#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 -1.01 0.02 7.83 3.02 -1.26 -4.81 115.26 119.04 1mm5 n ASN 2 Ca 0.00 -0.94 -0.08 0.00 -0.03 0.00 0.00 54.58 53.53 1mm5 n ASN 2 Cb 0.00 -0.46 -0.06 0.00 -0.61 0.00 0.00 39.78 38.65 1mm5 n ASN 2 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1mm5 h ALA 3 N -2.20 -0.16 0.00 5.41 0.00 -2.05 -2.60 119.26 117.65 1mm5 h ALA 3 Ca -0.19 -0.19 -0.15 0.00 0.00 0.00 0.00 54.91 54.38 1mm5 h ALA 3 Cb 0.57 0.06 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1mm5 h ALA 3 CO 0.13 -0.19 -0.72 -0.44 0.00 0.00 0.00 179.25 178.03 1mm5 h ASP 4 N -0.97 0.00 0.28 0.00 3.45 -1.99 -2.83 116.42 114.36 1mm5 h ASP 4 Ca -0.02 0.00 -0.11 0.00 0.43 0.00 0.00 57.03 57.34 1mm5 h ASP 4 Cb 0.44 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 39.19 1mm5 h ASP 4 CO 0.03 0.72 -0.43 -0.08 -1.57 0.00 0.00 179.24 177.91 1mm5 h GLU 5 N 0.00 0.19 0.09 3.56 4.81 -1.95 -2.41 114.58 118.87 1mm5 h GLU 5 Ca -0.01 -0.09 -0.25 0.00 -0.13 0.00 0.00 59.36 58.88 1mm5 h GLU 5 Cb 1.36 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.74 1mm5 h GLU 5 CO 0.09 0.59 -1.14 2.35 -0.73 0.00 0.00 179.01 180.17 1mm5 h TRP 6 N 0.16 0.45 -0.09 0.92 7.01 -1.42 -3.12 115.95 119.86 1mm5 h TRP 6 Ca 0.01 -0.31 -0.09 0.00 2.11 0.00 0.00 58.89 60.61 1mm5 h TRP 6 Cb 0.82 -0.03 -0.01 0.00 -2.10 0.00 0.00 29.16 27.84 1mm5 h TRP 6 CO 0.01 1.21 -0.37 1.98 -2.79 0.00 0.00 178.44 178.48 1mm5 h MET 7 N 0.10 0.19 0.43 2.65 4.05 -1.37 -1.11 114.93 119.86 1mm5 h MET 7 Ca -0.11 -0.08 -0.02 0.00 -0.28 0.00 0.00 59.70 59.21 1mm5 h MET 7 Cb 1.84 -0.01 0.00 0.00 -0.80 0.00 0.00 31.60 32.64 1mm5 h MET 7 CO 0.18 0.54 -0.21 1.79 0.23 0.00 0.00 176.91 179.44 1mm5 h THR 8 N 0.16 0.28 -0.24 -0.77 1.35 -1.47 0.20 112.91 112.42 1mm5 h THR 8 Ca 0.02 -0.60 -0.01 0.00 -0.55 0.00 0.00 66.41 65.27 1mm5 h THR 8 Cb 0.73 0.44 -0.01 0.00 -1.73 0.00 0.00 68.15 67.57 1mm5 h THR 8 CO 0.06 0.06 0.12 0.71 -0.25 0.00 0.00 175.52 176.21 1mm5 h THR 9 N -1.05 1.09 -0.03 6.82 1.35 -1.57 0.51 112.91 120.03 1mm5 h THR 9 Ca -0.06 -0.24 -0.14 0.00 -0.55 0.00 0.00 66.41 65.42 1mm5 h THR 9 Cb 0.54 0.78 0.01 0.00 -1.73 0.00 0.00 68.15 67.75 1mm5 h THR 9 CO 0.10 0.10 -0.54 0.15 -0.25 0.00 0.00 175.52 175.07 1mm5 h PHE 10 N 0.33 0.60 -0.08 4.73 3.57 -1.21 -2.91 116.94 121.96 1mm5 h PHE 10 Ca 0.09 -0.31 -0.08 0.00 3.53 0.00 0.00 57.97 61.20 1mm5 h PHE 10 Cb 0.04 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1mm5 h PHE 10 CO 0.00 1.11 -0.30 0.00 -2.23 0.00 0.00 178.31 176.89 1mm5 h ARG 11 N -0.08 0.16 -0.17 1.11 3.08 -0.21 -1.33 114.38 116.94 1mm5 h ARG 11 Ca -0.06 -0.05 -0.12 0.00 0.07 0.00 0.00 59.98 59.81 1mm5 h ARG 11 Cb 1.24 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 31.27 1mm5 h ARG 11 CO 0.11 0.45 -0.42 0.93 -1.07 0.00 0.00 179.97 179.96 1mm5 h GLU 12 N 0.14 0.41 0.07 0.04 5.08 -0.94 -0.57 114.58 118.81 1mm5 h GLU 12 Ca 0.02 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.17 1mm5 h GLU 12 Cb 0.61 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.86 1mm5 h GLU 12 CO 0.04 0.76 -0.03 -0.97 -1.00 0.00 0.00 179.01 177.81 1mm5 h ASN 13 N 0.34 -0.08 -0.79 1.42 -1.24 -1.27 -2.64 115.58 111.33 1mm5 h ASN 13 Ca 0.03 -0.42 0.02 0.00 0.71 0.00 0.00 56.30 56.64 1mm5 h ASN 13 Cb 0.89 0.02 -0.04 0.00 0.73 0.00 0.00 38.32 39.92 1mm5 h ASN 13 CO 0.07 0.59 0.52 0.16 -1.29 0.00 0.00 177.43 177.49 1mm5 h ILE 14 N -0.96 1.16 -0.00 2.57 -0.00 -1.33 -0.01 117.51 118.93 1mm5 h ILE 14 Ca -0.01 -0.35 -0.11 0.00 -0.00 0.00 0.00 64.86 64.40 1mm5 h ILE 14 Cb 0.50 0.06 -0.02 0.00 -0.00 0.00 0.00 36.82 37.36 1mm5 h ILE 14 CO 0.02 0.18 -0.51 0.00 -0.00 0.00 0.00 178.15 177.84 1mm5 h ALA 15 N 1.53 1.16 0.02 0.16 0.00 -1.21 -2.18 119.26 118.74 1mm5 h ALA 15 Ca 0.30 -0.46 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 1mm5 h ALA 15 Cb -0.02 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1mm5 h ALA 15 CO -0.08 0.63 -0.36 1.96 0.00 0.00 0.00 179.25 181.41 1mm5 h GLN 16 N 0.01 0.20 -0.18 0.00 4.20 -0.89 -2.39 115.11 116.06 1mm5 h GLN 16 Ca -0.00 -0.25 0.00 0.00 0.06 0.00 0.00 58.65 58.46 1mm5 h GLN 16 Cb 0.90 0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.75 1mm5 h GLN 16 CO 0.07 1.01 0.12 0.00 -0.67 0.00 0.00 178.83 179.36 1mm5 h THR 17 N -0.50 1.06 -0.01 -0.54 1.03 -1.05 0.14 112.91 113.03 1mm5 h THR 17 Ca -0.05 -0.13 -0.00 0.00 -0.01 0.00 0.00 66.41 66.22 1mm5 h THR 17 Cb 1.16 0.82 -0.00 0.00 -1.07 0.00 0.00 68.15 69.06 1mm5 h THR 17 CO 0.07 0.06 0.01 -0.50 -0.01 0.00 0.00 175.52 175.14 1mm5 h TRP 18 N 0.23 0.02 0.36 0.00 -0.00 -1.51 -2.79 115.95 112.26 1mm5 h TRP 18 Ca 0.07 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.89 58.94 1mm5 h TRP 18 Cb -0.01 -0.01 0.00 0.00 -0.00 0.00 0.00 29.16 29.15 1mm5 h TRP 18 CO -0.06 0.15 -0.18 0.37 -0.00 0.00 0.00 178.44 178.73 1mm5 h GLN 19 N -0.12 -0.47 -4.27 0.49 5.75 -1.32 -3.41 115.11 111.76 1mm5 h GLN 19 Ca 0.00 0.03 -0.63 0.00 -0.15 0.00 0.00 58.65 57.91 1mm5 h GLN 19 Cb 0.14 0.11 -0.40 0.00 1.07 0.00 0.00 27.48 28.40 1mm5 h GLN 19 CO -0.00 -0.31 -0.74 1.14 -2.65 0.00 0.00 178.83 176.26 1mm5 s GLN 20 N -4.00 1.27 0.42 1.69 -2.07 0.46 -4.98 119.66 112.45 1mm5 s GLN 20 Ca -0.07 -1.47 0.19 0.00 -1.82 0.00 0.00 55.36 52.19 1mm5 s GLN 20 Cb 0.01 -2.71 0.93 0.00 -1.09 0.00 0.00 33.01 30.15 1mm5 s GLN 20 CO 0.21 -0.89 1.88 -1.00 -1.32 0.00 0.00 175.29 174.17 1mm5 h PRO 21 N 7.82 0.00 -6.99 9.60 0.13 -1.65 -3.38 132.00 137.53 1mm5 h PRO 21 Ca -0.10 0.00 -0.46 0.00 -0.87 0.00 0.00 66.00 64.57 1mm5 h PRO 21 Cb 1.03 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.15 1mm5 h PRO 21 CO 0.49 0.29 0.37 -1.83 -0.23 0.00 0.00 178.00 177.08 1mm5 s GLU 22 N -4.04 