#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 3.10 0.02 7.83 2.85 -1.26 -4.33 115.26 123.46 1mm5 n ASN 2 Ca 0.00 0.00 -0.08 0.00 -0.11 0.00 0.00 54.58 54.39 1mm5 n ASN 2 Cb 0.00 0.00 -0.06 0.00 1.24 0.00 0.00 39.78 40.96 1mm5 n ASN 2 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1mm5 h ALA 3 N 0.00 -0.16 0.00 5.20 0.00 -2.06 -2.75 119.26 119.49 1mm5 h ALA 3 Ca 0.00 -0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 1mm5 h ALA 3 Cb 0.83 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1mm5 h ALA 3 CO 0.00 -0.19 -0.66 0.22 0.00 0.00 0.00 179.25 178.62 1mm5 h ASP 4 N -0.97 0.00 0.31 0.00 1.82 -2.01 -3.10 116.42 112.47 1mm5 h ASP 4 Ca -0.02 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.53 1mm5 h ASP 4 Cb 0.44 0.00 -0.01 0.00 0.68 0.00 0.00 39.33 40.44 1mm5 h ASP 4 CO 0.03 0.66 -0.39 -0.08 -1.61 0.00 0.00 179.24 177.85 1mm5 h GLU 5 N 0.00 0.11 -0.01 0.28 4.22 -1.76 -2.53 114.58 114.89 1mm5 h GLU 5 Ca -0.01 -0.05 -0.15 0.00 0.08 0.00 0.00 59.36 59.24 1mm5 h GLU 5 Cb 1.27 -0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.50 1mm5 h GLU 5 CO 0.09 0.48 -0.69 -1.49 -2.18 0.00 0.00 179.01 175.22 1mm5 h TRP 6 N 0.09 0.09 -0.01 0.92 4.06 -1.41 -2.58 115.95 117.12 1mm5 h TRP 6 Ca 0.01 -0.04 -0.16 0.00 2.06 0.00 0.00 58.89 60.75 1mm5 h TRP 6 Cb 0.73 -0.01 -0.02 0.00 -1.00 0.00 0.00 29.16 28.86 1mm5 h TRP 6 CO 0.01 0.73 -0.75 0.52 -3.56 0.00 0.00 178.44 175.39 1mm5 h MET 7 N 0.04 0.08 0.05 0.49 2.86 -1.47 -2.68 114.93 114.31 1mm5 h MET 7 Ca -0.01 -0.08 -0.00 0.00 -2.06 0.00 0.00 59.70 57.55 1mm5 h MET 7 Cb 1.23 0.02 0.00 0.00 0.06 0.00 0.00 31.60 32.90 1mm5 h MET 7 CO 0.09 0.79 -0.03 1.79 1.06 0.00 0.00 176.91 180.62 1mm5 h THR 8 N 0.05 1.30 -0.15 2.22 1.35 -1.39 -3.16 112.91 113.12 1mm5 h THR 8 Ca -0.02 -1.45 0.01 0.00 -0.55 0.00 0.00 66.41 64.40 1mm5 h THR 8 Cb 1.32 2.21 -0.01 0.00 -1.73 0.00 0.00 68.15 69.95 1mm5 h THR 8 CO 0.10 0.35 0.10 0.00 -0.25 0.00 0.00 175.52 175.83 1mm5 h THR 9 N -0.75 1.02 -0.31 6.82 1.03 -1.55 -1.31 112.91 117.86 1mm5 h THR 9 Ca -0.01 -0.06 -0.05 0.00 -0.01 0.00 0.00 66.41 66.29 1mm5 h THR 9 Cb 0.63 0.83 -0.02 0.00 -1.07 0.00 0.00 68.15 68.52 1mm5 h THR 9 CO 0.01 0.03 -0.01 0.15 -0.01 0.00 0.00 175.52 175.69 1mm5 h PHE 10 N 0.17 0.49 -0.07 0.00 3.57 -1.50 -2.18 116.94 117.42 1mm5 h PHE 10 Ca 0.06 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 1mm5 h PHE 10 Cb 0.04 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 38.62 1mm5 h PHE 10 CO -0.00 0.50 -0.35 -0.09 -2.23 0.00 0.00 178.31 176.14 1mm5 h ARG 11 N 0.46 0.13 -0.02 1.11 9.65 -1.20 -2.34 114.38 122.16 1mm5 h ARG 11 Ca 0.10 -0.05 -0.15 0.00 -1.10 0.00 0.00 59.98 58.78 1mm5 h ARG 11 Cb 0.32 -0.01 -0.02 0.00 -1.39 0.00 0.00 29.97 28.88 1mm5 h ARG 11 CO 0.01 0.47 -0.66 1.49 2.80 0.00 0.00 179.97 184.08 1mm5 h GLU 12 N 0.11 0.10 0.19 0.20 4.81 -1.35 -2.33 114.58 116.30 1mm5 h GLU 12 Ca 0.01 -0.07 -0.01 0.00 -0.13 0.00 0.00 59.36 59.16 1mm5 h GLU 12 Cb 0.68 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.07 1mm5 h GLU 12 CO 0.05 0.72 -0.09 -0.91 -0.73 0.00 0.00 179.01 178.05 1mm5 h ASN 13 N 0.07 -0.21 -0.09 1.04 4.21 -1.18 -1.95 115.58 117.46 1mm5 h ASN 13 Ca -0.01 -0.31 0.01 0.00 1.21 0.00 0.00 56.30 57.19 1mm5 h ASN 13 Cb 1.18 0.05 -0.00 0.00 -1.12 0.00 0.00 38.32 38.43 1mm5 h ASN 13 CO 0.09 0.32 0.06 0.16 -1.29 0.00 0.00 177.43 176.78 1mm5 h ILE 14 N -0.88 1.01 -0.12 2.81 3.07 -1.51 -1.74 117.51 120.15 1mm5 h ILE 14 Ca -0.03 -0.03 -0.18 0.00 1.55 0.00 0.00 64.86 66.17 1mm5 h ILE 14 Cb 0.51 0.90 0.01 0.00 -0.27 0.00 0.00 36.82 37.97 1mm5 h ILE 14 CO 0.04 0.02 -0.63 0.00 -1.05 0.00 0.00 178.15 176.53 1mm5 h ALA 15 N 1.94 0.24 -0.13 0.16 0.00 -1.45 -2.62 119.26 117.42 1mm5 h ALA 15 Ca 0.04 -0.55 -0.01 0.00 0.00 0.00 0.00 54.91 54.39 1mm5 h ALA 15 Cb 0.03 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1mm5 h ALA 15 CO -0.01 0.52 0.05 1.96 0.00 0.00 0.00 179.25 181.77 1mm5 h GLN 16 N 0.31 0.19 -0.09 0.00 4.20 -0.74 0.13 115.11 119.12 1mm5 h GLN 16 Ca -0.04 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.61 1mm5 h GLN 16 Cb 1.27 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.01 1mm5 h GLN 16 CO 0.13 0.29 -0.04 0.00 -0.67 0.00 0.00 178.83 178.54 1mm5 h THR 17 N 0.05 1.09 0.01 -0.54 1.03 -1.41 0.15 112.91 113.28 1mm5 h THR 17 Ca 0.04 -0.36 -0.22 0.00 -0.01 0.00 0.00 66.41 65.86 1mm5 h THR 17 Cb 0.17 1.07 -0.03 0.00 -1.07 0.00 0.00 68.15 68.29 1mm5 h THR 17 CO -0.00 0.11 -1.05 -0.25 -0.01 0.00 0.00 175.52 174.32 1mm5 h TRP 18 N 0.12 0.03 0.04 0.00 2.91 -1.10 -3.39 115.95 114.56 1mm5 h TRP 18 Ca 0.03 -0.02 -0.00 0.00 1.13 0.00 0.00 58.89 60.03 1mm5 h TRP 18 Cb 0.16 -0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.81 1mm5 h TRP 18 CO 0.00 1.02 -0.02 0.37 -1.03 0.00 0.00 178.44 178.78 1mm5 h GLN 19 N 0.00 -0.06 -6.05 2.65 4.15 0.01 -3.43 115.11 112.39 1mm5 h GLN 19 Ca -0.03 0.00 -0.60 0.00 0.77 0.00 0.00 58.65 58.79 1mm5 h GLN 19 Cb 1.79 0.01 -0.10 0.00 0.21 0.00 0.00 27.48 29.39 1mm5 h GLN 19 CO 0.13 -0.04 0.55 -0.65 -1.93 0.00 0.00 178.83 176.89 1mm5 s GLN 20 N -1.54 3.70 0.05 1.69 -0.21 -0.03 -4.97 119.66 118.35 1mm5 s GLN 20 Ca -0.01 0.36 -0.24 0.00 0.02 0.00 0.00 55.36 55.49 1mm5 s GLN 20 Cb 0.00 -3.85 -0.13 0.00 1.00 0.00 0.00 33.01 30.03 1mm5 s GLN 20 CO 0.03 -1.04 1.37 -1.35 -2.12 0.00 0.00 175.29 172.18 1mm5 h PRO 21 N 8.71 -0.75 -5.06 2.91 0.11 -1.85 -3.42 132.00 132.66 1mm5 h PRO 21 Ca -0.24 0.05 0.01 0.00 0.11 0.00 0.00 66.00 65.93 1mm5 h PRO 21 Cb 1.08 0.17 -0.12 0.00 0.11 0.00 0.00 31.00 32.24 1mm5 h PRO 21 CO 0.98 -0.50 -1.48 0.39 -0.21 0.00 0.00 178.00 177.18 1mm5 n GLU 22 N -4.41 -4.48 -3.59 1.05 1.02 -1.26 -5.04 120.64 103.92 1mm5 n GLU 22 Ca -0.09 