.22 174.30 1mm5 s LEU 163 N 1.91 2.30 -0.30 -0.37 2.34 -1.26 -2.43 118.68 120.86 1mm5 s LEU 163 Ca 0.02 -0.66 -0.14 0.00 0.06 0.00 0.00 54.13 53.41 1mm5 s LEU 163 Cb -0.12 -0.72 0.18 0.00 -0.56 0.00 0.00 46.19 44.96 1mm5 s LEU 163 CO -0.03 -0.00 1.10 -0.70 -1.06 0.00 0.00 176.35 175.66 1mm5 s GLU 164 N -1.88 0.10 1.23 1.48 2.56 -1.26 -5.06 118.70 115.87 1mm5 s GLU 164 Ca 0.03 0.12 -0.16 0.00 0.00 0.00 0.00 54.97 54.96 1mm5 s GLU 164 Cb -0.10 0.06 0.30 0.00 2.00 0.00 0.00 34.13 36.39 1mm5 s GLU 164 CO 0.03 -0.17 1.01 -3.38 -0.56 0.00 0.00 175.26 172.19 1mm5 s HIS 165 N 2.97 0.83 0.17 5.30 -3.43 -1.26 -5.01 115.29 114.86 1mm5 s HIS 165 Ca 0.22 0.93 0.00 0.00 -0.80 0.00 0.00 55.06 55.41 1mm5 s HIS 165 Cb -0.03 -3.08 0.00 0.00 -1.43 0.00 0.00 32.58 28.05 1mm5 s HIS 165 CO -0.20 -4.13 0.00 0.72 -2.00 0.00 0.00 174.74 169.13 1mm5 n HIS 166 N -5.07 -1.64 -1.24 0.38 8.25 -1.26 -4.91 115.22 109.74 1mm5 n HIS 166 Ca 0.06 0.31 -0.31 0.00 -0.26 0.00 0.00 57.72 57.52 1mm5 n HIS 166 Cb 0.57 0.72 0.10 0.00 1.12 0.00 0.00 29.99 32.49 1mm5 n HIS 166 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1mm5 n HIS 167 N -3.04 3.01 -0.12 4.41 -0.00 -1.26 -4.14 115.22 114.08 1mm5 n HIS 167 Ca 0.00 -2.67 -0.17 0.00 0.46 0.00 0.00 57.72 55.34 1mm5 n HIS 167 Cb 0.00 -1.30 -0.12 0.00 -0.12 0.00 0.00 29.99 28.46 1mm5 n HIS 167 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38 1mm5 n HIS 168 N -0.84 0.00 -0.11 1.57 -0.00 -1.26 -4.75 115.22 109.83 1mm5 n HIS 168 Ca 0.59 0.00 -0.20 0.00 -0.00 0.00 0.00 57.72 58.11 1mm5 n HIS 168 Cb 0.86 -0.96 -0.09 0.00 -0.00 0.00 0.00 29.99 29.80 1mm5 n HIS 168 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92 1mm5 n HIS 169 N -3.22 0.00 0.06 1.57 -0.00 -1.26 -5.22 115.22 107.16 1mm5 n HIS 169 Ca -0.44 0.00 0.01 0.00 -0.00 0.00 0.00 57.72 57.29 1mm5 n HIS 169 Cb 0.97 -0.81 0.01 0.00 -0.00 0.00 0.00 29.99 30.16 1mm5 n HIS 169 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92