#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1mtl s GLU 3 N 0.00 3.87 0.79 1.45 0.41 -1.26 -5.07 118.70 118.89 1mtl s GLU 3 Ca 0.00 0.38 -0.13 0.00 -0.41 0.00 0.00 54.97 54.82 1mtl s GLU 3 Cb 0.00 -2.67 0.07 0.00 -1.78 0.00 0.00 34.13 29.75 1mtl s GLU 3 CO 0.00 0.32 1.16 -0.51 -0.49 0.00 0.00 175.26 175.74 1mtl s ASP 4 N -2.22 3.94 -0.43 -0.19 -0.00 -1.26 -4.95 116.67 111.57 1mtl s ASP 4 Ca 0.47 2.18 0.02 0.00 -0.00 0.00 0.00 52.55 55.21 1mtl s ASP 4 Cb -0.12 -2.57 0.14 0.00 -0.00 0.00 0.00 42.92 40.38 1mtl s ASP 4 CO 0.20 -2.42 0.26 -0.63 -0.00 0.00 0.00 175.17 172.58 1mtl s ILE 5 N -2.38 0.98 0.21 0.77 1.01 -0.61 -5.00 121.20 116.17 1mtl s ILE 5 Ca 0.69 -2.43 0.03 0.00 0.00 0.00 0.00 60.65 58.94 1mtl s ILE 5 Cb -0.24 -1.69 -0.05 0.00 0.01 0.00 0.00 42.46 40.49 1mtl s ILE 5 CO 0.51 -0.98 -0.00 -0.76 0.00 0.00 0.00 174.94 173.71 1mtl s LEU 6 N 0.41 2.15 -0.10 2.97 1.43 -1.26 -0.70 118.68 123.58 1mtl s LEU 6 Ca 0.20 -1.20 -0.31 0.00 -1.03 0.00 0.00 54.13 51.79 1mtl s LEU 6 Cb -0.19 -0.18 0.11 0.00 0.03 0.00 0.00 46.19 45.96 1mtl s LEU 6 CO -0.03 -0.53 1.39 0.00 0.23 0.00 0.00 176.35 177.41 1mtl s ALA 7 N -3.52 -2.75 0.48 4.21 0.00 -1.26 -5.08 121.76 113.84 1mtl s ALA 7 Ca 0.27 0.35 -0.05 0.00 0.00 0.00 0.00 51.96 52.52 1mtl s ALA 7 Cb 0.06 0.80 -0.03 0.00 0.00 0.00 0.00 23.12 23.94 1mtl s ALA 7 CO 0.07 -1.16 0.78 -2.14 0.00 0.00 0.00 175.76 173.31 1mtl s PRO 8 N -2.00 3.52 0.00 0.00 0.02 -1.26 -4.15 135.00 131.12 1mtl s PRO 8 Ca 0.29 0.17 0.00 0.00 0.02 0.00 0.00 61.00 61.48 1mtl s PRO 8 Cb 0.02 -2.38 0.00 0.00 0.02 0.00 0.00 34.50 32.15 1mtl s PRO 8 CO -0.04 -0.20 0.00 0.41 -0.33 0.00 0.00 177.00 176.84 1mtl n GLY 9 N -2.25 0.33 3.75 0.52 0.00 -1.26 -4.99 105.19 101.29 1mtl n GLY 9 Ca 0.00 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 1mtl n GLY 9 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1mtl s LEU 10 N 0.00 3.50 -0.08 0.99 1.43 -1.26 -4.90 118.68 118.35 1mtl s LEU 10 Ca 0.00 2.25 -0.06 0.00 -1.03 0.00 0.00 54.13 55.29 1mtl s LEU 10 Cb 0.00 -4.58 -0.27 0.00 0.03 0.00 0.00 46.19 41.36 1mtl s LEU 10 CO 0.00 -1.76 0.52 0.03 0.23 0.00 0.00 176.35 175.37 1mtl h ARG 11 N 0.34 0.29 -3.35 1.70 3.08 -1.44 -2.05 114.38 112.94 1mtl h ARG 11 Ca -0.49 -0.49 -0.18 0.00 0.07 0.00 0.00 59.98 58.89 1mtl h ARG 11 Cb 1.28 0.18 -0.26 0.00 0.08 0.00 0.00 29.97 31.25 1mtl h ARG 11 CO 0.53 1.19 -0.53 0.08 -1.07 0.00 0.00 179.97 180.17 1mtl s VAL 12 N -2.57 0.01 -0.22 2.04 1.01 -1.22 -1.42 120.40 118.02 1mtl s VAL 12 Ca -0.18 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 61.77 1mtl s VAL 12 Cb 0.06 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 36.23 1mtl s VAL 12 CO 0.81 -0.02 -0.14 -0.69 0.00 0.00 0.00 175.10 175.06 1mtl s VAL 13 N -0.01 2.29 -0.19 2.92 1.01 -0.68 -0.68 