4.24 0.49 0.86 4.04 -1.26 -4.76 118.70 118.27 1mm5 s GLU 22 Ca -0.02 1.30 0.02 0.00 0.04 0.00 0.00 54.97 56.32 1mm5 s GLU 22 Cb 0.13 -2.41 -0.02 0.00 0.02 0.00 0.00 34.13 31.84 1mm5 s GLU 22 CO 0.67 -0.04 0.01 -1.01 -1.84 0.00 0.00 175.26 173.06 1mm5 s HIS 23 N -1.88 1.95 -0.23 4.83 3.76 -1.25 -4.97 115.29 117.51 1mm5 s HIS 23 Ca 0.59 -0.94 -0.02 0.00 -0.15 0.00 0.00 55.06 54.54 1mm5 s HIS 23 Cb -0.16 -1.60 0.01 0.00 1.11 0.00 0.00 32.58 31.95 1mm5 s HIS 23 CO 0.20 0.22 -0.08 0.71 -0.85 0.00 0.00 174.74 174.93 1mm5 s TYR 24 N -2.89 2.97 -0.07 1.40 1.51 -1.06 -4.06 117.35 115.16 1mm5 s TYR 24 Ca 0.11 -1.39 0.02 0.00 -1.01 0.00 0.00 57.07 54.80 1mm5 s TYR 24 Cb 0.03 -2.04 -0.03 0.00 -0.11 0.00 0.00 41.96 39.81 1mm5 s TYR 24 CO 0.06 -0.69 -0.09 -0.51 -1.11 0.00 0.00 175.55 173.20 1mm5 s ASP 25 N 1.36 4.44 -0.10 2.29 -0.00 -1.07 -0.97 116.67 122.62 1mm5 s ASP 25 Ca 0.03 -0.09 -0.05 0.00 -0.00 0.00 0.00 52.55 52.44 1mm5 s ASP 25 Cb -0.15 -1.09 -0.04 0.00 -0.00 0.00 0.00 42.92 41.64 1mm5 s ASP 25 CO -0.06 0.35 0.11 -0.76 -0.00 0.00 0.00 175.17 174.81 1mm5 s LEU 26 N -0.72 4.18 -0.19 1.23 1.02 -0.78 -2.05 118.68 121.36 1mm5 s LEU 26 Ca 0.11 0.38 0.01 0.00 0.02 0.00 0.00 54.13 54.65 1mm5 s LEU 26 Cb -0.11 -2.05 0.04 0.00 0.02 0.00 0.00 46.19 44.09 1mm5 s LEU 26 CO 0.01 0.39 -0.13 -0.31 0.02 0.00 0.00 176.35 176.34 1mm5 s TYR 27 N -1.02 2.51 -0.03 0.29 1.51 0.41 -2.57 117.35 118.46 1mm5 s TYR 27 Ca 0.16 -1.61 -0.02 0.00 -1.01 0.00 0.00 57.07 54.59 1mm5 s TYR 27 Cb -0.12 -1.70 0.02 0.00 -0.11 0.00 0.00 41.96 40.05 1mm5 s TYR 27 CO 0.05 -0.75 0.07 0.42 -1.11 0.00 0.00 175.55 174.22 1mm5 s ILE 28 N 1.37 -0.02 0.73 2.71 -1.09 -1.07 -2.28 121.20 121.55 1mm5 s ILE 28 Ca 0.00 0.08 -0.11 0.00 -2.23 0.00 0.00 60.65 58.39 1mm5 s ILE 28 Cb -0.15 -0.12 0.03 0.00 -1.58 0.00 0.00 42.46 40.64 1mm5 s ILE 28 CO -0.09 0.03 1.08 -2.16 -1.23 0.00 0.00 174.94 172.57 1mm5 s PRO 29 N 0.48 2.57 0.03 2.79 0.04 -1.26 -0.52 135.00 139.13 1mm5 s PRO 29 Ca -0.04 1.12 0.00 0.00 0.04 0.00 0.00 61.00 62.12 1mm5 s PRO 29 Cb -0.05 -1.94 0.00 0.00 0.04 0.00 0.00 34.50 32.55 1mm5 s PRO 29 CO -0.02 -1.40 0.00 0.00 0.04 0.00 0.00 177.00 175.63 1mm5 n ALA 30 N -3.23 1.40 -2.47 8.56 0.00 -1.25 -4.82 120.51 118.70 1mm5 n ALA 30 Ca 0.09 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.45 1mm5 n ALA 30 Cb 0.53 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.88 1mm5 n ALA 30 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1mm5 s ILE 31 N -2.00 0.17 -0.16 0.00 -0.00 -1.23 -5.12 121.20 112.86 1mm5 s ILE 31 Ca 0.00 -1.40 -0.20 0.00 -0.00 0.00 0.00 60.65 59.06 1mm5 s ILE 31 Cb 0.00 -1.06 0.05 0.00 -0.00 0.00 0.00 42.46 41.45 1mm5 s ILE 31 CO 0.00 -0.77 0.52 0.28 -0.00 0.00 0.00 174.94 174.97 1mm5 s THR 32 N -3.01 0.01 -0.06 8.37 -1.32 -1.26 -2.45 115.64 115.93 1mm5 s THR 32 Ca -0.02 -0.06 -0.17 0.00 -1.21 0.00 0.00 61.69 60.23 1mm5 s THR 32 Cb 0.01 -0.76 -0.05 0.00 -1.51 0.00 0.00 72.50 70.20 1mm5 s THR 32 CO -0.07 -0.03 0.47 0.26 -2.21 0.00 0.00 174.62 173.04 1mm5 s TRP 33 N -0.11 3.62 0.10 9.09 0.51 -0.76 -5.00 118.94 126.39 1mm5 s TRP 33 Ca -0.03 0.97 0.06 0.00 -2.12 0.00 0.00 56.10 54.98 1mm5 s TRP 33 Cb -0.03 -2.46 -0.04 0.00 -0.81 0.00 0.00 33.47 30.13 1mm5 s TRP 33 CO 0.02 0.38 -0.04 -3.38 -0.51 0.00 0.00 176.95 173.42 1mm5 s HIS 34 N -0.15 2.89 0.12 -1.98 -3.43 -1.26 -4.02 115.29 107.45 1mm5 s HIS 34 Ca 0.25 -0.08 0.00 0.00 -0.80 0.00 0.00 55.06 54.44 1mm5 s HIS 34 Cb -0.16 -1.49 0.00 0.00 -1.43 0.00 0.00 32.58 29.49 1mm5 s HIS 34 CO 0.12 0.46 0.00 0.00 -2.00 0.00 0.00 174.74 173.32 1mm5 n ALA 35 N 0.61 -1.32 -0.00 -1.38 0.00 -1.26 -4.86 120.51 112.30 1mm5 n ALA 35 Ca -0.12 0.16 -0.01 0.00 0.00 0.00 0.00 53.44 53.48 1mm5 n ALA 35 Cb 0.52 -0.46 -0.00 0.00 0.00 0.00 0.00 19.45 19.51 1mm5 n ALA 35 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1mm5 n ARG 36 N -2.71 0.04 -3.00 0.00 1.74 -1.26 -4.69 116.66 106.78 1mm5 n ARG 36 Ca 0.00 0.01 -0.17 0.00 -0.77 0.00 0.00 57.85 56.93 1mm5 n ARG 36 Cb 0.23 -0.38 -0.02 0.00 -1.02 0.00 0.00 32.46 31.27 1mm5 n ARG 36 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1mm5 n PHE 37 N -2.68 -1.81 -2.34 -1.55 7.35 -1.26 -5.14 117.46 110.02 1mm5 n PHE 37 Ca -0.01 -2.69 -0.25 0.00 -0.76 0.00 0.00 57.45 53.75 1mm5 n PHE 37 Cb 0.03 0.57 0.08 0.00 0.35 0.00 0.00 39.48 40.52 1mm5 n PHE 37 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1mm5 s ALA 38 N -0.21 3.34 -1.16 3.13 0.00 -1.26 -4.97 121.76 120.62 1mm5 s ALA 38 Ca 0.33 -1.19 -0.21 0.00 0.00 0.00 0.00 51.96 50.89 1mm5 s ALA 38 Cb 0.17 -2.39 0.03 0.00 0.00 0.00 0.00 23.12 20.93 1mm5 s ALA 38 CO -0.17 -1.32 1.70 0.71 0.00 0.00 0.00 175.76 176.68 1mm5 s TYR 39 N -3.18 2.49 -0.12 0.00 2.02 -1.26 -4.96 117.35 112.34 1mm5 s TYR 39 Ca 0.62 -0.87 -0.29 0.00 -0.37 0.00 0.00 57.07 56.17 1mm5 s TYR 39 Cb -0.09 -4.56 -0.01 0.00 -0.40 0.00 0.00 41.96 36.90 1mm5 s TYR 39 CO 0.44 -1.75 0.98 0.34 -1.57 0.00 0.00 175.55 173.98 1mm5 s ASP 40 N 5.15 7.20 0.09 2.29 2.15 -1.26 -4.88 116.67 127.41 1mm5 s ASP 40 Ca 0.55 1.47 0.00 0.00 0.43 0.00 0.00 52.55 55.00 1mm5 s ASP 40 Cb 0.01 -2.54 0.00 0.00 -0.30 0.00 0.00 42.92 40.09 1mm5 s ASP 40 CO 0.02 -0.44 0.00 0.29 -0.17 0.00 0.00 175.17 174.87 1mm5 n LYS 41 N 5.05 0.00 0.00 4.34 5.02 -1.26 -5.06 118.16 126.25 1mm5 n LYS 41 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 1mm5 n LYS 41 Cb 0.49 -0.33 0.00 0.00 -0.02 0.00 0.00 35.03 35.17 1mm5 n LYS 41 CO 0.00 0.00 0.00 -1.91 -0.52 0.00 0.00 177.40 174.97 1mm5 n GLU 42 N -3.19 0.00 -3.11 1.97 0.00 -1.26 -5.01 120.64 110.04 1mm5 n GLU 42 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 57.16 56.81 1mm5 n GLU 42 Cb 0.15 0.00 -0.03 0.00 0.00 0.00 0.00 31.44 31.56 1mm5 n GLU 42 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1mm5 n LYS 43 N -1.56 3.72 -1.52 5.31 5.02 -1.26 -4.67 118.16 123.20 1mm5 n LYS 43 Ca 0.00 -4.66 0.04 0.00 -2.02 0.00 0.00 58.31 51.67 1mm5 n LYS 43 Cb 0.00 -2.38 0.04 0.00 -0.02 0.00 0.00 35.03 32.67 1mm5 n LYS 43 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1mm5 n THR 44 N 0.78 0.33 -3.61 -0.18 -2.24 -1.26 -5.09 114.28 103.00 1mm5 n THR 44 Ca 0.31 -1.39 -0.02 0.00 -2.27 0.00 0.00 64.05 60.68 1mm5 n THR 44 Cb 0.36 0.88 -0.02 0.00 -2.10 0.00 0.00 70.33 69.46 1mm5 n THR 44 CO 0.00 0.00 0.00 1.51 -0.57 0.00 0.00 175.07 176.01 1mm5 s ASP 45 N -2.27 -0.07 0.55 3.42 -4.77 -1.26 -5.03 116.67 107.24 1mm5 s ASP 45 Ca 0.34 -0.02 0.04 0.00 -3.30 0.00 0.00 52.55 49.61 1mm5 s ASP 45 Cb 0.38 0.08 0.04 0.00 -1.09 0.00 0.00 42.92 42.33 1mm5 s ASP 45 CO -0.15 -0.14 0.30 0.54 0.70 0.00 0.00 175.17 176.43 1mm5 n ARG 46 N -0.13 0.69 -1.94 2.11 3.00 -1.26 -5.07 116.66 114.05 1mm5 n ARG 46 Ca 0.01 -3.56 -0.02 0.00 -0.01 0.00 0.00 57.85 54.26 1mm5 n ARG 46 Cb 0.58 0.54 0.06 0.00 0.00 0.00 0.00 32.46 33.65 1mm5 n ARG 46 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.63 180.11 1mm5 n TYR 47 N -1.67 0.96 -3.19 -1.55 4.11 -1.26 -5.09 117.16 109.48 1mm5 n TYR 47 Ca -0.07 -1.56 -0.25 0.00 -0.00 0.00 0.00 57.90 56.02 1mm5 n TYR 47 Cb 0.64 -0.23 -0.01 0.00 -0.00 0.00 0.00 39.34 39.74 1mm5 n TYR 47 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.86 178.07 1mm5 s ASN 48 N -3.14 6.29 -0.22 9.48 3.84 -1.26 -5.09 114.94 124.84 1mm5 s ASN 48 Ca 0.35 0.58 -0.01 0.00 0.21 0.00 0.00 52.86 53.99 1mm5 s ASN 48 Cb 0.37 -2.09 0.06 0.00 -0.55 0.00 0.00 41.25 39.04 1mm5 s ASN 48 CO -0.07 -0.37 0.00 -1.61 -2.79 0.00 0.00 177.10 172.27 1mm5 s GLU 49 N -4.41 1.08 0.19 0.43 8.01 -1.26 -5.13 118.70 117.61 1mm5 s GLU 49 Ca 0.42 -0.71 0.06 0.00 0.01 0.00 0.00 54.97 54.74 1mm5 s GLU 49 Cb -0.10 -2.32 -0.04 0.00 -4.31 0.00 0.00 34.13 27.36 1mm5 s GLU 49 CO 0.38 -0.64 0.15 1.03 0.01 0.00 0.00 175.26 176.19 1mm5 s ARG 50 N 1.64 2.91 -0.24 1.61 1.81 -1.26 -5.06 118.95 120.35 1mm5 s ARG 50 Ca -0.02 -0.92 -0.29 0.00 -1.72 0.00 0.00 55.73 52.77 1mm5 s ARG 50 Cb -0.18 -2.62 -0.02 0.00 -0.45 0.00 0.00 34.95 31.68 1mm5 s ARG 50 CO -0.08 0.46 1.66 -1.25 -0.68 0.00 0.00 175.30 175.41 1mm5 s PRO 51 N -3.32 3.70 -0.18 3.54 0.04 -1.26 -4.86 135.00 132.66 1mm5 s PRO 51 Ca 0.31 1.61 0.15 0.00 0.04 0.00 0.00 61.00 63.12 1mm5 s PRO 51 Cb -0.09 -4.07 -0.24 0.00 0.04 0.00 0.00 34.50 30.13 1mm5 s PRO 51 CO 0.24 -1.42 0.16 0.91 0.04 0.00 0.00 177.00 176.93 1mm5 n TRP 52 N 8.84 0.21 0.00 0.56 8.01 -1.26 -4.87 117.44 128.93 1mm5 n TRP 52 Ca 0.20 0.07 0.00 0.00 -1.31 0.00 0.00 57.50 56.46 1mm5 n TRP 52 Cb 0.46 -1.04 0.00 0.00 -2.01 0.00 0.00 31.31 28.72 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 1.77 2.97 0.00 6.99 0.00 -1.26 -4.85 105.19 110.81 1mm5 n GLY 53 Ca -0.31 -1.74 0.00 0.00 0.00 0.00 0.00 46.02 43.97 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 0.07 0.93 0.00 -0.02 0.00 -1.06 -4.68 105.19 100.44 1mm5 n GLY 54 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 46.02 45.23 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 0.00 -0.43 3.58 -0.02 0.00 -0.97 -1.39 105.19 105.96 1mm5 n GLY 55 Ca 0.00 -0.65 -0.27 0.00 0.00 0.00 0.00 46.02 45.10 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 2.01 0.12 1.61 -0.12 -0.72 -0.44 117.98 116.44 1mm5 s PHE 56 Ca 0.00 -0.98 -0.24 0.00 -0.05 0.00 0.00 56.93 55.66 1mm5 s PHE 56 Cb 0.00 -1.44 0.08 0.00 -0.63 0.00 0.00 43.02 41.03 1mm5 s PHE 56 CO 0.00 0.08 0.69 0.20 -0.05 0.00 0.00 175.22 176.13 1mm5 s GLY 57 N -3.66 -0.56 0.28 1.99 0.00 -0.87 -1.14 107.32 103.37 1mm5 s GLY 57 Ca 0.26 0.59 0.10 0.00 0.00 0.00 0.00 44.72 45.67 1mm5 s GLY 57 CO 0.13 0.20 -0.02 0.48 0.00 0.00 0.00 173.10 173.88 1mm5 s LEU 58 N -2.69 3.10 0.19 0.66 2.34 -0.94 -2.58 118.68 118.76 1mm5 s LEU 58 Ca 0.03 -0.73 -0.22 0.00 0.06 0.00 0.00 54.13 53.27 1mm5 s LEU 58 Cb -0.01 -1.60 0.05 0.00 -0.56 0.00 0.00 46.19 44.07 1mm5 s LEU 58 CO -0.11 -0.02 0.62 -0.94 -1.06 0.00 0.00 176.35 174.84 1mm5 s SER 59 N -3.66 -0.45 0.04 1.48 1.04 -1.26 -1.20 113.70 109.70 1mm5 s SER 59 Ca 0.32 -0.21 0.01 0.00 0.48 0.00 0.00 55.95 56.55 1mm5 s SER 59 Cb -0.06 0.63 -0.03 0.00 0.10 0.00 0.00 66.02 66.67 1mm5 s SER 59 CO 0.19 -1.08 -0.06 -0.13 0.98 0.00 0.00 173.24 173.14 1mm5 s ARG 60 N -3.81 0.51 -0.32 4.02 0.52 0.44 -3.75 118.95 116.56 1mm5 s ARG 60 Ca 0.04 -0.81 -0.12 0.00 -0.52 0.00 0.00 55.73 54.32 1mm5 s ARG 60 Cb -0.02 -0.14 -0.03 0.00 0.52 0.00 0.00 34.95 35.28 1mm5 s ARG 60 CO -0.07 0.00 0.22 -1.58 0.02 0.00 0.00 175.30 173.90 1mm5 s TRP 61 N -1.83 3.23 0.26 -0.53 0.51 -1.26 -2.60 118.94 116.72 1mm5 s TRP 61 Ca -0.08 -0.10 -0.30 0.00 -2.12 0.00 0.00 56.10 53.51 1mm5 s TRP 61 Cb -0.07 -2.45 -0.09 0.00 -0.81 0.00 0.00 33.47 30.05 1mm5 s TRP 61 CO -0.01 -0.29 1.02 0.34 -0.51 0.00 0.00 176.95 177.49 1mm5 s ASP 62 N 1.74 7.45 0.63 2.95 3.68 0.23 -4.91 116.67 128.44 1mm5 s ASP 62 Ca 0.06 2.11 0.29 0.00 2.13 0.00 0.00 52.55 57.14 1mm5 s ASP 62 Cb -0.17 -2.62 1.53 0.00 -1.45 0.00 0.00 42.92 40.22 1mm5 s ASP 62 CO 0.11 0.00 1.90 -0.33 0.13 0.00 0.00 175.17 176.98 1mm5 h GLU 63 N 3.96 0.00 -1.01 4.34 5.08 -1.98 0.14 114.58 125.11 1mm5 h GLU 63 Ca -0.46 0.00 -0.28 0.00 -1.00 0.00 0.00 59.36 57.62 1mm5 h GLU 63 Cb 1.21 0.00 -0.17 0.00 0.50 0.00 0.00 28.75 30.29 1mm5 h GLU 63 CO 0.67 0.00 0.36 1.63 -1.00 0.00 0.00 179.01 180.67 1mm5 n LYS 64 N -3.24 1.68 -3.57 2.33 4.76 -1.26 -4.86 118.16 113.99 1mm5 n LYS 64 Ca 0.02 -1.62 -0.20 0.00 -2.87 0.00 0.00 58.31 53.65 1mm5 n LYS 64 Cb 0.51 -1.63 0.06 0.00 -1.84 0.00 0.00 35.03 32.12 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 -0.37 -0.35 3.39 0.72 0.00 0.46 -5.01 105.19 104.04 1mm5 n GLY 65 Ca 0.32 0.12 -0.26 0.00 0.00 0.00 0.00 46.02 46.20 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 -4.26 3.20 -0.24 1.61 0.02 -1.10 -4.42 114.94 109.76 1mm5 s ASN 66 Ca 0.06 -0.83 0.02 0.00 -1.02 0.00 0.00 52.86 51.09 1mm5 s ASN 66 Cb -0.03 -0.22 0.06 0.00 0.02 0.00 0.00 41.25 41.08 1mm5 s ASN 66 CO 0.77 0.10 -0.08 0.86 0.02 0.00 0.00 177.10 178.77 1mm5 s TRP 67 N -1.56 2.70 -0.02 2.20 -0.11 -1.01 -0.60 118.94 120.55 1mm5 s TRP 67 Ca 0.17 -1.94 0.02 0.00 1.22 0.00 0.00 56.10 55.58 1mm5 s TRP 67 Cb -0.08 -1.71 0.00 0.00 -1.50 0.00 0.00 33.47 30.18 1mm5 s TRP 67 CO 0.08 -0.81 -0.07 -3.38 -4.62 0.00 0.00 176.95 168.15 1mm5 s HIS 68 N 1.29 0.72 -0.07 5.86 -3.43 -1.07 -1.59 115.29 117.00 1mm5 s HIS 68 Ca -0.06 -0.16 -0.31 0.00 -0.80 0.00 0.00 55.06 53.73 1mm5 s HIS 68 Cb -0.19 -0.51 0.12 0.00 -1.43 0.00 0.00 32.58 30.57 1mm5 s HIS 68 CO -0.06 -0.06 0.99 0.20 -2.00 0.00 0.00 174.74 173.81 1mm5 s GLY 69 N 0.10 -0.40 0.43 -1.38 0.00 -1.08 -0.42 107.32 104.57 1mm5 s GLY 69 Ca -0.01 1.27 -0.04 0.00 0.00 0.00 0.00 44.72 45.94 1mm5 s GLY 69 CO -0.00 0.45 0.70 -2.27 0.00 0.00 0.00 173.10 171.98 1mm5 s LEU 70 N -2.28 3.78 -0.15 0.66 2.96 -0.34 -0.40 118.68 122.91 1mm5 s LEU 70 Ca 0.06 0.78 0.00 0.00 -0.22 0.00 0.00 54.13 54.75 1mm5 s LEU 70 Cb -0.01 -3.70 0.03 0.00 0.50 0.00 0.00 46.19 43.01 1mm5 s LEU 70 CO -0.07 -0.46 -0.11 -0.31 -1.32 0.00 0.00 176.35 174.08 1mm5 s TYR 71 N -2.56 1.98 -0.34 5.38 2.02 0.55 -2.21 117.35 122.16 1mm5 s TYR 71 Ca 0.45 -1.13 -0.07 0.00 -0.37 0.00 0.00 57.07 55.95 1mm5 s TYR 71 Cb -0.10 -1.48 0.04 0.00 -0.40 0.00 0.00 41.96 40.02 1mm5 s TYR 71 CO 0.41 -0.63 0.12 0.00 -1.57 0.00 0.00 175.55 173.87 1mm5 s ALA 72 N 1.55 3.08 0.03 3.71 0.00 -0.29 -2.67 121.76 127.17 1mm5 s ALA 72 Ca 0.04 -1.74 0.00 0.00 0.00 0.00 0.00 51.96 50.26 1mm5 s ALA 72 Cb -0.13 -2.32 -0.02 0.00 0.00 0.00 0.00 23.12 20.64 1mm5 s ALA 72 CO -0.09 -1.35 -0.04 0.00 0.00 0.00 0.00 175.76 174.28 1mm5 s MET 73 N 1.42 0.40 0.05 0.00 0.23 -1.08 -1.76 119.30 118.57 1mm5 s MET 73 Ca -0.01 -0.73 0.08 0.00 -1.03 0.00 0.00 55.69 54.00 1mm5 s MET 73 Cb -0.19 0.02 -0.03 0.00 -1.53 0.00 0.00 34.83 33.10 1mm5 s MET 73 CO 0.03 -0.03 -0.23 0.00 -2.03 0.00 0.00 175.02 172.76 1mm5 s ALA 74 N -1.76 1.97 -0.34 3.16 0.00 -0.49 -1.96 121.76 122.35 1mm5 s ALA 74 Ca -0.11 -1.15 -0.11 0.00 0.00 0.00 0.00 51.96 50.59 1mm5 s ALA 74 Cb -0.08 -0.40 0.01 0.00 0.00 0.00 0.00 23.12 22.65 1mm5 s ALA 74 CO -0.02 0.45 0.19 -0.06 0.00 0.00 0.00 175.76 176.32 1mm5 s PHE 75 N -0.81 3.21 -0.17 0.00 0.40 -1.07 -2.55 117.98 116.99 1mm5 s PHE 75 Ca 0.09 -0.72 -0.26 0.00 -0.60 0.00 0.00 56.93 55.44 1mm5 s PHE 75 Cb -0.09 -2.41 -0.01 0.00 0.51 0.00 0.00 43.02 41.02 1mm5 s PHE 75 CO 0.02 -0.54 0.89 0.21 0.70 0.00 0.00 175.22 176.50 1mm5 s LYS 76 N 1.60 4.31 0.12 0.44 2.36 -1.26 -2.60 119.74 124.71 1mm5 s LYS 76 Ca 0.04 1.12 0.01 0.00 -2.55 0.00 0.00 55.97 54.58 1mm5 s LYS 76 Cb -0.18 -3.58 -0.04 0.00 -1.05 0.00 0.00 37.83 32.98 1mm5 s LYS 76 CO 0.07 -0.37 0.27 -0.51 1.55 0.00 0.00 175.35 176.36 1mm5 s ASP 77 N 1.16 6.36 0.59 1.43 1.01 -1.26 -4.88 116.67 121.08 1mm5 s ASP 77 Ca 0.40 0.25 0.30 0.00 0.71 0.00 0.00 52.55 54.21 1mm5 s ASP 77 Cb -0.17 -1.95 1.78 0.00 1.01 0.00 0.00 42.92 43.60 1mm5 s ASP 77 CO 0.12 0.08 2.21 -1.28 0.21 0.00 0.00 175.17 176.51 1mm5 h SER 78 N 2.49 0.00 0.00 0.27 0.87 -1.96 -3.36 113.55 111.86 1mm5 h SER 78 Ca -0.47 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1mm5 h SER 78 Cb 1.18 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 1mm5 h SER 78 CO 0.71 0.00 -0.03 1.87 -0.53 0.00 0.00 176.83 178.85 1mm5 n TRP 79 N -3.81 0.00 0.00 2.24 -0.00 -1.26 -5.11 117.44 109.49 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 0.16 0.11 0.00 0.00 -0.00 0.00 0.00 31.31 31.59 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 -1.77 -0.91 -4.28 5.87 2.85 -1.26 -5.05 115.26 110.71 1mm5 n ASN 80 Ca 0.00 0.00 -0.22 0.00 -0.11 0.00 0.00 54.58 54.25 1mm5 n ASN 80 Cb 0.02 0.00 -0.01 0.00 1.24 0.00 0.00 39.78 41.03 1mm5 n ASN 80 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1mm5 n LYS 81 N -0.91 0.85 -2.46 1.20 4.76 -1.26 -4.47 118.16 115.87 1mm5 n LYS 81 Ca 0.00 -2.81 -0.40 0.00 -2.87 0.00 0.00 58.31 52.23 1mm5 n LYS 81 Cb 0.00 0.36 -0.04 0.00 -1.84 0.00 0.00 35.03 33.50 1mm5 n LYS 81 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1mm5 s TRP 82 N -2.24 3.56 -0.47 2.13 0.51 -1.26 -4.11 118.94 117.05 1mm5 s TRP 82 Ca 0.22 1.66 -0.06 0.00 -2.12 0.00 0.00 56.10 55.80 1mm5 s TRP 82 Cb -0.02 -3.31 0.12 0.00 -0.81 0.00 0.00 33.47 29.46 1mm5 s TRP 82 CO 0.14 -0.64 0.31 -1.21 -0.51 0.00 0.00 176.95 175.04 1mm5 s GLU 83 N -1.21 2.33 0.45 4.98 2.02 -1.07 -4.84 118.70 121.35 1mm5 s GLU 83 Ca 0.46 -1.88 -0.23 0.00 0.02 0.00 0.00 54.97 53.34 1mm5 s GLU 83 Cb -0.32 -3.79 -0.08 0.00 0.10 0.00 0.00 34.13 30.04 1mm5 s GLU 83 CO 0.40 -1.15 1.14 -1.25 0.02 0.00 0.00 175.26 174.43 1mm5 s PRO 84 N 1.11 3.84 -0.15 0.39 0.04 -1.25 -2.60 135.00 136.39 1mm5 s PRO 84 Ca 0.08 1.73 -0.11 0.00 0.04 0.00 0.00 61.00 62.74 1mm5 s PRO 84 Cb -0.24 -2.44 0.04 0.00 0.04 0.00 0.00 34.50 31.91 1mm5 s PRO 84 CO -0.03 -0.47 0.37 -1.50 0.04 0.00 0.00 177.00 175.42 1mm5 s ILE 85 N -1.56 -0.01 -0.13 0.56 2.07 -0.83 -2.61 121.20 118.69 1mm5 s ILE 85 Ca 0.62 0.04 -0.01 0.00 -1.41 0.00 0.00 60.65 59.89 1mm5 s ILE 85 Cb -0.27 -0.54 0.03 0.00 0.13 0.00 0.00 42.46 41.81 1mm5 s ILE 85 CO 0.33 0.02 -0.05 0.00 -1.91 0.00 0.00 174.94 173.33 1mm5 s ALA 86 N 0.62 1.23 -0.01 1.50 0.00 -1.07 -2.64 121.76 