3.37 -0.13 0.00 -0.02 0.00 0.00 57.16 60.29 1mm5 n GLU 22 Cb 0.33 -4.80 -0.06 0.00 -0.02 0.00 0.00 31.44 26.88 1mm5 n GLU 22 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 1mm5 s HIS 23 N -0.62 -0.57 0.01 -0.32 -3.43 -1.26 -4.87 115.29 104.23 1mm5 s HIS 23 Ca -0.26 1.19 -0.30 0.00 -0.80 0.00 0.00 55.06 54.89 1mm5 s HIS 23 Cb 0.02 0.38 -0.06 0.00 -1.43 0.00 0.00 32.58 31.49 1mm5 s HIS 23 CO 0.70 -0.39 1.38 0.71 -2.00 0.00 0.00 174.74 175.14 1mm5 s TYR 24 N -0.42 2.93 -0.35 0.38 2.02 -0.59 -4.80 117.35 116.52 1mm5 s TYR 24 Ca -0.02 0.87 -0.13 0.00 -0.37 0.00 0.00 57.07 57.42 1mm5 s TYR 24 Cb -0.03 -3.64 -0.01 0.00 -0.40 0.00 0.00 41.96 37.89 1mm5 s TYR 24 CO 0.01 -2.32 0.24 -0.51 -1.57 0.00 0.00 175.55 171.40 1mm5 s ASP 25 N 1.76 5.97 -0.13 2.29 1.01 -1.07 -1.55 116.67 124.96 1mm5 s ASP 25 Ca 0.63 -0.57 -0.07 0.00 0.71 0.00 0.00 52.55 53.25 1mm5 s ASP 25 Cb -0.31 -2.11 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 1mm5 s ASP 25 CO 0.27 -0.28 0.14 -0.22 0.21 0.00 0.00 175.17 175.28 1mm5 s LEU 26 N 1.69 4.36 -0.05 1.23 2.96 -0.54 -0.49 118.68 127.85 1mm5 s LEU 26 Ca 0.05 0.43 -0.01 0.00 -0.22 0.00 0.00 54.13 54.39 1mm5 s LEU 26 Cb -0.18 -2.07 0.03 0.00 0.50 0.00 0.00 46.19 44.47 1mm5 s LEU 26 CO 0.10 0.38 0.01 -0.47 -1.32 0.00 0.00 176.35 175.04 1mm5 s TYR 27 N -0.82 0.42 -0.22 5.38 5.04 0.37 -2.60 117.35 124.92 1mm5 s TYR 27 Ca 0.14 -0.03 -0.15 0.00 -2.44 0.00 0.00 57.07 54.59 1mm5 s TYR 27 Cb -0.12 -0.57 0.07 0.00 0.35 0.00 0.00 41.96 41.68 1mm5 s TYR 27 CO 0.03 -0.21 0.56 -1.50 -1.34 0.00 0.00 175.55 173.09 1mm5 s ILE 28 N 1.52 -0.01 0.43 3.14 1.10 -0.92 -1.45 121.20 125.02 1mm5 s ILE 28 Ca -0.03 0.03 -0.23 0.00 -0.51 0.00 0.00 60.65 59.91 1mm5 s ILE 28 Cb -0.13 -0.81 -0.08 0.00 0.15 0.00 0.00 42.46 41.59 1mm5 s ILE 28 CO -0.03 0.01 1.12 -2.16 -2.11 0.00 0.00 174.94 171.78 1mm5 s PRO 29 N 1.13 3.93 0.00 3.50 0.04 -1.26 -1.41 135.00 140.93 1mm5 s PRO 29 Ca -0.07 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.66 1mm5 s PRO 29 Cb -0.06 -2.48 0.00 0.00 0.04 0.00 0.00 34.50 32.00 1mm5 s PRO 29 CO -0.11 -0.38 0.00 0.00 0.04 0.00 0.00 177.00 176.55 1mm5 n ALA 30 N -0.29 3.00 -2.69 8.56 0.00 -1.23 -4.87 120.51 123.00 1mm5 n ALA 30 Ca 0.06 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.16 1mm5 n ALA 30 Cb 0.48 0.28 -0.11 0.00 0.00 0.00 0.00 19.45 20.10 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 -2.00 3.84 -0.26 0.00 1.09 -1.26 -5.06 121.20 117.55 1mm5 s ILE 31 Ca 0.00 -0.42 -0.02 0.00 -1.10 0.00 0.00 60.65 59.11 1mm5 s ILE 31 Cb 0.00 -2.60 0.15 0.00 -1.06 0.00 0.00 42.46 38.95 1mm5 s ILE 31 CO 0.00 0.58 0.46 -0.89 -0.10 0.00 0.00 174.94 174.99 1mm5 s THR 32 N -0.56 -0.76 0.18 2.92 2.01 -1.26 -1.86 115.64 116.31 1mm5 s THR 32 Ca 0.09 -0.04 -0.21 0.00 0.31 0.00 0.00 61.69 61.84 1mm5 s THR 32 Cb -0.12 -0.88 -0.08 0.00 0.01 0.00 0.00 72.50 71.43 1mm5 s THR 32 CO 0.02 -0.07 0.70 0.26 -0.69 0.00 0.00 174.62 174.84 1mm5 s TRP 33 N 2.67 3.74 -0.16 4.92 0.52 -1.20 -5.07 118.94 124.36 1mm5 s TRP 33 Ca 0.15 1.41 -0.00 0.00 0.02 0.00 0.00 56.10 57.67 1mm5 s TRP 33 Cb -0.15 -2.62 -0.00 0.00 -1.15 0.00 0.00 33.47 29.55 1mm5 s TRP 33 CO -0.18 0.43 -0.13 -1.58 0.02 0.00 0.00 176.95 175.51 1mm5 s HIS 34 N -1.35 2.81 -0.54 -1.98 2.46 -1.26 -4.60 115.29 110.83 1mm5 s HIS 34 Ca 0.38 -0.97 0.02 0.00 0.47 0.00 0.00 55.06 54.97 1mm5 s HIS 34 Cb -0.19 -1.91 0.42 0.00 -0.13 0.00 0.00 32.58 30.77 1mm5 s HIS 34 CO 0.22 -0.44 1.55 0.00 -2.47 0.00 0.00 174.74 173.59 1mm5 n ALA 35 N 4.08 5.67 -0.09 1.58 0.00 -1.26 -4.64 120.51 125.85 1mm5 n ALA 35 Ca -0.19 -3.93 -0.18 0.00 0.00 0.00 0.00 53.44 49.13 1mm5 n ALA 35 Cb 0.52 -1.08 -0.06 0.00 0.00 0.00 0.00 19.45 18.82 1mm5 n ALA 35 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1mm5 n ARG 36 N -0.66 0.41 -2.51 0.00 3.00 -1.26 -5.01 116.66 110.63 1mm5 n ARG 36 Ca 0.49 0.18 -0.21 0.00 -0.00 0.00 0.00 57.85 58.31 1mm5 n ARG 36 Cb 0.65 -1.20 -0.00 0.00 0.00 0.00 0.00 32.46 31.92 1mm5 n ARG 36 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 1mm5 n PHE 37 N -3.95 -1.16 -2.75 -0.14 3.72 -1.26 -4.99 117.46 106.92 1mm5 n PHE 37 Ca -0.33 0.10 -0.20 0.00 -0.05 0.00 0.00 57.45 56.98 1mm5 n PHE 37 Cb 0.70 -4.01 0.09 0.00 -0.94 0.00 0.00 39.48 35.32 1mm5 n PHE 37 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1mm5 n ALA 38 N -2.30 0.54 -1.80 4.37 0.00 -1.26 -4.95 120.51 115.11 1mm5 n ALA 38 Ca -0.22 -1.82 -0.20 0.00 0.00 0.00 0.00 53.44 51.20 1mm5 n ALA 38 Cb 0.67 0.38 -0.08 0.00 0.00 0.00 0.00 19.45 20.42 1mm5 n ALA 38 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1mm5 s TYR 39 N -2.58 1.50 0.80 0.00 2.02 -1.26 -4.92 117.35 112.91 1mm5 s TYR 39 Ca 0.58 1.46 -0.12 0.00 -0.37 0.00 0.00 57.07 58.63 1mm5 s TYR 39 Cb -0.04 -3.65 0.07 0.00 -0.40 0.00 0.00 41.96 37.94 1mm5 s TYR 39 CO 0.38 -1.18 1.11 0.34 -1.57 0.00 0.00 175.55 174.63 1mm5 s ASP 40 N 8.36 4.52 -0.42 2.29 2.15 -1.26 -5.06 116.67 127.26 1mm5 s ASP 40 Ca 0.78 1.18 0.04 0.00 0.43 0.00 0.00 52.55 54.98 1mm5 s ASP 40 Cb -0.06 -1.89 0.17 0.00 -0.30 0.00 0.00 42.92 40.85 1mm5 s ASP 40 CO 0.12 -1.94 0.40 -0.75 -0.17 0.00 0.00 175.17 172.83 1mm5 s LYS 41 N -5.24 0.85 -0.06 4.34 2.20 -1.26 -4.92 119.74 115.65 1mm5 s LYS 41 Ca 0.61 -1.65 0.02 0.00 -0.36 0.00 0.00 55.97 54.60 1mm5 s LYS 41 Cb -0.14 -1.05 0.08 0.00 -1.51 0.00 0.00 37.83 35.21 1mm5 s LYS 41 CO 0.53 -1.33 0.85 -1.91 -0.36 0.00 0.00 175.35 173.13 1mm5 n GLU 42 N 3.21 0.26 -0.79 4.03 2.13 -1.26 -4.96 120.64 123.26 1mm5 n GLU 42 Ca 0.23 -0.74 -0.03 0.00 0.66 0.00 0.00 57.16 57.28 1mm5 n GLU 42 Cb 0.48 0.45 0.20 0.00 0.27 0.00 0.00 31.44 32.84 1mm5 n GLU 42 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 1mm5 n LYS 43 N -0.29 