120.40 125.05 1mtl s VAL 13 Ca -0.01 -1.20 -0.23 0.00 0.00 0.00 0.00 61.98 60.54 1mtl s VAL 13 Cb -0.02 -2.14 -0.02 0.00 0.00 0.00 0.00 36.38 34.20 1mtl s VAL 13 CO 0.00 0.27 0.75 -0.36 0.00 0.00 0.00 175.10 175.76 1mtl s PHE 14 N 1.23 3.38 -0.35 5.22 0.40 0.17 -1.41 117.98 126.63 1mtl s PHE 14 Ca -0.01 1.10 -0.08 0.00 -0.60 0.00 0.00 56.93 57.34 1mtl s PHE 14 Cb -0.16 -2.93 0.03 0.00 0.51 0.00 0.00 43.02 40.47 1mtl s PHE 14 CO -0.08 -0.24 0.14 0.00 0.70 0.00 0.00 175.22 175.73 1mtl s GLY 16 N 1.47 1.79 0.00 0.00 0.00 0.21 -1.43 107.32 109.37 1mtl s GLY 16 Ca 0.00 -1.25 0.00 0.00 0.00 0.00 0.00 44.72 43.47 1mtl s GLY 16 CO 0.04 -0.47 0.00 1.39 0.00 0.00 0.00 173.10 174.06 1mtl n ILE 17 N -3.77 0.00 -3.56 0.90 5.41 -1.26 -0.60 119.36 116.48 1mtl n ILE 17 Ca 0.16 0.28 -0.29 0.00 1.00 0.00 0.00 62.75 63.89 1mtl n ILE 17 Cb 0.59 -1.27 -0.15 0.00 -0.71 0.00 0.00 39.64 38.11 1mtl n ILE 17 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 1mtl s ASN 18 N -2.71 3.55 0.00 4.38 3.04 -1.26 -2.00 114.94 119.93 1mtl s ASN 18 Ca 0.00 -1.42 0.00 0.00 0.04 0.00 0.00 52.86 51.48 1mtl s ASN 18 Cb 0.00 -0.42 0.00 0.00 -1.54 0.00 0.00 41.25 39.29 1mtl s ASN 18 CO 0.00 -0.42 0.00 -2.65 -3.04 0.00 0.00 177.10 170.99 1mtl n PRO 19 N 5.08 0.00 -0.01 0.43 -0.02 -1.26 -4.20 135.00 135.02 1mtl n PRO 19 Ca -0.04 0.00 -0.13 0.00 -2.02 0.00 0.00 63.50 61.31 1mtl n PRO 19 Cb 0.41 -1.37 -0.10 0.00 -0.02 0.00 0.00 33.50 32.42 1mtl n PRO 19 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1mtl h GLY 20 N 2.94 -0.04 -7.52 -1.23 0.00 -1.97 -3.21 103.07 92.03 1mtl h GLY 20 Ca 0.00 0.02 -0.39 0.00 0.00 0.00 0.00 47.33 46.95 1mtl h GLY 20 CO 0.00 -0.02 1.26 0.48 0.00 0.00 0.00 176.54 178.27 1mtl s LEU 21 N -8.97 3.19 0.00 3.11 2.34 -1.26 -4.56 118.68 112.53 1mtl s LEU 21 Ca -0.16 -1.79 0.00 0.00 0.06 0.00 0.00 54.13 52.24 1mtl s LEU 21 Cb 0.00 -2.59 0.00 0.00 -0.56 0.00 0.00 46.19 43.05 1mtl s LEU 21 CO 0.64 -2.75 0.00 -0.24 -1.06 0.00 0.00 176.35 172.94 1mtl n SER 22 N 13.35 0.00 -0.46 1.48 2.88 -1.26 -4.62 113.62 124.98 1mtl n SER 22 Ca 0.45 0.00 0.42 0.00 -1.33 0.00 0.00 58.87 58.41 1mtl n SER 22 Cb 0.46 -0.24 0.75 0.00 -0.75 0.00 0.00 64.21 64.43 1mtl n SER 22 CO 0.00 0.00 0.00 0.28 -1.23 0.00 0.00 175.04 174.09 1mtl h SER 23 N 0.00 0.00 0.00 -3.46 0.02 -1.80 2.28 113.55 110.59 1mtl h SER 23 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1mtl h SER 23 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 1mtl h SER 23 CO 0.00 0.00 -0.04 0.00 -1.14 0.00 0.00 176.83 175.65 1mtl n ALA 24 N -2.75 2.19 1.43 3.77 0.00 -1.21 -0.04 120.51 123.89 1mtl n ALA 24 Ca 0.33 -2.25 0.00 0.00 0.00 0.00 0.00 53.44 51.51 1mtl n ALA 24 Cb 1.60 -0.34 0.00 0.00 0.00 0.00 0.00 19.45 20.72 1mtl n ALA 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mtl