121.39 1mm5 s ALA 86 Ca -0.03 -0.56 0.00 0.00 0.00 0.00 0.00 51.96 51.37 1mm5 s ALA 86 Cb -0.05 -0.96 0.01 0.00 0.00 0.00 0.00 23.12 22.12 1mm5 s ALA 86 CO -0.04 -0.58 -0.01 0.20 0.00 0.00 0.00 175.76 175.33 1mm5 s GLY 87 N 1.75 0.13 -0.17 0.00 0.00 -1.09 -2.16 107.32 105.78 1mm5 s GLY 87 Ca 0.03 0.04 -0.21 0.00 0.00 0.00 0.00 44.72 44.59 1mm5 s GLY 87 CO -0.07 0.22 0.61 -0.19 0.00 0.00 0.00 173.10 173.66 1mm5 s TYR 88 N 0.39 3.42 0.03 1.90 2.02 0.18 -0.33 117.35 124.96 1mm5 s TYR 88 Ca -0.04 0.95 0.03 0.00 -0.37 0.00 0.00 57.07 57.65 1mm5 s TYR 88 Cb -0.06 -2.75 -0.04 0.00 -0.40 0.00 0.00 41.96 38.71 1mm5 s TYR 88 CO -0.01 -0.08 -0.03 0.20 -1.57 0.00 0.00 175.55 174.06 1mm5 s GLY 89 N 1.06 1.84 -0.24 0.71 0.00 0.47 -2.60 107.32 108.56 1mm5 s GLY 89 Ca 0.29 -1.04 0.02 0.00 0.00 0.00 0.00 44.72 43.99 1mm5 s GLY 89 CO 0.11 -0.95 -0.11 0.86 0.00 0.00 0.00 173.10 173.01 1mm5 s TRP 90 N -1.13 2.97 0.05 1.90 -0.00 -0.22 -2.62 118.94 119.90 1mm5 s TRP 90 Ca 0.21 -2.06 0.05 0.00 -0.00 0.00 0.00 56.10 54.29 1mm5 s TRP 90 Cb -0.11 -1.84 -0.02 0.00 -0.00 0.00 0.00 33.47 31.49 1mm5 s TRP 90 CO 0.12 -0.84 -0.13 -2.00 -0.00 0.00 0.00 176.95 174.10 1mm5 s GLU 91 N 1.21 0.84 -0.12 5.86 -6.30 -0.62 -1.68 118.70 117.88 1mm5 s GLU 91 Ca -0.06 -0.83 -0.14 0.00 -2.50 0.00 0.00 54.97 51.44 1mm5 s GLU 91 Cb -0.18 -0.83 -0.05 0.00 0.00 0.00 0.00 34.13 33.07 1mm5 s GLU 91 CO -0.07 0.19 0.32 0.45 0.02 0.00 0.00 175.26 176.18 1mm5 s SER 92 N -1.42 6.53 -0.09 -1.70 0.15 0.03 -2.41 113.70 114.80 1mm5 s SER 92 Ca -0.01 0.62 -0.18 0.00 0.70 0.00 0.00 55.95 57.08 1mm5 s SER 92 Cb -0.09 -2.20 -0.05 0.00 -1.71 0.00 0.00 66.02 61.98 1mm5 s SER 92 CO 0.02 0.16 0.49 -0.89 1.20 0.00 0.00 173.24 174.22 1mm5 s THR 93 N 0.06 5.12 -0.02 6.45 2.01 -1.26 -2.62 115.64 125.38 1mm5 s THR 93 Ca 0.19 1.00 -0.09 0.00 0.31 0.00 0.00 61.69 63.10 1mm5 s THR 93 Cb -0.14 -3.83 0.01 0.00 0.01 0.00 0.00 72.50 68.55 1mm5 s THR 93 CO 0.06 0.37 0.19 0.26 -0.69 0.00 0.00 174.62 174.81 1mm5 s TRP 94 N 0.32 -0.07 0.02 4.92 0.52 0.44 -4.98 118.94 120.10 1mm5 s TRP 94 Ca 0.27 0.12 0.07 0.00 0.02 0.00 0.00 56.10 56.58 1mm5 s TRP 94 Cb -0.16 0.01 -0.02 0.00 -1.15 0.00 0.00 33.47 32.15 1mm5 s TRP 94 CO 0.12 -0.27 -0.21 1.03 0.02 0.00 0.00 176.95 177.64 1mm5 s ARG 95 N -1.02 1.53 0.70 4.98 0.52 -1.26 -2.12 118.95 122.27 1mm5 s ARG 95 Ca -0.11 -0.89 -0.12 0.00 -0.52 0.00 0.00 55.73 54.09 1mm5 s ARG 95 Cb -0.06 -1.59 0.17 0.00 0.52 0.00 0.00 34.95 33.99 1mm5 s ARG 95 CO 0.02 0.42 0.75 -0.35 0.02 0.00 0.00 175.30 176.16 1mm5 n PRO 96 N 2.09 -1.65 -0.09 3.54 -0.04 -1.25 -5.02 135.00 132.57 1mm5 n PRO 96 Ca -0.16 -1.18 -0.09 0.00 -0.04 0.00 0.00 63.50 62.02 1mm5 n PRO 96 Cb 0.53 -0.95 -0.13 0.00 -0.04 0.00 0.00 33.50 32.91 1mm5 n PRO 96 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1mm5 n LEU 97 N 0.00 0.36 0.11 1.53 7.99 -1.26 -4.44 117.00 121.29 1mm5 n LEU 97 Ca 0.10 -0.01 -0.04 0.00 -0.01 0.00 0.00 56.01 56.05 1mm5 n LEU 97 Cb 0.37 0.28 0.07 0.00 -0.11 0.00 0.00 43.42 44.02 1mm5 n LEU 97 CO 0.26 0.47 0.37 0.00 -1.51 0.00 0.00 177.39 176.98 1mm5 h ALA 98 N 0.74 0.75 -3.27 -1.18 0.00 -2.03 -3.45 119.26 110.82 1mm5 h ALA 98 Ca -0.46 -0.68 -0.48 0.00 0.00 0.00 0.00 54.91 53.29 1mm5 h ALA 98 Cb 2.01 -0.11 -0.20 0.00 0.00 0.00 0.00 17.79 19.49 1mm5 h ALA 98 CO 0.01 0.92 -0.79 -0.51 0.00 0.00 0.00 179.25 178.89 1mm5 s ASP 99 N -6.81 2.20 -0.11 0.00 1.01 -1.26 -5.05 116.67 106.64 1mm5 s ASP 99 Ca -0.01 -0.73 0.09 0.00 0.71 0.00 0.00 52.55 52.61 1mm5 s ASP 99 Cb 0.12 -0.10 -0.13 0.00 1.01 0.00 0.00 42.92 43.82 1mm5 s ASP 99 CO 0.79 -0.05 0.02 1.21 0.21 0.00 0.00 175.17 177.35 1mm5 n GLU 100 N 0.85 2.00 0.09 8.23 0.00 -1.26 -3.97 120.64 126.59 1mm5 n GLU 100 Ca -0.18 0.00 -0.00 0.00 0.00 0.00 0.00 57.16 56.99 1mm5 n GLU 100 Cb 0.55 -1.28 -0.03 0.00 0.00 0.00 0.00 31.44 30.68 1mm5 n GLU 100 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.13 176.22 1mm5 h ASN 101 N 0.00 0.00 -1.93 4.31 2.35 -1.96 -3.46 115.58 114.89 1mm5 h ASN 101 Ca -0.30 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 54.85 1mm5 h ASN 101 Cb 1.65 0.00 0.01 0.00 0.05 0.00 0.00 38.32 40.03 1mm5 h ASN 101 CO 0.01 0.62 1.25 0.33 -1.65 0.00 0.00 177.43 177.99 1mm5 n PHE 102 N -3.15 2.18 -3.42 1.19 7.35 -1.26 -3.67 117.46 116.68 1mm5 n PHE 102 Ca -0.02 -0.05 -0.38 0.00 -0.76 0.00 0.00 57.45 56.24 1mm5 n PHE 102 Cb 0.81 -2.68 -0.06 0.00 0.35 0.00 0.00 39.48 37.89 1mm5 n PHE 102 CO 0.00 0.00 0.00 -1.01 -0.76 0.00 0.00 176.76 174.99 1mm5 s HIS 103 N 5.50 3.66 0.00 -5.13 3.76 -1.07 -4.39 115.29 117.62 1mm5 s HIS 103 Ca 0.96 0.97 -0.04 0.00 -0.15 0.00 0.00 55.06 56.81 1mm5 s HIS 103 Cb -0.60 -2.40 -0.00 0.00 1.11 0.00 0.00 32.58 30.68 1mm5 s HIS 103 CO 0.47 0.47 0.07 -0.51 -0.85 0.00 0.00 174.74 174.39 1mm5 s LEU 104 N -0.47 1.80 -0.17 0.89 1.43 -0.90 -2.01 118.68 119.25 1mm5 s LEU 104 Ca 0.25 -0.25 -0.35 0.00 -1.03 0.00 0.00 54.13 52.75 1mm5 s LEU 104 Cb -0.16 0.42 0.15 0.00 0.03 0.00 0.00 46.19 46.63 1mm5 s LEU 104 CO 0.13 -0.30 1.37 -0.83 0.23 0.00 0.00 176.35 176.95 1mm5 s GLY 105 N -1.20 -0.35 0.00 -3.19 0.00 -0.46 -0.42 107.32 101.70 1mm5 s GLY 105 Ca -0.13 1.36 -0.23 0.00 0.00 0.00 0.00 44.72 45.72 1mm5 s GLY 105 CO 0.00 0.38 0.51 0.48 0.00 0.00 0.00 173.10 174.48 1mm5 s LEU 106 N -2.53 -0.00 0.00 0.66 2.34 -1.08 -2.58 118.68 115.48 1mm5 s LEU 106 Ca 0.13 0.31 0.00 0.00 0.06 0.00 0.00 54.13 54.63 1mm5 s LEU 106 Cb 0.03 2.02 0.00 0.00 -0.56 0.00 0.00 46.19 47.69 1mm5 s LEU 106 CO -0.04 -0.62 0.00 0.61 -1.06 0.00 0.00 176.35 175.24 1mm5 n GLY 107 N 0.78 -0.89 3.71 -3.48 0.00 -1.07 -0.79 105.19 103.45 1mm5 n GLY 107 Ca -0.19 -0.92 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 