1.78 -0.02 5.31 3.00 -1.26 -4.57 118.16 122.12 1mm5 n LYS 43 Ca -0.18 -3.22 -0.02 0.00 -0.00 0.00 0.00 58.31 54.89 1mm5 n LYS 43 Cb 0.62 -1.78 -0.02 0.00 0.00 0.00 0.00 35.03 33.85 1mm5 n LYS 43 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1mm5 n THR 44 N -1.13 0.20 -2.75 3.15 -1.04 -1.26 -5.09 114.28 106.37 1mm5 n THR 44 Ca 0.31 -0.09 -0.06 0.00 -2.04 0.00 0.00 64.05 62.18 1mm5 n THR 44 Cb 0.98 -0.68 0.01 0.00 -1.82 0.00 0.00 70.33 68.82 1mm5 n THR 44 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1mm5 n ASP 45 N -2.52 -7.33 -0.10 8.00 10.43 -1.26 -4.98 116.55 118.79 1mm5 n ASP 45 Ca -0.06 0.38 -0.11 0.00 2.57 0.00 0.00 54.79 57.57 1mm5 n ASP 45 Cb 0.57 -4.94 -0.15 0.00 1.84 0.00 0.00 41.12 38.44 1mm5 n ASP 45 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1mm5 n ARG 46 N -0.58 0.68 -3.68 -1.24 1.74 -1.26 -5.03 116.66 107.29 1mm5 n ARG 46 Ca 0.09 0.03 -0.10 0.00 -0.77 0.00 0.00 57.85 57.10 1mm5 n ARG 46 Cb 0.43 -1.53 -0.04 0.00 -1.02 0.00 0.00 32.46 30.30 1mm5 n ARG 46 CO 0.00 0.00 0.00 1.52 -1.52 0.00 0.00 177.63 177.63 1mm5 s TYR 47 N -2.50 -0.17 0.03 -1.55 1.13 -1.26 -5.15 117.35 107.88 1mm5 s TYR 47 Ca -0.14 -0.15 -0.25 0.00 -1.41 0.00 0.00 57.07 55.12 1mm5 s TYR 47 Cb 0.07 0.36 -0.05 0.00 -1.10 0.00 0.00 41.96 41.23 1mm5 s TYR 47 CO 0.79 -0.84 0.77 -0.80 -2.51 0.00 0.00 175.55 172.96 1mm5 s ASN 48 N -2.84 7.20 0.11 -0.18 0.02 -1.26 -5.06 114.94 112.92 1mm5 s ASN 48 Ca 0.07 1.43 0.03 0.00 -1.02 0.00 0.00 52.86 53.37 1mm5 s ASN 48 Cb -0.00 -2.47 -0.04 0.00 0.02 0.00 0.00 41.25 38.76 1mm5 s ASN 48 CO -0.06 -0.02 -0.08 -1.61 0.02 0.00 0.00 177.10 175.34 1mm5 s GLU 49 N 0.12 0.90 -0.74 -0.60 0.41 -1.26 -5.11 118.70 112.42 1mm5 s GLU 49 Ca 0.39 -1.33 0.02 0.00 -0.41 0.00 0.00 54.97 53.65 1mm5 s GLU 49 Cb -0.20 -0.40 0.18 0.00 -1.78 0.00 0.00 34.13 31.93 1mm5 s GLU 49 CO 0.23 0.03 0.55 0.50 -0.49 0.00 0.00 175.26 176.08 1mm5 s ARG 50 N -3.56 2.68 0.83 1.61 3.52 -1.26 -5.09 118.95 117.67 1mm5 s ARG 50 Ca 0.12 -3.17 -0.11 0.00 -0.13 0.00 0.00 55.73 52.44 1mm5 s ARG 50 Cb 0.03 -3.61 0.09 0.00 -1.56 0.00 0.00 34.95 29.90 1mm5 s ARG 50 CO -0.02 -1.25 1.09 -1.25 -0.81 0.00 0.00 175.30 173.07 1mm5 s PRO 51 N -1.15 1.77 0.49 5.12 0.04 -1.26 -4.84 135.00 135.17 1mm5 s PRO 51 Ca 0.24 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.33 1mm5 s PRO 51 Cb -0.09 -1.85 0.00 0.00 0.04 0.00 0.00 34.50 32.60 1mm5 s PRO 51 CO -0.12 -1.95 0.00 0.91 0.04 0.00 0.00 177.00 175.88 1mm5 n TRP 52 N -3.72 -3.95 -2.16 0.56 8.01 -1.26 -5.00 117.44 109.92 1mm5 n TRP 52 Ca 0.08 2.12 -0.14 0.00 -1.31 0.00 0.00 57.50 58.25 1mm5 n TRP 52 Cb 0.54 -3.28 0.08 0.00 -2.01 0.00 0.00 31.31 26.63 1mm5 n TRP 52 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1mm5 n GLY 53 N -1.32 0.07 0.00 6.99 0.00 -1.26 -4.89 105.19 104.78 1mm5 n GLY 53 Ca 0.00 -1.90 0.00 0.00 0.00 0.00 0.00 46.02 44.12 1mm5 n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mm5 n GLY 54 N 0.52 -0.37 0.00 -0.02 0.00 -1.07 -4.35 105.19 99.90 1mm5 n GLY 54 Ca 0.09 -1.07 0.00 0.00 0.00 0.00 0.00 46.02 45.05 1mm5 n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1mm5 n GLY 55 N -0.39 -0.66 3.32 -0.02 0.00 -0.53 -2.14 105.19 104.78 1mm5 n GLY 55 Ca 0.00 -0.51 -0.18 0.00 0.00 0.00 0.00 46.02 45.33 1mm5 n GLY 55 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1mm5 s PHE 56 N -4.00 1.57 0.00 1.61 -0.12 -0.29 -0.48 117.98 116.27 1mm5 s PHE 56 Ca 0.00 -1.37 0.00 0.00 -0.05 0.00 0.00 56.93 55.51 1mm5 s PHE 56 Cb 0.00 -0.84 0.00 0.00 -0.63 0.00 0.00 43.02 41.55 1mm5 s PHE 56 CO 0.00 -0.53 0.00 0.41 -0.05 0.00 0.00 175.22 175.05 1mm5 n GLY 57 N -0.56 2.20 3.17 1.99 0.00 0.36 -0.42 105.19 111.93 1mm5 n GLY 57 Ca 0.01 -0.66 -0.09 0.00 0.00 0.00 0.00 46.02 45.27 1mm5 n GLY 57 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mm5 s LEU 58 N 0.00 1.73 0.13 0.99 1.43 -1.07 -2.59 118.68 119.30 1mm5 s LEU 58 Ca 0.00 -1.14 -0.25 0.00 -1.03 0.00 0.00 54.13 51.71 1mm5 s LEU 58 Cb 0.00 0.41 0.07 0.00 0.03 0.00 0.00 46.19 46.70 1mm5 s LEU 58 CO 0.00 -0.74 0.76 -0.94 0.23 0.00 0.00 176.35 175.66 1mm5 s SER 59 N -3.02 -0.40 0.21 2.29 1.04 -1.26 -0.85 113.70 111.70 1mm5 s SER 59 Ca 0.21 -0.17 0.02 0.00 0.48 0.00 0.00 55.95 56.49 1mm5 s SER 59 Cb 0.07 0.55 -0.01 0.00 0.10 0.00 0.00 66.02 66.73 1mm5 s SER 59 CO 0.00 -0.93 0.24 0.54 0.98 0.00 0.00 173.24 174.07 1mm5 n ARG 60 N -0.37 0.34 -4.53 4.02 1.74 0.44 -4.82 116.66 113.47 1mm5 n ARG 60 Ca -0.11 -1.88 -0.26 0.00 -0.77 0.00 0.00 57.85 54.83 1mm5 n ARG 60 Cb 0.62 1.67 -0.17 0.00 -1.02 0.00 0.00 32.46 33.57 1mm5 n ARG 60 CO 0.00 0.00 0.00 1.67 -1.52 0.00 0.00 177.63 177.78 1mm5 s TRP 61 N -3.26 1.60 0.30 -1.55 1.48 -1.26 -2.37 118.94 113.89 1mm5 s TRP 61 Ca 0.21 -0.65 -0.20 0.00 -1.06 0.00 0.00 56.10 54.40 1mm5 s TRP 61 Cb 0.00 -1.18 -0.09 0.00 -1.16 0.00 0.00 33.47 31.04 1mm5 s TRP 61 CO 0.15 -0.34 0.82 0.34 -4.06 0.00 0.00 176.95 173.86 1mm5 s ASP 62 N 0.80 7.05 0.63 -2.66 2.15 0.45 -4.90 116.67 120.20 1mm5 s ASP 62 Ca -0.12 1.54 0.29 0.00 0.43 0.00 0.00 52.55 54.69 1mm5 s ASP 62 Cb -0.15 -2.47 1.55 0.00 -0.30 0.00 0.00 42.92 41.55 1mm5 s ASP 62 CO 0.02 -0.11 1.91 -0.33 -0.17 0.00 0.00 175.17 176.49 1mm5 h GLU 63 N 2.86 0.00 -1.23 4.34 3.07 -2.01 -0.18 114.58 121.43 1mm5 h GLU 63 Ca -0.48 0.00 -0.33 0.00 -0.50 0.00 0.00 59.36 58.06 1mm5 h GLU 63 Cb 1.19 0.00 -0.16 0.00 -0.84 0.00 0.00 28.75 28.93 1mm5 h GLU 63 CO 0.64 0.00 0.42 1.63 -1.40 0.00 0.00 179.01 180.30 1mm5 n LYS 64 N -3.26 1.80 -3.70 2.33 4.76 -1.26 -4.85 118.16 113.99 1mm5 n LYS 64 Ca 0.02 -1.72 -0.22 0.00 -2.87 0.00 0.00 58.31 53.53 1mm5 n LYS 64 Cb 0.49 -1.67 0.03 0.00 -1.84 0.00 0.00 35.03 32.04 1mm5 n LYS 64 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1mm5 