n GLY 25 N -1.18 -0.67 0.00 0.00 0.00 0.77 -2.31 105.19 101.80 1mtl n GLY 25 Ca 0.12 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.14 1mtl n GLY 25 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1mtl n THR 26 N -0.48 0.00 0.00 2.61 -2.24 -1.26 -4.98 114.28 107.93 1mtl n THR 26 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1mtl n THR 26 Cb 0.00 1.53 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 1mtl n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1mtl n GLY 27 N 0.00 2.59 3.92 3.38 0.00 -0.98 -5.05 105.19 109.05 1mtl n GLY 27 Ca 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.76 1mtl n GLY 27 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1mtl s PHE 28 N -2.72 3.54 0.16 1.61 0.40 -1.26 -4.09 117.98 115.62 1mtl s PHE 28 Ca 0.00 0.64 -0.16 0.00 -0.60 0.00 0.00 56.93 56.81 1mtl s PHE 28 Cb 0.00 -2.15 -0.07 0.00 0.51 0.00 0.00 43.02 41.31 1mtl s PHE 28 CO 0.00 -0.12 0.59 -2.14 0.70 0.00 0.00 175.22 174.25 1mtl s PRO 29 N -4.57 4.05 -1.38 0.24 0.02 -1.24 -3.40 135.00 128.72 1mtl s PRO 29 Ca 0.45 0.59 -0.04 0.00 0.02 0.00 0.00 61.00 62.02 1mtl s PRO 29 Cb -0.10 -2.93 0.00 0.00 0.02 0.00 0.00 34.50 31.49 1mtl s PRO 29 CO 0.41 0.47 0.42 1.19 -0.33 0.00 0.00 177.00 179.16 1mtl n PHE 30 N 0.83 -1.62 0.61 6.54 3.01 -0.76 -4.82 117.46 121.24 1mtl n PHE 30 Ca -0.05 0.67 0.13 0.00 1.01 0.00 0.00 57.45 59.20 1mtl n PHE 30 Cb 0.52 -3.56 0.33 0.00 -0.01 0.00 0.00 39.48 36.75 1mtl n PHE 30 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1mtl n ALA 31 N -4.43 2.50 -2.27 4.37 0.00 0.95 -4.82 120.51 116.80 1mtl n ALA 31 Ca -0.28 -0.10 -0.42 0.00 0.00 0.00 0.00 53.44 52.64 1mtl n ALA 31 Cb 0.67 -1.37 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 1mtl n ALA 31 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1mtl s HIS 32 N -3.12 3.48 0.65 0.00 5.04 -1.26 -4.86 115.29 115.22 1mtl s HIS 32 Ca 0.09 1.40 0.29 0.00 -1.54 0.00 0.00 55.06 55.31 1mtl s HIS 32 Cb 0.13 -3.38 1.59 0.00 0.04 0.00 0.00 32.58 30.96 1mtl s HIS 32 CO 0.64 -1.08 1.92 -1.00 -2.34 0.00 0.00 174.74 172.88 1mtl h PRO 33 N 6.09 0.00 -0.46 2.88 0.13 -1.96 -1.58 132.00 137.09 1mtl h PRO 33 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1mtl h PRO 33 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 1mtl h PRO 33 CO 0.78 0.00 0.00 0.00 -0.23 0.00 0.00 178.00 178.55 1mtl n ALA 34 N -1.99 2.43 -2.71 -0.56 0.00 -1.26 -4.90 120.51 111.52 1mtl n ALA 34 Ca 0.00 -0.87 -0.38 0.00 0.00 0.00 0.00 53.44 52.19 1mtl n ALA 34 Cb 0.44 -0.97 -0.06 0.00 0.00 0.00 0.00 19.45 18.86 1mtl n ALA 34 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1mtl s ASN 35 N -1.13 6.58 -0.04 0.00 3.84 -0.60 -1.94 114.94 121.65 1mtl s ASN 35 Ca 0.35 0.69 0.13 0.00 0.21 0.00 0.00 52.86 