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 -3.00 2.50 -0.19 1.61 0.40 -0.67 -2.38 117.98 116.26 1mm5 s PHE 108 Ca 0.00 -0.64 -0.04 0.00 -0.60 0.00 0.00 56.93 55.65 1mm5 s PHE 108 Cb 0.00 -1.88 0.09 0.00 0.51 0.00 0.00 43.02 41.74 1mm5 s PHE 108 CO 0.00 0.25 0.25 0.95 0.70 0.00 0.00 175.22 177.37 1mm5 s THR 109 N -2.66 -0.38 -0.13 0.64 -4.23 -1.02 -1.06 115.64 106.81 1mm5 s THR 109 Ca 0.37 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.87 1mm5 s THR 109 Cb 0.06 -0.63 -0.02 0.00 1.34 0.00 0.00 72.50 73.24 1mm5 s THR 109 CO 0.20 -0.11 -0.08 0.00 -0.54 0.00 0.00 174.62 174.09 1mm5 s ALA 110 N 2.38 2.86 0.25 3.99 0.00 -1.07 -2.54 121.76 127.62 1mm5 s ALA 110 Ca 0.06 -0.86 -0.06 0.00 0.00 0.00 0.00 51.96 51.10 1mm5 s ALA 110 Cb -0.15 -1.36 -0.02 0.00 0.00 0.00 0.00 23.12 21.60 1mm5 s ALA 110 CO -0.11 0.31 0.34 0.20 0.00 0.00 0.00 175.76 176.49 1mm5 s GLY 111 N 0.09 1.07 -0.07 0.00 0.00 -0.85 -0.65 107.32 106.92 1mm5 s GLY 111 Ca -0.03 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.38 1mm5 s GLY 111 CO 0.03 -1.00 -0.05 -1.34 0.00 0.00 0.00 173.10 170.75 1mm5 s VAL 112 N -3.92 0.68 -0.15 1.40 -7.23 -0.92 -0.46 120.40 109.80 1mm5 s VAL 112 Ca 0.30 -0.13 -0.06 0.00 -1.81 0.00 0.00 61.98 60.28 1mm5 s VAL 112 Cb 0.02 -0.73 -0.04 0.00 0.56 0.00 0.00 36.38 36.20 1mm5 s VAL 112 CO 0.12 0.29 0.06 0.28 -0.31 0.00 0.00 175.10 175.54 1mm5 s THR 113 N 1.39 4.81 0.22 5.32 -1.32 -1.08 -2.61 115.64 122.36 1mm5 s THR 113 Ca -0.03 -0.04 -0.18 0.00 -1.21 0.00 0.00 61.69 60.23 1mm5 s THR 113 Cb -0.13 -3.12 0.03 0.00 -1.51 0.00 0.00 72.50 67.76 1mm5 s THR 113 CO -0.03 0.52 0.57 0.00 -2.21 0.00 0.00 174.62 173.48 1mm5 s ALA 114 N -0.17 -0.99 -0.22 11.08 0.00 -1.07 -2.04 121.76 128.36 1mm5 s ALA 114 Ca 0.07 -0.25 -0.23 0.00 0.00 0.00 0.00 51.96 51.55 1mm5 s ALA 114 Cb -0.12 0.88 0.06 0.00 0.00 0.00 0.00 23.12 23.94 1mm5 s ALA 114 CO 0.01 -0.87 0.64 -0.98 0.00 0.00 0.00 175.76 174.57 1mm5 s ARG 115 N -3.89 0.78 1.14 0.00 1.04 -0.58 -3.90 118.95 113.54 1mm5 s ARG 115 Ca 0.10 0.83 0.00 0.00 -1.04 0.00 0.00 55.73 55.62 1mm5 s ARG 115 Cb -0.02 0.38 0.00 0.00 -2.04 0.00 0.00 34.95 33.27 1mm5 s ARG 115 CO 0.00 -0.11 0.00 -0.25 -0.04 0.00 0.00 175.30 174.90 1mm5 n ASP 116 N 2.55 0.00 0.00 -2.89 9.92 -1.26 -3.91 116.55 120.96 1mm5 n ASP 116 Ca -0.14 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.12 1mm5 n ASP 116 Cb 0.56 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.04 1mm5 n ASP 116 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1mm5 n ASN 117 N 2.16 0.00 -4.50 -2.24 4.13 -1.26 -5.05 115.26 108.50 1mm5 n ASN 117 Ca 0.00 0.00 -0.44 0.00 1.68 0.00 0.00 54.58 55.82 1mm5 n ASN 117 Cb 0.00 0.00 -0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1mm5 n ASN 117 CO 0.00 0.00 0.00 0.86 0.28 0.00 0.00 177.26 178.40 1mm5 s TRP 118 N 0.00 3.22 0.00 3.10 -0.11 -1.26 -3.64 118.94 120.25 1mm5 s TRP 118 Ca 0.00 -1.89 0.00 0.00 1.22 0.00 0.00 56.10 55.43 1mm5 s TRP 118 Cb 0.00 -4.46 0.00 0.00 -1.50 0.00 0.00 33.47 27.51 1mm5 s TRP 118 CO 0.00 -1.55 0.00 0.09 -4.62 0.00 0.00 176.95 170.87 1mm5 n ASN 119 N 6.66 0.00 -3.15 5.86 4.13 -1.26 -5.03 115.26 122.46 1mm5 n ASN 119 Ca 0.39 0.00 -0.22 0.00 1.68 0.00 0.00 54.58 56.44 1mm5 n ASN 119 Cb 0.44 0.00 -0.06 0.00 -1.54 0.00 0.00 39.78 38.63 1mm5 n ASN 119 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1mm5 n TYR 120 N 0.00 -0.99 -2.04 3.10 4.19 -1.24 -5.03 117.16 115.15 1mm5 n TYR 120 Ca 0.00 -3.20 -0.41 0.00 3.31 0.00 0.00 57.90 57.61 1mm5 n TYR 120 Cb 0.00 0.08 -0.02 0.00 0.49 0.00 0.00 39.34 39.89 1mm5 n TYR 120 CO 0.00 0.00 0.00 0.42 0.91 0.00 0.00 176.86 178.19 1mm5 s ILE 121 N -0.64 2.57 -0.51 2.97 1.09 -1.25 -1.53 121.20 123.89 1mm5 s ILE 121 Ca 0.34 0.56 -0.36 0.00 -1.10 0.00 0.00 60.65 60.10 1mm5 s ILE 121 Cb 0.15 -3.36 -0.15 0.00 -1.06 0.00 0.00 42.46 38.05 1mm5 s ILE 121 CO -0.14 0.13 2.29 -2.65 -0.10 0.00 0.00 174.94 174.47 1mm5 n PRO 122 N 0.94 0.62 -4.14 2.79 -0.02 -1.24 -4.67 135.00 129.29 1mm5 n PRO 122 Ca 0.01 0.14 -0.34 0.00 -2.02 0.00 0.00 63.50 61.29 1mm5 n PRO 122 Cb 0.41 -2.16 -0.11 0.00 -0.02 0.00 0.00 33.50 31.62 1mm5 n PRO 122 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1mm5 s LEU 123 N 7.82 3.62 0.44 2.45 1.43 -0.86 -4.82 118.68 128.76 1mm5 s LEU 123 Ca 1.16 0.01 -0.23 0.00 -1.03 0.00 0.00 54.13 54.03 1mm5 s LEU 123 Cb -1.01 -1.90 -0.08 0.00 0.03 0.00 0.00 46.19 43.23 1mm5 s LEU 123 CO 0.51 0.17 1.15 -2.16 0.23 0.00 0.00 176.35 176.25 1mm5 s PRO 124 N 0.36 3.85 -0.20 1.29 0.04 -1.26 -2.64 135.00 136.45 1mm5 s PRO 124 Ca 0.01 1.76 -0.05 0.00 0.04 0.00 0.00 61.00 62.75 1mm5 s PRO 124 Cb -0.13 -2.46 0.10 0.00 0.04 0.00 0.00 34.50 32.05 1mm5 s PRO 124 CO 0.01 -0.47 0.35 0.54 0.04 0.00 0.00 177.00 177.47 1mm5 s VAL 125 N -1.54 -0.55 -0.11 -0.36 0.11 0.39 -4.97 120.40 113.37 1mm5 s VAL 125 Ca 0.62 0.10 -0.01 0.00 -2.93 0.00 0.00 61.98 59.76 1mm5 s VAL 125 Cb -0.28 -0.66 -0.03 0.00 -1.53 0.00 0.00 36.38 33.89 1mm5 s VAL 125 CO 0.35 -0.00 -0.08 -0.22 -3.33 0.00 0.00 175.10 171.82 1mm5 s LEU 126 N 2.52 3.06 -0.06 2.54 2.96 -1.26 -2.00 118.68 126.45 1mm5 s LEU 126 Ca 0.04 -0.14 -0.15 0.00 -0.22 0.00 0.00 54.13 53.67 1mm5 s LEU 126 Cb -0.13 -1.69 0.03 0.00 0.50 0.00 0.00 46.19 44.89 1mm5 s LEU 126 CO -0.13 0.25 0.34 -1.48 -1.32 0.00 0.00 176.35 174.02 1mm5 s LEU 127 N -0.16 0.73 0.06 -0.68 2.34 -1.05 -5.01 118.68 114.91 1mm5 s LEU 127 Ca 0.02 0.32 -0.31 0.00 0.06 0.00 0.00 54.13 54.22 1mm5 s LEU 127 Cb -0.13 1.30 -0.06 0.00 -0.56 0.00 0.00 46.19 46.73 1mm5 s LEU 127 CO 0.03 -0.34 1.29 -2.16 -1.06 0.00 0.00 176.35 174.10 1mm5 s PRO 128 N -0.80 4.37 0.06 1.48 0.04 -1.26 -2.45 135.00 