n GLY 65 N -0.11 -0.30 3.45 0.72 0.00 -0.10 -5.00 105.19 103.85 1mm5 n GLY 65 Ca 0.33 0.13 -0.23 0.00 0.00 0.00 0.00 46.02 46.26 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 -4.32 3.30 -0.21 1.61 0.02 -1.09 -4.75 114.94 109.50 1mm5 s ASN 66 Ca 0.03 -1.06 -0.02 0.00 -1.02 0.00 0.00 52.86 50.79 1mm5 s ASN 66 Cb -0.02 -0.26 0.06 0.00 0.02 0.00 0.00 41.25 41.06 1mm5 s ASN 66 CO 0.81 -0.07 0.02 0.26 0.02 0.00 0.00 177.10 178.13 1mm5 s TRP 67 N -2.67 1.41 -0.03 2.20 0.51 -0.91 -0.41 118.94 119.04 1mm5 s TRP 67 Ca 0.28 -1.13 0.04 0.00 -2.12 0.00 0.00 56.10 53.18 1mm5 s TRP 67 Cb -0.02 -1.20 -0.01 0.00 -0.81 0.00 0.00 33.47 31.43 1mm5 s TRP 67 CO 0.13 -0.67 -0.16 -3.38 -0.51 0.00 0.00 176.95 172.36 1mm5 s HIS 68 N 1.73 1.58 -0.16 -1.98 -3.43 -1.00 -1.69 115.29 110.34 1mm5 s HIS 68 Ca -0.02 -0.40 -0.30 0.00 -0.80 0.00 0.00 55.06 53.55 1mm5 s HIS 68 Cb -0.18 -1.05 0.12 0.00 -1.43 0.00 0.00 32.58 30.04 1mm5 s HIS 68 CO -0.08 -0.11 0.97 0.20 -2.00 0.00 0.00 174.74 173.71 1mm5 s GLY 69 N -0.09 -0.29 0.67 -1.38 0.00 -1.08 -0.42 107.32 104.73 1mm5 s GLY 69 Ca -0.00 2.00 -0.10 0.00 0.00 0.00 0.00 44.72 46.62 1mm5 s GLY 69 CO 0.01 1.08 1.04 0.48 0.00 0.00 0.00 173.10 175.71 1mm5 s LEU 70 N -1.03 2.99 -0.07 0.66 2.34 -0.03 -0.36 118.68 123.19 1mm5 s LEU 70 Ca -0.02 0.99 -0.02 0.00 0.06 0.00 0.00 54.13 55.14 1mm5 s LEU 70 Cb -0.01 -3.79 0.03 0.00 -0.56 0.00 0.00 46.19 41.87 1mm5 s LEU 70 CO 0.02 -1.27 0.04 -0.31 -1.06 0.00 0.00 176.35 173.77 1mm5 s TYR 71 N -3.25 0.29 -0.35 3.48 2.02 0.47 -2.60 117.35 117.40 1mm5 s TYR 71 Ca 0.57 0.05 -0.14 0.00 -0.37 0.00 0.00 57.07 57.17 1mm5 s TYR 71 Cb -0.11 -0.61 -0.01 0.00 -0.40 0.00 0.00 41.96 40.83 1mm5 s TYR 71 CO 0.50 -0.27 0.30 0.00 -1.57 0.00 0.00 175.55 174.51 1mm5 s ALA 72 N 2.10 3.50 0.32 3.71 0.00 0.44 -2.66 121.76 129.16 1mm5 s ALA 72 Ca 0.05 -1.35 0.04 0.00 0.00 0.00 0.00 51.96 50.70 1mm5 s ALA 72 Cb -0.13 -2.77 -0.06 0.00 0.00 0.00 0.00 23.12 20.16 1mm5 s ALA 72 CO -0.04 -1.09 0.04 -1.64 0.00 0.00 0.00 175.76 173.03 1mm5 s MET 73 N 1.86 1.64 -0.11 0.00 -1.94 0.03 -1.14 119.30 119.64 1mm5 s MET 73 Ca 0.09 -1.90 -0.06 0.00 -1.71 0.00 0.00 55.69 52.10 1mm5 s MET 73 Cb -0.17 -0.91 0.04 0.00 2.01 0.00 0.00 34.83 35.80 1mm5 s MET 73 CO 0.11 -0.16 0.26 0.00 -0.01 0.00 0.00 175.02 175.23 1mm5 s ALA 74 N -3.26 -0.62 -0.10 3.03 0.00 -0.91 -0.43 121.76 119.48 1mm5 s ALA 74 Ca 0.36 1.01 -0.02 0.00 0.00 0.00 0.00 51.96 53.30 1mm5 s ALA 74 Cb 0.08 -0.63 -0.03 0.00 0.00 0.00 0.00 23.12 22.54 1mm5 s ALA 74 CO 0.15 -0.19 -0.02 -0.06 0.00 0.00 0.00 175.76 175.64 1mm5 s PHE 75 N 1.09 3.08 -0.16 0.00 0.40 -1.07 -2.59 117.98 118.73 1mm5 s PHE 75 Ca -0.08 0.06 -0.20 0.00 -0.60 0.00 0.00 56.93 56.11 1mm5 s PHE 75 Cb -0.09 -1.81 -0.03 0.00 0.51 0.00 0.00 43.02 41.60 1mm5 s PHE 75 CO -0.07 0.34 0.59 -1.59 0.70 0.00 0.00 175.22 175.18 1mm5 s LYS 76 N -0.61 4.27 0.76 0.44 0.00 -1.26 -2.54 119.74 120.79 1mm5 s LYS 76 Ca 0.10 0.58 -0.06 0.00 0.00 0.00 0.00 55.97 56.59 1mm5 s LYS 76 Cb -0.12 -3.53 0.12 0.00 0.00 0.00 0.00 37.83 34.30 1mm5 s LYS 76 CO 0.02 -0.10 1.06 0.34 0.00 0.00 0.00 175.35 176.67 1mm5 s ASP 77 N 1.02 4.28 0.38 0.03 3.68 -1.23 -4.98 116.67 119.86 1mm5 s ASP 77 Ca 0.28 0.05 0.11 0.00 2.13 0.00 0.00 52.55 55.13 1mm5 s ASP 77 Cb -0.16 -0.47 0.77 0.00 -1.45 0.00 0.00 42.92 41.61 1mm5 s ASP 77 CO 0.11 -1.92 1.87 0.77 0.13 0.00 0.00 175.17 176.13 1mm5 h SER 78 N -0.75 0.10 0.00 -0.34 4.64 -1.98 -3.34 113.55 111.88 1mm5 h SER 78 Ca -0.41 -0.03 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1mm5 h SER 78 Cb 1.28 -0.03 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1mm5 h SER 78 CO 0.47 0.37 0.00 1.87 -0.87 0.00 0.00 176.83 178.66 1mm5 n TRP 79 N -4.19 0.00 0.00 4.77 -0.00 -1.26 -5.04 117.44 111.72 1mm5 n TRP 79 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.50 57.48 1mm5 n TRP 79 Cb 0.34 -0.32 0.00 0.00 -0.00 0.00 0.00 31.31 31.33 1mm5 n TRP 79 CO 0.00 0.00 0.00 0.27 -0.00 0.00 0.00 177.69 177.96 1mm5 n ASN 80 N -1.72 0.00 -4.68 5.87 6.94 -1.26 -5.13 115.26 115.28 1mm5 n ASN 80 Ca 0.00 0.00 -0.46 0.00 -0.02 0.00 0.00 54.58 54.10 1mm5 n ASN 80 Cb 0.00 0.00 -0.04 0.00 -2.36 0.00 0.00 39.78 37.38 1mm5 n ASN 80 CO 0.00 0.00 0.00 2.29 -1.03 0.00 0.00 177.26 178.52 1mm5 n LYS 81 N 0.00 2.34 -4.00 -3.83 2.85 -1.26 -4.52 118.16 109.75 1mm5 n LYS 81 Ca 0.00 0.85 -0.26 0.00 -1.05 0.00 0.00 58.31 57.85 1mm5 n LYS 81 Cb 0.00 -2.67 -0.04 0.00 -0.65 0.00 0.00 35.03 31.67 1mm5 n LYS 81 CO 0.00 0.00 0.00 1.67 -0.05 0.00 0.00 177.40 179.02 1mm5 s TRP 82 N 2.17 3.36 -0.20 5.58 1.48 -1.26 -3.47 118.94 126.60 1mm5 s TRP 82 Ca 0.83 0.07 -0.02 0.00 -1.06 0.00 0.00 56.10 55.91 1mm5 s TRP 82 Cb -0.63 -1.61 -0.00 0.00 -1.16 0.00 0.00 33.47 30.07 1mm5 s TRP 82 CO 0.41 0.52 -0.09 -1.83 -4.06 0.00 0.00 176.95 171.89 1mm5 s GLU 83 N -3.20 3.28 0.60 3.25 -1.05 -1.05 -4.92 118.70 115.61 1mm5 s GLU 83 Ca 0.33 -0.68 -0.17 0.00 -0.15 0.00 0.00 54.97 54.30 1mm5 s GLU 83 Cb -0.11 -2.86 -0.03 0.00 -0.44 0.00 0.00 34.13 30.70 1mm5 s GLU 83 CO 0.27 -0.15 1.09 -1.25 0.95 0.00 0.00 175.26 176.17 1mm5 s PRO 84 N 1.29 3.17 -0.06 -4.83 0.04 -1.26 -2.59 135.00 130.76 1mm5 s PRO 84 Ca 0.04 1.39 -0.02 0.00 0.04 0.00 0.00 61.00 62.45 1mm5 s PRO 84 Cb -0.14 -2.00 0.03 0.00 0.04 0.00 0.00 34.50 32.43 1mm5 s PRO 84 CO -0.05 -0.96 0.03 0.42 0.04 0.00 0.00 177.00 176.48 1mm5 s ILE 85 N -2.19 0.18 -0.17 0.56 1.01 0.43 -2.43 121.20 118.59 1mm5 s ILE 85 Ca 0.68 0.25 0.01 0.00 0.00 0.00 0.00 60.65 61.58 1mm5 s ILE 85 Cb -0.20 -0.38 0.03 0.00 0.01 0.00 0.00 42.46 41.92 1mm5 s ILE 85 CO 0.35 0.23 -0.13 0.00 0.00 0.00 0.00 174.94 175.39 1mm5 s ALA 86 N 2.05 1.91 -0.07 9.38 0.00 -1.07 -0.79 121.76 