54.24 1mtl s ASN 35 Cb 0.19 -2.26 0.43 0.00 -0.55 0.00 0.00 41.25 39.06 1mtl s ASN 35 CO 0.25 -0.01 1.33 0.54 -2.79 0.00 0.00 177.10 176.42 1mtl n ARG 36 N 3.89 2.40 0.14 0.43 1.74 -0.70 -4.57 116.66 119.98 1mtl n ARG 36 Ca -0.08 -1.74 -0.16 0.00 -0.77 0.00 0.00 57.85 55.11 1mtl n ARG 36 Cb 0.51 -1.51 -0.09 0.00 -1.02 0.00 0.00 32.46 30.35 1mtl n ARG 36 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 1mtl h PHE 37 N 2.65 -1.41 -0.44 -1.55 3.57 -1.93 0.34 116.94 118.17 1mtl h PHE 37 Ca 0.00 0.03 0.08 0.00 3.53 0.00 0.00 57.97 61.61 1mtl h PHE 37 Cb 0.81 0.59 -0.07 0.00 2.79 0.00 0.00 35.95 40.08 1mtl h PHE 37 CO 0.40 -0.57 0.05 -1.49 -2.23 0.00 0.00 178.31 174.47 1mtl h TRP 38 N -0.75 0.07 -0.42 0.41 4.06 -1.90 0.13 115.95 117.54 1mtl h TRP 38 Ca -0.02 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.94 1mtl h TRP 38 Cb 0.73 0.04 -0.02 0.00 -1.00 0.00 0.00 29.16 28.91 1mtl h TRP 38 CO -0.41 -0.04 0.17 -0.22 -3.56 0.00 0.00 178.44 174.38 1mtl h LYS 39 N 0.17 0.62 -0.24 0.49 3.64 -1.80 -2.28 116.57 117.16 1mtl h LYS 39 Ca 0.22 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.48 1mtl h LYS 39 Cb 0.30 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 1mtl h LYS 39 CO -0.32 0.57 0.12 0.28 -2.27 0.00 0.00 179.45 177.84 1mtl h VAL 40 N 0.53 1.13 -0.27 2.00 2.07 0.64 -0.37 116.25 121.99 1mtl h VAL 40 Ca 0.14 -0.37 -0.07 0.00 0.82 0.00 0.00 66.70 67.23 1mtl h VAL 40 Cb 0.18 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 30.87 1mtl h VAL 40 CO -0.01 0.13 -0.13 0.16 0.02 0.00 0.00 177.57 177.74 1mtl h ILE 41 N 0.27 1.22 0.37 4.57 3.07 -0.73 0.64 117.51 126.93 1mtl h ILE 41 Ca 0.08 -0.99 -0.02 0.00 1.55 0.00 0.00 64.86 65.49 1mtl h ILE 41 Cb 0.10 1.16 0.00 0.00 -0.27 0.00 0.00 36.82 37.81 1mtl h ILE 41 CO -0.01 0.32 -0.18 0.22 -1.05 0.00 0.00 178.15 177.45 1mtl h TYR 42 N 0.42 -0.47 -0.56 0.16 3.20 -1.23 -0.73 116.97 117.78 1mtl h TYR 42 Ca 0.08 -0.01 0.16 0.00 3.14 0.00 0.00 58.73 62.10 1mtl h TYR 42 Cb 0.48 0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.88 1mtl h TYR 42 CO 0.01 -0.29 0.50 1.96 -1.64 0.00 0.00 178.16 178.70 1mtl h GLN 43 N -0.54 0.00 -0.00 1.82 4.20 -0.84 0.75 115.11 120.50 1mtl h GLN 43 Ca -0.05 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.66 1mtl h GLN 43 Cb 0.38 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.16 1mtl h GLN 43 CO 0.08 0.00 -0.16 0.00 -0.67 0.00 0.00 178.83 178.09 1mtl n ALA 44 N -2.47 2.71 -0.27 3.87 0.00 0.22 -4.95 120.51 119.63 1mtl n ALA 44 Ca 0.11 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.37 1mtl n ALA 44 Cb 0.72 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.81 1mtl n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1mtl n GLY 45 N 1.50 0.86 0.18 0.00 0.00 0.26 -4.54 105.19 103.45 1mtl n GLY 