136.44 1mm5 s PRO 128 Ca -0.09 1.88 0.03 0.00 0.04 0.00 0.00 61.00 62.87 1mm5 s PRO 128 Cb -0.04 -3.37 -0.03 0.00 0.04 0.00 0.00 34.50 31.10 1mm5 s PRO 128 CO 0.03 -0.37 -0.10 -1.17 0.04 0.00 0.00 177.00 175.43 1mm5 s LEU 129 N 1.36 2.30 0.08 -3.56 0.20 -1.00 -2.59 118.68 115.47 1mm5 s LEU 129 Ca 0.61 -0.64 0.01 0.00 0.69 0.00 0.00 54.13 54.80 1mm5 s LEU 129 Cb -0.32 -0.29 -0.04 0.00 -0.43 0.00 0.00 46.19 45.11 1mm5 s LEU 129 CO 0.29 -0.19 -0.06 0.00 -0.29 0.00 0.00 176.35 176.10 1mm5 s ALA 130 N -1.63 0.82 -0.16 5.97 0.00 -0.18 -2.59 121.76 123.99 1mm5 s ALA 130 Ca -0.04 -1.27 -0.01 0.00 0.00 0.00 0.00 51.96 50.64 1mm5 s ALA 130 Cb -0.08 0.18 0.05 0.00 0.00 0.00 0.00 23.12 23.27 1mm5 s ALA 130 CO 0.01 -0.26 -0.01 -1.12 0.00 0.00 0.00 175.76 174.38 1mm5 s SER 131 N -2.91 2.62 -0.09 0.00 0.01 -1.07 -2.59 113.70 109.67 1mm5 s SER 131 Ca 0.09 -0.61 -0.04 0.00 1.31 0.00 0.00 55.95 56.70 1mm5 s SER 131 Cb 0.05 -0.71 0.05 0.00 0.21 0.00 0.00 66.02 65.62 1mm5 s SER 131 CO -0.06 -0.23 0.20 0.68 0.41 0.00 0.00 173.24 174.24 1mm5 s VAL 132 N 1.78 -0.19 0.00 3.43 -7.23 -0.97 -1.36 120.40 115.86 1mm5 s VAL 132 Ca 0.01 0.24 0.00 0.00 -1.81 0.00 0.00 61.98 60.42 1mm5 s VAL 132 Cb -0.15 -0.34 0.00 0.00 0.56 0.00 0.00 36.38 36.45 1mm5 s VAL 132 CO -0.07 0.10 0.00 0.61 -0.31 0.00 0.00 175.10 175.43 1mm5 n GLY 133 N 4.77 2.43 3.62 2.32 0.00 -0.85 -1.03 105.19 116.45 1mm5 n GLY 133 Ca -0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 46.02 45.72 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 0.13 -0.78 0.00 1.61 6.14 0.42 -2.59 117.35 122.28 1mm5 s TYR 134 Ca 0.00 1.52 0.00 0.00 0.64 0.00 0.00 57.07 59.23 1mm5 s TYR 134 Cb 0.00 0.47 0.00 0.00 0.42 0.00 0.00 41.96 42.85 1mm5 s TYR 134 CO 0.00 -0.39 0.00 0.41 0.64 0.00 0.00 175.55 176.21 1mm5 n GLY 135 N 4.14 2.31 0.56 8.97 0.00 -1.24 -2.60 105.19 117.32 1mm5 n GLY 135 Ca -0.18 -0.38 0.03 0.00 0.00 0.00 0.00 46.02 45.49 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 13.26 1.67 -3.96 1.61 -0.04 -1.26 -4.74 135.00 141.55 1mm5 n PRO 136 Ca 0.00 -0.74 -0.29 0.00 -0.04 0.00 0.00 63.50 62.43 1mm5 n PRO 136 Cb 0.00 -1.37 -0.16 0.00 -0.04 0.00 0.00 33.50 31.93 1mm5 n PRO 136 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1mm5 s VAL 137 N -1.63 1.39 -0.15 0.52 -7.23 -1.07 -3.65 120.40 108.59 1mm5 s VAL 137 Ca 0.13 -0.73 0.00 0.00 -1.81 0.00 0.00 61.98 59.57 1mm5 s VAL 137 Cb 0.08 -1.46 0.02 0.00 0.56 0.00 0.00 36.38 35.59 1mm5 s VAL 137 CO 0.07 0.24 -0.13 0.42 -0.31 0.00 0.00 175.10 175.38 1mm5 s THR 138 N 1.52 1.52 0.31 5.32 -4.23 -1.02 -0.43 115.64 118.64 1mm5 s THR 138 Ca 0.01 -0.61 -0.27 0.00 -1.18 0.00 0.00 61.69 59.65 1mm5 s THR 138 Cb -0.15 -1.44 -0.10 0.00 1.34 0.00 0.00 72.50 72.15 1mm5 s THR 138 CO -0.09 0.44 0.95 -0.36 -0.54 0.00 0.00 174.62 175.02 1mm5 s PHE 139 N 1.51 3.72 -0.12 3.99 0.08 -0.20 -1.91 117.98 125.05 1mm5 s PHE 139 Ca 0.05 1.80 -0.04 0.00 0.12 0.00 0.00 56.93 58.86 1mm5 s PHE 139 Cb -0.13 -2.94 -0.03 0.00 -0.57 0.00 0.00 43.02 39.34 1mm5 s PHE 139 CO -0.10 0.21 0.01 -1.14 -0.10 0.00 0.00 175.22 174.09 1mm5 s GLN 140 N -1.93 3.36 -0.08 0.44 0.74 -0.67 -2.30 119.66 119.23 1mm5 s GLN 140 Ca 0.49 -0.41 0.03 0.00 0.05 0.00 0.00 55.36 55.52 1mm5 s GLN 140 Cb -0.20 -2.92 0.01 0.00 1.10 0.00 0.00 33.01 31.00 1mm5 s GLN 140 CO 0.25 0.51 -0.16 -1.64 -0.55 0.00 0.00 175.29 173.70 1mm5 s MET 141 N -0.34 2.13 -0.01 1.67 -1.94 -1.07 -2.56 119.30 117.18 1mm5 s MET 141 Ca 0.07 -0.57 0.05 0.00 -1.71 0.00 0.00 55.69 53.54 1mm5 s MET 141 Cb -0.12 -1.69 -0.01 0.00 2.01 0.00 0.00 34.83 35.01 1mm5 s MET 141 CO 0.02 0.08 -0.16 0.99 -0.01 0.00 0.00 175.02 175.94 1mm5 s THR 142 N 0.55 1.30 -0.26 2.05 2.01 -0.91 -1.01 115.64 119.36 1mm5 s THR 142 Ca -0.16 -0.72 -0.01 0.00 0.31 0.00 0.00 61.69 61.11 1mm5 s THR 142 Cb -0.16 -1.08 0.04 0.00 0.01 0.00 0.00 72.50 71.30 1mm5 s THR 142 CO 0.05 0.35 -0.06 -0.31 -0.69 0.00 0.00 174.62 173.97 1mm5 s TYR 143 N -0.41 3.13 -0.57 4.92 1.51 -1.07 -2.59 117.35 122.27 1mm5 s TYR 143 Ca 0.06 -1.75 -0.02 0.00 -1.01 0.00 0.00 57.07 54.35 1mm5 s TYR 143 Cb -0.06 -2.05 0.15 0.00 -0.11 0.00 0.00 41.96 39.89 1mm5 s TYR 143 CO -0.01 -0.77 0.38 0.42 -1.11 0.00 0.00 175.55 174.46 1mm5 s ILE 144 N 1.27 3.51 0.54 2.71 1.01 -0.64 -4.27 121.20 125.33 1mm5 s ILE 144 Ca -0.02 -2.83 -0.20 0.00 0.00 0.00 0.00 60.65 57.60 1mm5 s ILE 144 Cb -0.18 -3.32 -0.06 0.00 0.01 0.00 0.00 42.46 38.91 1mm5 s ILE 144 CO -0.04 -0.83 1.16 -2.16 0.00 0.00 0.00 174.94 173.06 1mm5 s PRO 145 N 0.14 3.33 0.01 2.79 0.04 -1.26 -2.24 135.00 137.81 1mm5 s PRO 145 Ca 0.15 1.69 -0.05 0.00 0.04 0.00 0.00 61.00 62.84 1mm5 s PRO 145 Cb -0.21 -2.05 -0.02 0.00 0.04 0.00 0.00 34.50 32.26 1mm5 s PRO 145 CO -0.03 -0.88 -0.09 0.41 0.04 0.00 0.00 177.00 176.44 1mm5 n GLY 146 N 0.29 -0.18 2.12 0.56 0.00 -1.26 -4.77 105.19 101.95 1mm5 n GLY 146 Ca 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.05 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 -3.56 0.91 -3.59 2.61 5.66 -1.26 -5.09 114.28 109.95 1mm5 n THR 147 Ca -0.04 -2.27 -0.07 0.00 -3.05 0.00 0.00 64.05 58.63 1mm5 n THR 147 Cb 0.14 0.93 0.01 0.00 -1.55 0.00 0.00 70.33 69.86 1mm5 n THR 147 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 175.07 170.80 1mm5 n TYR 148 N -0.20 -1.71 0.68 1.09 4.01 -1.26 -5.05 117.16 114.72 1mm5 n TYR 148 Ca 0.10 -1.26 0.07 0.00 -0.16 0.00 0.00 57.90 56.65 1mm5 n TYR 148 Cb 0.94 0.54 -0.09 0.00 -0.31 0.00 0.00 39.34 40.43 1mm5 n TYR 148 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1mm5 n ASN 149 N -1.44 0.78 -1.90 7.72 0.23 -1.26 -4.39 115.26 115.00 1mm5 n ASN 149 Ca -0.04 -0.80 -0.12 0.00 -0.53 0.00 0.00 54.58 53.08 1mm5 n ASN 149 Cb 