133.19 1mm5 s ALA 86 Ca 0.05 -1.02 -0.07 0.00 0.00 0.00 0.00 51.96 50.91 1mm5 s ALA 86 Cb -0.12 -1.14 0.02 0.00 0.00 0.00 0.00 23.12 21.87 1mm5 s ALA 86 CO -0.04 -0.56 0.20 0.20 0.00 0.00 0.00 175.76 175.56 1mm5 s GLY 87 N 1.45 -0.13 -0.18 0.00 0.00 -1.09 -1.62 107.32 105.75 1mm5 s GLY 87 Ca 0.03 0.50 -0.18 0.00 0.00 0.00 0.00 44.72 45.06 1mm5 s GLY 87 CO -0.10 0.41 0.50 -0.19 0.00 0.00 0.00 173.10 173.72 1mm5 s TYR 88 N -0.09 3.40 -0.15 1.90 2.02 0.43 -0.40 117.35 124.47 1mm5 s TYR 88 Ca -0.02 0.78 -0.05 0.00 -0.37 0.00 0.00 57.07 57.42 1mm5 s TYR 88 Cb -0.02 -2.63 -0.03 0.00 -0.40 0.00 0.00 41.96 38.87 1mm5 s TYR 88 CO 0.01 -0.04 0.02 0.20 -1.57 0.00 0.00 175.55 174.16 1mm5 s GLY 89 N 1.04 1.85 -0.25 0.71 0.00 0.51 -2.60 107.32 108.58 1mm5 s GLY 89 Ca 0.24 -0.78 -0.03 0.00 0.00 0.00 0.00 44.72 44.16 1mm5 s GLY 89 CO 0.10 -0.17 -0.04 -0.98 0.00 0.00 0.00 173.10 172.01 1mm5 s TRP 90 N -0.03 3.07 0.05 1.90 0.51 -0.43 -2.64 118.94 121.37 1mm5 s TRP 90 Ca 0.04 -1.41 0.01 0.00 -2.12 0.00 0.00 56.10 52.62 1mm5 s TRP 90 Cb -0.13 -2.09 -0.03 0.00 -0.81 0.00 0.00 33.47 30.41 1mm5 s TRP 90 CO 0.02 -0.69 -0.05 -1.83 -0.51 0.00 0.00 176.95 173.89 1mm5 s GLU 91 N 1.37 0.57 -0.30 4.98 -1.05 -0.68 -1.04 118.70 122.55 1mm5 s GLU 91 Ca 0.01 -0.99 0.01 0.00 -0.15 0.00 0.00 54.97 53.84 1mm5 s GLU 91 Cb -0.16 -0.02 0.06 0.00 -0.44 0.00 0.00 34.13 33.57 1mm5 s GLU 91 CO -0.03 -0.04 -0.03 -1.12 0.95 0.00 0.00 175.26 174.99 1mm5 s SER 92 N -2.29 4.73 0.22 0.83 0.01 0.42 -2.13 113.70 115.48 1mm5 s SER 92 Ca -0.01 -1.46 -0.30 0.00 1.31 0.00 0.00 55.95 55.49 1mm5 s SER 92 Cb -0.01 -1.65 -0.08 0.00 0.21 0.00 0.00 66.02 64.49 1mm5 s SER 92 CO -0.04 -0.26 1.08 -0.89 0.41 0.00 0.00 173.24 173.53 1mm5 s THR 93 N 1.15 3.79 0.03 1.44 2.01 -1.26 -2.60 115.64 120.20 1mm5 s THR 93 Ca -0.04 1.65 0.08 0.00 0.31 0.00 0.00 61.69 63.69 1mm5 s THR 93 Cb -0.20 -4.05 -0.03 0.00 0.01 0.00 0.00 72.50 68.23 1mm5 s THR 93 CO -0.04 0.33 -0.23 0.26 -0.69 0.00 0.00 174.62 174.26 1mm5 s TRP 94 N -0.65 2.43 -0.23 4.92 0.23 -0.64 -4.91 118.94 120.09 1mm5 s TRP 94 Ca 0.47 -0.35 0.02 0.00 -2.03 0.00 0.00 56.10 54.21 1mm5 s TRP 94 Cb -0.30 -1.44 0.05 0.00 0.03 0.00 0.00 33.47 31.82 1mm5 s TRP 94 CO 0.36 0.16 -0.10 0.50 0.96 0.00 0.00 176.95 178.84 1mm5 s ARG 95 N -1.23 2.06 0.87 4.98 3.00 -1.26 -2.60 118.95 124.77 1mm5 s ARG 95 Ca 0.13 -1.07 -0.12 0.00 -1.00 0.00 0.00 55.73 53.67 1mm5 s ARG 95 Cb -0.10 -2.65 0.18 0.00 0.00 0.00 0.00 34.95 32.38 1mm5 s ARG 95 CO 0.03 -0.51 0.41 -2.30 0.00 0.00 0.00 175.30 172.93 1mm5 n PRO 96 N 4.58 -1.71 0.11 5.12 -0.02 -1.26 -4.84 135.00 136.98 1mm5 n PRO 96 Ca -0.14 -0.69 -0.03 0.00 -2.02 0.00 0.00 63.50 60.62 1mm5 n PRO 96 Cb 0.44 -1.24 0.08 0.00 -0.02 0.00 0.00 33.50 32.76 1mm5 n PRO 96 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 1mm5 h LEU 97 N 0.00 0.00 -2.02 2.45 3.38 -2.01 -3.13 115.31 113.98 1mm5 h LEU 97 Ca -0.19 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.85 1mm5 h LEU 97 Cb 0.63 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 1mm5 h LEU 97 CO 0.11 0.74 0.18 0.00 0.09 0.00 0.00 178.44 179.56 1mm5 h ALA 98 N 1.26 2.20 -5.05 1.53 0.00 -2.01 -3.47 119.26 113.73 1mm5 h ALA 98 Ca -0.01 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1mm5 h ALA 98 Cb 1.32 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.13 1mm5 h ALA 98 CO 0.10 -0.30 -0.86 -0.25 0.00 0.00 0.00 179.25 177.94 1mm5 n ASP 99 N -4.42 -7.72 -3.51 0.00 10.43 -1.18 -5.07 116.55 105.08 1mm5 n ASP 99 Ca 0.03 1.21 -0.14 0.00 2.57 0.00 0.00 54.79 58.46 1mm5 n ASP 99 Cb 0.33 -5.14 -0.06 0.00 1.84 0.00 0.00 41.12 38.10 1mm5 n ASP 99 CO 0.00 0.00 0.00 -0.70 -1.07 0.00 0.00 177.20 175.43 1mm5 s GLU 100 N -1.73 1.74 0.34 -1.24 2.12 -1.26 -5.04 118.70 113.63 1mm5 s GLU 100 Ca 0.04 -1.69 0.01 0.00 0.36 0.00 0.00 54.97 53.70 1mm5 s GLU 100 Cb -0.01 0.41 0.59 0.00 0.26 0.00 0.00 34.13 35.38 1mm5 s GLU 100 CO 0.74 -0.70 2.00 -0.91 -0.54 0.00 0.00 175.26 175.85 1mm5 h ASN 101 N 2.20 0.78 -2.61 -1.70 4.21 -1.97 -3.42 115.58 113.07 1mm5 h ASN 101 Ca -0.29 -0.02 -0.52 0.00 1.21 0.00 0.00 56.30 56.68 1mm5 h ASN 101 Cb 1.24 -0.19 0.05 0.00 -1.12 0.00 0.00 38.32 38.29 1mm5 h ASN 101 CO 0.40 0.56 1.06 0.12 -1.29 0.00 0.00 177.43 178.28 1mm5 s PHE 102 N -5.77 2.49 0.04 1.19 2.19 -1.26 -3.55 117.98 113.32 1mm5 s PHE 102 Ca -0.10 0.17 -0.05 0.00 0.33 0.00 0.00 56.93 57.27 1mm5 s PHE 102 Cb 0.18 -4.14 -0.01 0.00 -1.31 0.00 0.00 43.02 37.74 1mm5 s PHE 102 CO 0.77 -4.52 0.09 -3.38 1.83 0.00 0.00 175.22 170.01 1mm5 s HIS 103 N 2.08 0.24 -0.07 10.12 -3.43 -1.07 -4.74 115.29 118.42 1mm5 s HIS 103 Ca 0.78 -0.59 -0.03 0.00 -0.80 0.00 0.00 55.06 54.42 1mm5 s HIS 103 Cb -0.47 -0.17 0.04 0.00 -1.43 0.00 0.00 32.58 30.56 1mm5 s HIS 103 CO 0.34 -0.38 0.15 -0.48 -2.00 0.00 0.00 174.74 172.37 1mm5 s LEU 104 N -2.30 0.58 0.30 5.38 2.34 -1.07 -2.45 118.68 121.46 1mm5 s LEU 104 Ca -0.02 0.31 0.04 0.00 0.06 0.00 0.00 54.13 54.52 1mm5 s LEU 104 Cb 0.01 0.35 -0.03 0.00 -0.56 0.00 0.00 46.19 45.96 1mm5 s LEU 104 CO -0.06 -0.16 0.20 -0.83 -1.06 0.00 0.00 176.35 174.44 1mm5 s GLY 105 N 1.36 2.08 0.04 -3.48 0.00 0.42 -1.61 107.32 106.12 1mm5 s GLY 105 Ca -0.07 -1.85 0.05 0.00 0.00 0.00 0.00 44.72 42.85 1mm5 s GLY 105 CO -0.06 -1.51 -0.15 -2.27 0.00 0.00 0.00 173.10 169.11 1mm5 s LEU 106 N -3.34 2.17 0.03 0.66 1.98 -1.07 -2.05 118.68 117.05 1mm5 s LEU 106 Ca 0.38 -0.46 -0.28 0.00 -2.89 0.00 0.00 54.13 50.88 1mm5 s LEU 106 Cb 0.04 -0.64 0.10 0.00 0.66 0.00 0.00 46.19 46.35 1mm5 s LEU 106 CO 0.21 0.05 1.23 -0.83 -1.89 0.00 0.00 176.35 175.11 1mm5 s GLY 107 N -1.13 -0.18 0.41 7.98 0.00 -0.82 -0.44 107.32 113.13 1mm5 s GLY 107 Ca 0.02 0.19 0.07 0.00 0.00 0.00 0.00 44.72 45.00 1mm5 s GLY 107 CO 0.01 3.05 0.01 -1.36 0.00 0.00 0.00 173.10 174.81 1mm5 s PHE 108 N -2.23 2.52 -0.21 1.90 0.40 -0.20 -1.84 117.98 118.31 1mm5 s PHE 108 Ca 0.22 -0.66 -0.03 0.00 -0.60 0.00 0.00 56.93 55.87 1mm5 s PHE 108 Cb 0.01 -1.76 0.06 0.00 0.51 0.00 0.00 43.02 41.84 1mm5 s PHE 108 CO -0.01 0.45 0.04 0.99 0.70 0.00 0.00 175.22 177.40 1mm5 s THR 109 N -2.70 0.53 -0.18 0.64 2.01 -0.96 -1.31 115.64 113.67 1mm5 s THR 109 Ca 0.35 -0.63 -0.01 0.00 0.31 0.00 0.00 61.69 61.71 1mm5 s THR 109 Cb 0.10 -1.08 -0.00 0.00 0.01 0.00 0.00 72.50 71.52 1mm5 s THR 109 CO 0.18 -0.26 -0.11 0.00 -0.69 0.00 0.00 174.62 173.74 1mm5 s ALA 110 N 1.85 2.63 0.00 7.40 0.00 -1.07 -1.87 121.76 130.69 1mm5 s ALA 110 Ca 0.00 -1.10 0.00 0.00 0.00 0.00 0.00 51.96 50.86 1mm5 s ALA 110 Cb -0.17 -1.42 0.00 0.00 0.00 0.00 0.00 23.12 21.53 1mm5 s ALA 110 CO -0.10 -0.21 0.00 0.41 0.00 0.00 0.00 175.76 175.86 1mm5 n GLY 111 N 4.38 4.35 3.25 0.00 0.00 -0.97 -0.43 105.19 115.76 1mm5 n GLY 111 Ca -0.19 -1.41 -0.13 0.00 0.00 0.00 0.00 46.02 44.29 1mm5 n GLY 111 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1mm5 s VAL 112 N -1.68 0.02 -0.28 1.61 1.01 -0.64 -2.02 120.40 118.42 1mm5 s VAL 112 Ca 0.00 -0.13 -0.11 0.00 0.00 0.00 0.00 61.98 61.74 1mm5 s VAL 112 Cb 0.00 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.80 1mm5 s VAL 112 CO 0.00 -0.07 0.18 -0.89 0.00 0.00 0.00 175.10 174.32 1mm5 s THR 113 N -0.24 5.14 0.28 3.92 2.01 -0.91 -2.59 115.64 123.24 1mm5 s THR 113 Ca -0.04 0.05 -0.29 0.00 0.31 0.00 0.00 61.69 61.73 1mm5 s THR 113 Cb -0.03 -3.47 -0.09 0.00 0.01 0.00 0.00 72.50 68.92 1mm5 s THR 113 CO 0.02 0.23 1.00 0.00 -0.69 0.00 0.00 174.62 175.18 1mm5 s ALA 114 N 1.73 3.33 0.04 7.40 0.00 -1.02 -2.08 121.76 131.16 1mm5 s ALA 114 Ca 0.07 0.71 0.07 0.00 0.00 0.00 0.00 51.96 52.81 1mm5 s ALA 114 Cb -0.16 -3.25 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1mm5 s ALA 114 CO 0.10 0.04 -0.20 0.50 0.00 0.00 0.00 175.76 176.20 1mm5 s ARG 115 N -1.49 1.35 -0.38 0.00 3.52 -1.26 -4.33 118.95 116.36 1mm5 s ARG 115 Ca 0.45 -0.91 0.11 0.00 -0.13 0.00 0.00 55.73 55.25 1mm5 s ARG 115 Cb -0.27 -1.45 0.34 0.00 -1.56 0.00 0.00 34.95 32.01 1mm5 s ARG 115 CO 0.34 0.37 0.73 -0.25 -0.81 0.00 0.00 175.30 175.68 1mm5 n ASP 116 N 1.88 0.57 0.12 -2.12 8.00 -1.26 -3.95 116.55 119.78 1mm5 n ASP 116 Ca -0.17 -3.02 0.00 0.00 0.71 0.00 0.00 54.79 52.31 1mm5 n ASP 116 Cb 0.53 -0.47 0.00 0.00 -0.02 0.00 0.00 41.12 41.16 1mm5 n ASP 116 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 1mm5 n ASN 117 N 0.41 -1.59 0.09 -2.24 2.85 -1.26 -5.00 115.26 108.52 1mm5 n ASN 117 Ca 0.23 0.43 -0.04 0.00 -0.11 0.00 0.00 54.58 55.10 1mm5 n ASN 117 Cb 0.65 1.66 -0.02 0.00 1.24 0.00 0.00 39.78 43.31 1mm5 n ASN 117 CO 0.00 0.00 0.00 -0.25 -2.11 0.00 0.00 177.26 174.90 1mm5 h TRP 118 N 0.00 -0.23 0.00 1.20 2.91 -2.00 -3.46 115.95 114.38 1mm5 h TRP 118 Ca 0.00 -0.01 -0.03 0.00 1.13 0.00 0.00 58.89 59.98 1mm5 h TRP 118 Cb 0.00 0.07 -0.03 0.00 -0.51 0.00 0.00 29.16 28.70 1mm5 h TRP 118 CO 0.00 -0.14 -0.06 -1.71 -1.03 0.00 0.00 178.44 175.50 1mm5 n ASN 119 N -3.03 -0.26 -3.22 2.65 2.85 -1.26 -5.02 115.26 107.95 1mm5 n ASN 119 Ca -0.03 -0.97 -0.10 0.00 -0.11 0.00 0.00 54.58 53.36 1mm5 n ASN 119 Cb 0.10 0.11 0.04 0.00 1.24 0.00 0.00 39.78 41.27 1mm5 n ASN 119 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 1mm5 n TYR 120 N -0.21 -2.63 -3.84 1.20 4.01 -1.25 -4.99 117.16 109.45 1mm5 n TYR 120 Ca -0.04 0.94 -0.34 0.00 -0.16 0.00 0.00 57.90 58.30 1mm5 n TYR 120 Cb 0.50 -4.02 -0.12 0.00 -0.31 0.00 0.00 39.34 35.39 1mm5 n TYR 120 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1mm5 s ILE 121 N -3.22 3.11 0.94 -0.72 1.01 -1.26 -4.95 121.20 116.11 1mm5 s ILE 121 Ca 0.25 -2.87 -0.12 0.00 0.00 0.00 0.00 60.65 57.91 1mm5 s ILE 121 Cb -0.04 -3.11 0.05 0.00 0.01 0.00 0.00 42.46 39.38 1mm5 s ILE 121 CO 0.76 -0.79 0.54 -2.65 0.00 0.00 0.00 174.94 172.80 1mm5 n PRO 122 N 3.62 -0.31 -3.52 2.79 -0.02 -1.26 -4.60 135.00 131.70 1mm5 n PRO 122 Ca 0.05 -0.04 -0.29 0.00 -2.02 0.00 0.00 63.50 61.20 1mm5 n PRO 122 Cb 0.37 -1.95 -0.13 0.00 -0.02 0.00 0.00 33.50 31.77 1mm5 n PRO 122 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1mm5 s LEU 123 N -2.05 0.98 0.43 2.45 2.96 -0.88 -4.92 118.68 117.64 1mm5 s LEU 123 Ca 0.59 -1.86 -0.24 0.00 -0.22 0.00 0.00 54.13 52.39 1mm5 s LEU 123 Cb -0.22 -0.44 -0.08 0.00 0.50 0.00 0.00 46.19 45.96 1mm5 s LEU 123 CO 0.66 -0.36 1.22 -2.16 -1.32 0.00 0.00 176.35 174.38 1mm5 s PRO 124 N 1.43 3.85 -0.08 0.98 0.04 -1.26 -2.15 135.00 137.81 1mm5 s PRO 124 Ca 0.14 1.93 -0.10 0.00 0.04 0.00 0.00 61.00 63.02 1mm5 s PRO 124 Cb -0.20 -2.57 0.02 0.00 0.04 0.00 0.00 34.50 31.79 1mm5 s PRO 124 CO -0.14 -0.52 0.26 0.08 0.04 0.00 0.00 177.00 176.73 1mm5 s VAL 125 N -1.41 0.01 0.01 -0.36 1.01 -0.85 -4.97 120.40 113.84 1mm5 s VAL 125 Ca 0.60 -0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.57 1mm5 s VAL 125 Cb -0.33 -0.40 -0.02 0.00 0.00 0.00 0.00 36.38 35.63 1mm5 s VAL 125 CO 0.41 -0.05 -0.25 -1.48 0.00 0.00 0.00 175.10 173.73 1mm5 s LEU 126 N -0.10 2.19 -0.17 3.92 2.34 -1.26 -2.29 118.68 123.31 1mm5 s LEU 126 Ca -0.02 -0.49 -0.05 0.00 0.06 0.00 0.00 54.13 53.63 1mm5 s LEU 126 Cb -0.03 -1.35 0.08 0.00 -0.56 0.00 0.00 46.19 44.34 1mm5 s LEU 126 CO 0.01 0.29 0.29 -0.76 -1.06 0.00 0.00 176.35 175.13 1mm5 s LEU 127 N -0.92 -0.37 0.44 1.48 1.02 -0.78 -5.00 118.68 114.54 1mm5 s LEU 127 Ca 0.11 0.47 -0.23 0.00 0.02 0.00 0.00 54.13 54.51 1mm5 s LEU 127 Cb -0.10 0.80 -0.08 0.00 0.02 0.00 0.00 46.19 46.83 1mm5 s LEU 127 CO 0.01 -0.26 1.08 -2.16 0.02 0.00 0.00 176.35 175.04 1mm5 s PRO 128 N 2.45 3.96 0.16 1.29 0.04 -1.26 -2.26 135.00 139.38 1mm5 s PRO 128 Ca 0.03 1.56 -0.24 0.00 0.04 0.00 0.00 61.00 62.39 1mm5 s PRO 128 Cb -0.13 -2.40 0.06 0.00 0.04 0.00 0.00 34.50 32.06 1mm5 s PRO 128 CO -0.11 -0.33 0.86 -0.48 0.04 0.00 0.00 177.00 176.98 1mm5 s LEU 129 N -2.94 -0.25 -0.01 -3.56 0.05 -0.77 -2.59 118.68 108.60 1mm5 s LEU 129 Ca 0.62 -0.37 0.04 0.00 0.05 0.00 0.00 54.13 54.46 1mm5 s LEU 129 Cb -0.23 2.31 -0.01 0.00 -2.05 0.00 0.00 46.19 46.22 1mm5 s LEU 129 CO 0.28 -0.98 -0.12 0.00 -0.55 0.00 0.00 176.35 174.98 1mm5 s ALA 130 N -3.46 1.01 -0.32 1.48 0.00 -0.89 -1.95 121.76 117.63 1mm5 s ALA 130 Ca 0.10 -0.50 -0.17 0.00 0.00 0.00 0.00 51.96 51.40 1mm5 s ALA 130 Cb -0.02 -0.28 -0.01 0.00 0.00 0.00 0.00 23.12 22.80 1mm5 s ALA 130 CO 0.01 0.23 0.47 -1.12 0.00 0.00 0.00 175.76 175.34 1mm5 s SER 131 N -0.18 6.30 -0.09 0.00 0.01 -0.87 -2.58 113.70 116.30 1mm5 s SER 131 Ca 0.03 0.08 -0.04 0.00 1.31 0.00 0.00 55.95 57.33 1mm5 s SER 131 Cb -0.06 -2.25 0.04 0.00 0.21 0.00 0.00 66.02 63.97 1mm5 s SER 131 CO -0.00 -0.38 0.20 0.54 0.41 0.00 0.00 173.24 174.01 1mm5 s VAL 132 N 2.27 -0.08 0.00 3.43 0.11 -0.39 -0.44 120.40 125.30 1mm5 s VAL 132 Ca 0.17 0.18 0.00 0.00 -2.93 0.00 0.00 61.98 59.41 1mm5 s VAL 132 Cb -0.16 -0.31 0.00 0.00 -1.53 0.00 0.00 36.38 34.38 1mm5 s VAL 132 CO 0.12 0.08 0.00 0.61 -3.33 0.00 0.00 175.10 172.57 1mm5 n GLY 133 N 4.36 1.64 2.77 6.54 0.00 -1.03 -0.85 105.19 118.62 1mm5 n GLY 133 Ca -0.24 -0.49 -0.18 0.00 0.00 0.00 0.00 46.02 45.11 1mm5 n GLY 133 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1mm5 s TYR 134 N -1.70 -0.25 0.00 1.61 6.14 0.45 -2.59 117.35 121.01 1mm5 s TYR 134 Ca 0.00 0.29 0.00 0.00 0.64 0.00 0.00 57.07 58.00 1mm5 s TYR 134 Cb 0.00 -0.35 0.00 0.00 0.42 0.00 0.00 41.96 42.03 1mm5 s TYR 134 CO 0.00 -0.54 0.00 0.41 0.64 0.00 0.00 175.55 176.06 1mm5 n GLY 135 N 5.32 3.50 0.20 8.97 0.00 -1.23 -1.45 105.19 120.50 1mm5 n GLY 135 Ca -0.05 0.24 0.14 0.00 0.00 0.00 0.00 46.02 46.34 1mm5 n GLY 135 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1mm5 h PRO 136 N 0.00 0.00 -5.79 1.61 0.13 -1.97 -3.42 132.00 122.56 1mm5 h PRO 136 Ca 0.00 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.53 1mm5 h PRO 136 Cb 0.00 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.03 1mm5 h PRO 136 CO 0.00 0.00 0.43 0.08 -0.23 0.00 0.00 178.00 178.28 1mm5 s VAL 137 N -3.44 4.80 -0.25 1.56 1.01 -0.53 -4.35 120.40 119.20 1mm5 s VAL 137 Ca 0.04 1.30 0.01 0.00 0.00 0.00 0.00 61.98 63.33 1mm5 s VAL 137 Cb 0.09 -4.14 0.06 0.00 0.00 0.00 0.00 36.38 32.39 1mm5 s VAL 137 CO 0.51 -0.21 -0.05 -0.89 0.00 0.00 0.00 175.10 174.47 1mm5 s THR 138 N 2.94 1.62 -0.28 3.92 2.01 -1.00 -0.41 115.64 124.45 1mm5 s THR 138 Ca 0.33 -1.35 -0.08 0.00 0.31 0.00 0.00 61.69 60.90 1mm5 s THR 138 Cb -0.14 -1.90 -0.02 0.00 0.01 0.00 0.00 72.50 70.45 1mm5 s THR 138 CO 0.11 -0.15 0.11 -0.36 -0.69 0.00 0.00 174.62 173.64 1mm5 s PHE 139 N 1.34 3.13 -0.20 4.92 0.40 -0.03 -0.67 117.98 126.87 1mm5 s PHE 139 Ca -0.05 -0.51 -0.04 0.00 -0.60 0.00 0.00 56.93 55.73 1mm5 s PHE 139 Cb -0.19 -2.29 -0.02 0.00 0.51 0.00 0.00 43.02 41.03 1mm5 s PHE 139 CO -0.07 -0.41 -0.03 -0.65 0.70 0.00 0.00 175.22 174.76 1mm5 s GLN 140 N 1.61 3.49 -0.17 0.44 -0.21 -0.39 -1.26 119.66 123.18 1mm5 s GLN 140 Ca 0.05 -0.58 -0.06 0.00 0.02 0.00 0.00 55.36 54.79 1mm5 s GLN 140 Cb -0.16 -3.00 -0.03 0.00 1.00 0.00 0.00 33.01 30.81 1mm5 s GLN 140 CO 0.05 -0.06 0.02 -1.64 -2.12 0.00 0.00 175.29 171.54 1mm5 s MET 141 N 1.14 3.82 0.12 2.91 -1.94 -1.06 -0.80 119.30 123.48 1mm5 s MET 141 Ca 0.02 -0.42 0.06 0.00 -1.71 0.00 0.00 55.69 53.64 1mm5 s MET 141 Cb -0.15 -3.07 -0.04 0.00 2.01 0.00 0.00 34.83 33.58 1mm5 s MET 141 CO 0.00 0.28 -0.01 0.99 -0.01 0.00 0.00 175.02 176.27 1mm5 s THR 142 N 0.32 3.85 -0.09 2.05 2.01 0.43 -2.10 115.64 122.10 1mm5 s THR 142 Ca 0.00 -1.17 -0.01 0.00 0.31 0.00 0.00 61.69 60.81 1mm5 s THR 142 Cb -0.13 -2.87 -0.03 0.00 0.01 0.00 0.00 72.50 69.48 1mm5 s THR 142 CO 0.01 0.03 -0.02 -0.31 -0.69 0.00 0.00 174.62 173.64 1mm5 s TYR 143 N -1.45 3.08 -0.48 4.92 2.02 -1.07 -2.10 117.35 122.28 1mm5 s TYR 143 Ca 0.26 0.08 0.04 0.00 -0.37 0.00 0.00 57.07 57.07 1mm5 s TYR 143 Cb -0.11 -1.80 0.12 0.00 -0.40 0.00 0.00 41.96 39.78 1mm5 s TYR 143 CO 0.18 0.35 0.22 0.42 -1.57 0.00 0.00 175.55 175.15 1mm5 s ILE 144 N -0.66 2.41 0.03 2.71 1.01 -1.05 -4.65 121.20 121.01 1mm5 s ILE 144 Ca 0.10 -3.06 -0.30 0.00 0.00 0.00 0.00 60.65 57.39 1mm5 s ILE 144 Cb -0.12 -2.70 -0.06 0.00 0.01 0.00 0.00 42.46 39.59 1mm5 s ILE 144 CO 0.02 -0.77 1.44 -2.16 0.00 0.00 0.00 174.94 173.47 1mm5 s PRO 145 N -0.00 4.27 0.00 2.79 0.04 -1.26 -3.79 135.00 137.05 1mm5 s PRO 145 Ca 0.16 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.25 1mm5 s PRO 145 Cb -0.24 -3.52 0.00 0.00 0.04 0.00 0.00 34.50 30.78 1mm5 s PRO 145 CO -0.02 -0.58 0.00 0.41 0.04 0.00 0.00 177.00 176.86 1mm5 n GLY 146 N 3.68 0.41 0.40 0.56 0.00 -1.26 -5.05 105.19 103.92 1mm5 n GLY 146 Ca 0.13 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 1mm5 n GLY 146 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1mm5 n THR 147 N -0.25 0.53 -0.49 2.61 5.66 -1.26 -5.05 114.28 116.03 1mm5 n THR 147 Ca 0.00 -0.17 -0.28 0.00 -3.05 0.00 0.00 64.05 60.55 1mm5 n THR 147 Cb 0.00 -1.26 0.25 0.00 -1.55 0.00 0.00 70.33 67.77 1mm5 n THR 147 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 1mm5 s TYR 148 N -2.18 1.29 -0.15 1.09 1.51 -1.26 -4.98 117.35 112.66 1mm5 s TYR 148 Ca -0.13 1.26 0.13 0.00 -1.01 0.00 0.00 57.07 57.31 1mm5 s TYR 148 Cb 0.04 -3.11 -0.18 0.00 -0.11 0.00 0.00 41.96 38.60 1mm5 s TYR 148 CO 0.19 -3.90 0.04 -1.71 -1.11 0.00 0.00 175.55 169.05 1mm5 n ASN 149 N -4.95 1.35 -2.02 2.29 4.05 -1.26 -4.45 115.26 110.26 1mm5 n ASN 149 Ca 0.04 -0.01 -0.13 0.00 0.45 0.00 0.00 54.58 