0.38 1.06 0.20 0.00 -2.08 0.00 0.00 39.78 39.34 1mm5 n ASN 149 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1mm5 n ASN 150 N -1.42 4.00 -1.22 0.53 5.15 -1.26 -5.04 115.26 116.00 1mm5 n ASN 150 Ca 0.02 -3.15 0.16 0.00 -0.60 0.00 0.00 54.58 51.01 1mm5 n ASN 150 Cb 0.26 -0.74 -0.06 0.00 -0.53 0.00 0.00 39.78 38.71 1mm5 n ASN 150 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1mm5 n GLY 151 N -0.44 -2.55 1.48 8.20 0.00 -1.26 -5.00 105.19 105.62 1mm5 n GLY 151 Ca 0.41 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 45.27 1mm5 n GLY 151 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1mm5 n ASN 152 N -4.03 0.14 -4.55 1.61 2.85 -1.08 -4.70 115.26 105.51 1mm5 n ASN 152 Ca -0.03 0.09 -0.34 0.00 -0.11 0.00 0.00 54.58 54.19 1mm5 n ASN 152 Cb 0.57 0.01 -0.12 0.00 1.24 0.00 0.00 39.78 41.48 1mm5 n ASN 152 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1mm5 s VAL 153 N -1.28 3.84 -0.07 3.44 0.11 -0.95 -4.54 120.40 120.96 1mm5 s VAL 153 Ca 0.00 -0.40 0.03 0.00 -2.93 0.00 0.00 61.98 58.68 1mm5 s VAL 153 Cb 0.00 -2.63 -0.02 0.00 -1.53 0.00 0.00 36.38 32.19 1mm5 s VAL 153 CO 0.00 0.55 -0.14 -0.31 -3.33 0.00 0.00 175.10 171.86 1mm5 s TYR 154 N -0.22 2.72 0.02 1.54 2.02 -1.26 -1.62 117.35 120.55 1mm5 s TYR 154 Ca 0.04 -0.28 0.06 0.00 -0.37 0.00 0.00 57.07 56.51 1mm5 s TYR 154 Cb -0.13 -1.68 -0.03 0.00 -0.40 0.00 0.00 41.96 39.72 1mm5 s TYR 154 CO 0.02 0.09 -0.15 0.12 -1.57 0.00 0.00 175.55 174.06 1mm5 s PHE 155 N -0.47 2.64 -0.14 2.71 2.19 -1.07 -1.83 117.98 122.01 1mm5 s PHE 155 Ca 0.06 -0.21 0.02 0.00 0.33 0.00 0.00 56.93 57.13 1mm5 s PHE 155 Cb -0.12 -1.52 0.02 0.00 -1.31 0.00 0.00 43.02 40.09 1mm5 s PHE 155 CO 0.02 0.25 -0.18 0.00 1.83 0.00 0.00 175.22 177.14 1mm5 s ALA 156 N -0.90 2.03 0.37 11.12 0.00 -1.02 -2.13 121.76 131.23 1mm5 s ALA 156 Ca 0.14 -0.98 0.08 0.00 0.00 0.00 0.00 51.96 51.21 1mm5 s ALA 156 Cb -0.11 -1.00 -0.07 0.00 0.00 0.00 0.00 23.12 21.95 1mm5 s ALA 156 CO 0.05 -0.17 -0.01 -1.58 0.00 0.00 0.00 175.76 174.05 1mm5 s TRP 157 N 1.09 2.50 -0.11 0.00 0.52 -1.06 -3.53 118.94 118.34 1mm5 s TRP 157 Ca -0.02 -0.55 -0.03 0.00 0.02 0.00 0.00 56.10 55.51 1mm5 s TRP 157 Cb -0.14 -1.60 -0.03 0.00 -1.15 0.00 0.00 33.47 30.54 1mm5 s TRP 157 CO -0.06 0.47 0.03 -1.64 0.02 0.00 0.00 176.95 175.78 1mm5 s MET 158 N -3.70 3.20 -0.19 4.98 -1.94 0.32 -1.66 119.30 120.31 1mm5 s MET 158 Ca 0.35 -0.35 0.01 0.00 -1.71 0.00 0.00 55.69 53.99 1mm5 s MET 158 Cb 0.04 -2.92 0.04 0.00 2.01 0.00 0.00 34.83 34.00 1mm5 s MET 158 CO 0.18 0.66 -0.13 0.50 -0.01 0.00 0.00 175.02 176.22 1mm5 s ARG 159 N -0.74 2.32 0.04 2.03 3.52 -0.80 -2.59 118.95 122.73 1mm5 s ARG 159 Ca 0.12 -0.83 0.03 0.00 -0.13 0.00 0.00 55.73 54.92 1mm5 s ARG 159 Cb -0.12 -2.43 -0.04 0.00 -1.56 0.00 0.00 34.95 30.80 1mm5 s ARG 159 CO 0.02 -0.35 -0.02 -0.06 -0.81 0.00 0.00 175.30 174.08 1mm5 s PHE 160 N 1.36 2.99 -0.31 5.12 0.40 -1.06 -2.42 117.98 124.06 1mm5 s PHE 160 Ca 0.01 0.00 -0.12 0.00 -0.60 0.00 0.00 56.93 56.22 1mm5 s PHE 160 Cb -0.15 -1.59 -0.03 0.00 0.51 0.00 0.00 43.02 41.75 1mm5 s PHE 160 CO -0.09 0.45 0.21 -1.14 0.70 0.00 0.00 175.22 175.35 1mm5 s GLN 161 N -1.86 3.67 -0.01 0.44 0.74 -1.24 -1.88 119.66 119.53 1mm5 s GLN 161 Ca 0.22 -0.51 0.07 0.00 0.05 0.00 0.00 55.36 55.18 1mm5 s GLN 161 Cb -0.11 -3.72 -0.02 0.00 1.10 0.00 0.00 33.01 30.25 1mm5 s GLN 161 CO 0.13 -0.33 -0.23 0.12 -0.55 0.00 0.00 175.29 174.43 1mm5 s PHE 162 N 1.73 2.03 -0.17 1.67 2.19 -0.14 -5.04 117.98 120.25 1mm5 s PHE 162 Ca 0.06 -0.39 -0.06 0.00 0.33 0.00 0.00 56.93 56.88 1mm5 s PHE 162 Cb -0.17 -1.29 0.08 0.00 -1.31 0.00 0.00 43.02 40.33 1mm5 s PHE 162 CO 0.10 -0.01 0.36 -0.48 1.83 0.00 0.00 175.22 177.03 1mm5 s LEU 163 N -0.65 -0.51 0.51 6.12 0.05 -1.26 -2.57 118.68 120.38 1mm5 s LEU 163 Ca 0.09 0.85 0.00 0.00 0.05 0.00 0.00 54.13 55.12 1mm5 s LEU 163 Cb -0.09 1.13 0.00 0.00 -2.05 0.00 0.00 46.19 45.18 1mm5 s LEU 163 CO -0.00 -0.23 0.00 -0.62 -0.55 0.00 0.00 176.35 174.94 1mm5 n GLU 164 N 5.35 -3.20 -2.78 1.48 -0.58 -1.26 -4.98 120.64 114.67 1mm5 n GLU 164 Ca -0.08 2.43 -0.05 0.00 -0.42 0.00 0.00 57.16 59.04 1mm5 n GLU 164 Cb 0.50 -3.82 0.01 0.00 -0.57 0.00 0.00 31.44 27.55 1mm5 n GLU 164 CO 0.00 0.00 0.00 0.72 -0.48 0.00 0.00 177.13 177.37 1mm5 n HIS 165 N -4.34 -3.66 -2.54 -0.32 8.25 -1.26 -4.99 115.22 106.36 1mm5 n HIS 165 Ca -0.05 1.54 -0.19 0.00 -0.26 0.00 0.00 57.72 58.76 1mm5 n HIS 165 Cb 0.69 -4.03 0.01 0.00 1.12 0.00 0.00 29.99 27.78 1mm5 n HIS 165 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1mm5 n HIS 166 N 0.11 2.48 -2.50 4.41 8.25 -1.26 -4.76 115.22 121.95 1mm5 n HIS 166 Ca 0.07 -2.93 -0.02 0.00 -0.26 0.00 0.00 57.72 54.58 1mm5 n HIS 166 Cb 0.27 -0.21 0.04 0.00 1.12 0.00 0.00 29.99 31.21 1mm5 n HIS 166 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1mm5 n HIS 167 N -0.33 -0.41 -0.01 4.41 1.44 -1.26 -4.92 115.22 114.13 1mm5 n HIS 167 Ca 0.27 -1.26 -0.21 0.00 -2.01 0.00 0.00 57.72 54.51 1mm5 n HIS 167 Cb 0.74 0.58 -0.13 0.00 0.12 0.00 0.00 29.99 31.29 1mm5 n HIS 167 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 1mm5 h HIS 168 N 1.08 0.35 0.02 -1.40 2.76 -2.01 -3.40 115.15 112.56 1mm5 h HIS 168 Ca -0.37 -0.26 -0.00 0.00 -2.20 0.00 0.00 60.37 57.54 1mm5 h HIS 168 Cb 1.43 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.38 1mm5 h HIS 168 CO 0.07 1.49 -0.01 1.25 -1.30 0.00 0.00 177.93 179.43 1mm5 h HIS 169 N -0.45 -0.03 -0.00 5.26 2.76 -1.98 -3.56 115.15 117.14 1mm5 h HIS 169 Ca -0.28 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.89 1mm5 h HIS 169 Cb 1.64 0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.60 1mm5 h HIS 169 CO 0.14 0.35 0.00 0.72 -1.30 0.00 0.00 177.93 177.83