54.93 1mm5 n ASN 149 Cb 0.54 0.80 0.24 0.00 1.23 0.00 0.00 39.78 42.59 1mm5 n ASN 149 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 1mm5 n ASN 150 N -2.59 4.19 0.00 1.20 3.02 -1.26 -5.02 115.26 114.80 1mm5 n ASN 150 Ca -0.25 -3.43 0.00 0.00 -0.03 0.00 0.00 54.58 50.87 1mm5 n ASN 150 Cb 0.98 -0.78 0.00 0.00 -0.61 0.00 0.00 39.78 39.38 1mm5 n ASN 150 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1mm5 n GLY 151 N -0.66 1.10 1.51 7.41 0.00 -1.26 -5.06 105.19 108.24 1mm5 n GLY 151 Ca 0.48 -1.64 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1mm5 n GLY 151 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1mm5 n ASN 152 N -0.32 0.05 -4.23 1.61 6.94 -1.26 -4.75 115.26 113.29 1mm5 n ASN 152 Ca 0.00 0.03 -0.32 0.00 -0.02 0.00 0.00 54.58 54.28 1mm5 n ASN 152 Cb 0.00 0.01 -0.17 0.00 -2.36 0.00 0.00 39.78 37.26 1mm5 n ASN 152 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 1mm5 s VAL 153 N -2.00 2.04 0.00 3.53 1.01 -1.25 -4.86 120.40 118.88 1mm5 s VAL 153 Ca 0.00 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 60.97 1mm5 s VAL 153 Cb 0.00 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.60 1mm5 s VAL 153 CO 0.00 0.56 -0.02 -0.31 0.00 0.00 0.00 175.10 175.33 1mm5 s TYR 154 N 0.16 3.03 -0.03 5.22 2.02 -1.26 -2.52 117.35 123.96 1mm5 s TYR 154 Ca -0.13 0.05 0.05 0.00 -0.37 0.00 0.00 57.07 56.66 1mm5 s TYR 154 Cb -0.16 -1.65 -0.01 0.00 -0.40 0.00 0.00 41.96 39.74 1mm5 s TYR 154 CO 0.07 0.44 -0.18 0.12 -1.57 0.00 0.00 175.55 174.43 1mm5 s PHE 155 N -1.07 1.68 0.03 2.71 2.19 -0.89 -3.22 117.98 119.40 1mm5 s PHE 155 Ca 0.19 -0.41 0.08 0.00 0.33 0.00 0.00 56.93 57.12 1mm5 s PHE 155 Cb -0.11 -1.11 -0.03 0.00 -1.31 0.00 0.00 43.02 40.46 1mm5 s PHE 155 CO 0.10 -0.10 -0.23 0.00 1.83 0.00 0.00 175.22 176.82 1mm5 s ALA 156 N -0.17 2.39 -0.04 11.12 0.00 -0.78 -0.42 121.76 133.86 1mm5 s ALA 156 Ca 0.01 -1.20 -0.02 0.00 0.00 0.00 0.00 51.96 50.75 1mm5 s ALA 156 Cb -0.09 -0.62 0.03 0.00 0.00 0.00 0.00 23.12 22.44 1mm5 s ALA 156 CO 0.01 0.55 0.06 -1.58 0.00 0.00 0.00 175.76 174.80 1mm5 s TRP 157 N -0.81 0.02 -0.10 0.00 0.52 0.02 -3.47 118.94 115.12 1mm5 s TRP 157 Ca 0.12 0.27 -0.19 0.00 0.02 0.00 0.00 56.10 56.32 1mm5 s TRP 157 Cb -0.10 -0.37 -0.04 0.00 -1.15 0.00 0.00 33.47 31.80 1mm5 s TRP 157 CO 0.03 -0.17 0.52 -1.64 0.02 0.00 0.00 176.95 175.70 1mm5 s MET 158 N 1.82 4.34 -0.05 4.98 -1.94 -0.50 -1.26 119.30 126.70 1mm5 s MET 158 Ca 0.00 0.53 0.04 0.00 -1.71 0.00 0.00 55.69 54.55 1mm5 s MET 158 Cb -0.12 -3.42 -0.00 0.00 2.01 0.00 0.00 34.83 33.29 1mm5 s MET 158 CO -0.03 0.18 -0.17 0.50 -0.01 0.00 0.00 175.02 175.48 1mm5 s ARG 159 N 0.54 1.85 0.03 2.03 3.00 0.16 -2.16 118.95 124.41 1mm5 s ARG 159 Ca 0.28 -0.59 0.03 0.00 -1.00 0.00 0.00 55.73 54.45 1mm5 s ARG 159 Cb -0.16 -1.57 -0.02 0.00 0.00 0.00 0.00 34.95 33.20 1mm5 s ARG 159 CO 0.12 0.20 -0.09 -0.06 0.00 0.00 0.00 175.30 175.47 1mm5 s PHE 160 N 0.17 0.76 -0.16 5.12 0.40 -1.07 -2.37 117.98 120.84 1mm5 s PHE 160 Ca -0.07 -0.38 -0.07 0.00 -0.60 0.00 0.00 56.93 55.81 1mm5 s PHE 160 Cb -0.13 -0.46 -0.04 0.00 0.51 0.00 0.00 43.02 42.90 1mm5 s PHE 160 CO 0.03 -0.03 0.10 1.14 0.70 0.00 0.00 175.22 177.15 1mm5 s GLN 161 N -1.19 3.77 -0.12 0.44 0.00 -1.26 -1.47 119.66 119.83 1mm5 s GLN 161 Ca -0.05 -0.25 0.02 0.00 -0.00 0.00 0.00 55.36 55.08 1mm5 s GLN 161 Cb -0.08 -3.22 0.01 0.00 0.00 0.00 0.00 33.01 29.73 1mm5 s GLN 161 CO 0.01 0.48 -0.19 0.12 0.00 0.00 0.00 175.29 175.71 1mm5 s PHE 162 N -0.20 2.32 0.17 9.60 2.19 -0.60 -4.96 117.98 126.51 1mm5 s PHE 162 Ca 0.09 -1.14 -0.30 0.00 0.33 0.00 0.00 56.93 55.91 1mm5 s PHE 162 Cb -0.12 -1.62 -0.07 0.00 -1.31 0.00 0.00 43.02 39.90 1mm5 s PHE 162 CO 0.01 -0.55 0.96 -1.17 1.83 0.00 0.00 175.22 176.30 1mm5 s LEU 163 N 0.91 4.56 0.47 6.12 0.20 -1.26 -1.54 118.68 128.14 1mm5 s LEU 163 Ca -0.07 1.89 0.13 0.00 0.69 0.00 0.00 54.13 56.77 1mm5 s LEU 163 Cb -0.15 -3.60 1.09 0.00 -0.43 0.00 0.00 46.19 43.10 1mm5 s LEU 163 CO -0.02 0.02 2.10 -0.08 -0.29 0.00 0.00 176.35 178.08 1mm5 h GLU 164 N 4.90 0.25 -2.57 1.98 4.22 -1.99 -3.43 114.58 117.95 1mm5 h GLU 164 Ca -0.44 -0.01 -0.10 0.00 0.08 0.00 0.00 59.36 58.89 1mm5 h GLU 164 Cb 1.21 -0.06 -0.24 0.00 0.50 0.00 0.00 28.75 30.16 1mm5 h GLU 164 CO 0.70 0.16 -0.18 -3.38 -2.18 0.00 0.00 179.01 174.13 1mm5 s HIS 165 N -5.26 -0.57 0.43 0.92 -3.43 -1.26 -5.14 115.29 100.98 1mm5 s HIS 165 Ca -0.07 1.32 0.07 0.00 -0.80 0.00 0.00 55.06 55.58 1mm5 s HIS 165 Cb 0.17 0.22 -0.05 0.00 -1.43 0.00 0.00 32.58 31.50 1mm5 s HIS 165 CO 0.70 -0.29 0.15 -1.01 -2.00 0.00 0.00 174.74 172.30 1mm5 s HIS 166 N 0.57 2.49 -0.44 0.38 3.76 -1.26 -5.05 115.29 115.75 1mm5 s HIS 166 Ca -0.03 -0.64 0.04 0.00 -0.15 0.00 0.00 55.06 54.29 1mm5 s HIS 166 Cb -0.04 -1.90 0.50 0.00 1.11 0.00 0.00 32.58 32.24 1mm5 s HIS 166 CO -0.03 0.20 1.66 0.72 -0.85 0.00 0.00 174.74 176.44 1mm5 n HIS 167 N -1.22 2.48 -2.31 1.40 8.25 -1.26 -4.30 115.22 118.26 1mm5 n HIS 167 Ca -0.03 -2.26 -0.04 0.00 -0.26 0.00 0.00 57.72 55.14 1mm5 n HIS 167 Cb 0.65 -0.84 0.03 0.00 1.12 0.00 0.00 29.99 30.95 1mm5 n HIS 167 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1mm5 n HIS 168 N -0.97 -0.96 0.23 4.41 -0.00 -1.26 -5.00 115.22 111.67 1mm5 n HIS 168 Ca 0.50 -1.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.22 1mm5 n HIS 168 Cb 1.00 0.98 0.00 0.00 -0.00 0.00 0.00 29.99 31.98 1mm5 n HIS 168 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.34 177.06 1mm5 n HIS 169 N -0.72 -4.57 -1.30 1.57 -0.00 -1.26 -5.30 115.22 103.64 1mm5 n HIS 169 Ca -0.20 1.54 0.00 0.00 -0.00 0.00 0.00 57.72 59.06 1mm5 n HIS 169 Cb 0.74 3.76 0.00 0.00 -0.00 0.00 0.00 29.99 34.49 1mm5 n HIS 169 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92