45 Ca 0.07 -0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.15 1mtl n GLY 45 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 1mtl h PHE 46 N 0.00 0.00 -4.15 1.61 -1.00 -1.34 -3.46 116.94 108.61 1mtl h PHE 46 Ca 0.00 0.00 -0.23 0.00 2.81 0.00 0.00 57.97 60.55 1mtl h PHE 46 Cb 0.00 0.00 -0.15 0.00 3.61 0.00 0.00 35.95 39.41 1mtl h PHE 46 CO 0.00 0.00 -0.65 0.95 -1.61 0.00 0.00 178.31 177.00 1mtl s THR 47 N -3.21 0.34 -1.88 -1.55 -4.23 -1.24 -4.90 115.64 98.97 1mtl s THR 47 Ca 0.07 -1.94 0.24 0.00 -1.18 0.00 0.00 61.69 58.88 1mtl s THR 47 Cb 0.07 -2.07 0.06 0.00 1.34 0.00 0.00 72.50 71.90 1mtl s THR 47 CO 0.67 -0.47 1.22 -0.90 -0.54 0.00 0.00 174.62 174.61 1mtl n ASP 48 N -0.15 1.65 -3.82 3.99 3.85 -1.26 -4.64 116.55 116.16 1mtl n ASP 48 Ca -0.06 -1.28 -0.09 0.00 -0.71 0.00 0.00 54.79 52.64 1mtl n ASP 48 Cb 0.63 0.40 -0.05 0.00 -1.35 0.00 0.00 41.12 40.76 1mtl n ASP 48 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1mtl s ARG 49 N -2.52 1.37 -0.56 0.11 1.70 -1.26 -5.10 118.95 112.69 1mtl s ARG 49 Ca 0.19 -0.98 -0.26 0.00 -0.47 0.00 0.00 55.73 54.21 1mtl s ARG 49 Cb 0.18 0.49 0.04 0.00 -0.57 0.00 0.00 34.95 35.09 1mtl s ARG 49 CO 0.58 -0.57 1.05 -1.14 -1.08 0.00 0.00 175.30 174.14 1mtl s GLN 50 N -3.91 3.42 1.07 3.89 0.74 -1.26 -4.70 119.66 118.91 1mtl s GLN 50 Ca 0.12 -0.02 -0.12 0.00 0.05 0.00 0.00 55.36 55.39 1mtl s GLN 50 Cb -0.00 -4.03 0.23 0.00 1.10 0.00 0.00 33.01 30.31 1mtl s GLN 50 CO -0.00 -1.56 1.06 -0.51 -0.55 0.00 0.00 175.29 173.73 1mtl s LEU 51 N 4.38 1.30 0.15 3.68 1.43 -1.26 -5.03 118.68 123.33 1mtl s LEU 51 Ca 0.36 1.42 0.08 0.00 -1.03 0.00 0.00 54.13 54.96 1mtl s LEU 51 Cb -0.10 -3.48 -0.04 0.00 0.03 0.00 0.00 46.19 42.59 1mtl s LEU 51 CO 0.22 -3.65 -0.07 -0.54 0.23 0.00 0.00 176.35 172.54 1mtl s LYS 52 N -4.70 2.17 0.30 1.70 1.02 -1.26 -4.85 119.74 114.12 1mtl s LYS 52 Ca 0.67 -1.14 0.05 0.00 0.02 0.00 0.00 55.97 55.57 1mtl s LYS 52 Cb -0.22 -2.26 0.75 0.00 -0.52 0.00 0.00 37.83 35.58 1mtl s LYS 52 CO 0.61 0.47 1.73 -1.35 -0.92 0.00 0.00 175.35 175.88 1mtl h PRO 53 N 3.10 0.52 -0.01 -1.68 0.11 -1.87 0.84 132.00 133.01 1mtl h PRO 53 Ca -0.48 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.61 1mtl h PRO 53 Cb 1.19 -0.12 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1mtl h PRO 53 CO 0.54 0.35 0.02 1.96 -0.21 0.00 0.00 178.00 180.65 1mtl h GLN 54 N 0.54 0.00 -0.63 1.05 7.50 -1.94 0.17 115.11 121.80 1mtl h GLN 54 Ca 0.57 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.72 1mtl h GLN 54 Cb 1.03 0.00 0.00 0.00 0.05 0.00 0.00 27.48 28.56 1mtl h GLN 54 CO -0.47 0.00 0.00 0.39 -1.50 0.00 0.00 178.83 177.25 1mtl n GLU 55 N -3.52 4.46 -0.31 1.46 1.02 0.29 -4.60 120.64 119.44 1mtl n GLU 55 Ca -0.03 -2.80 0.13 0.00 -0.02 0.00 0.00 57.16 54.44 1mtl n GLU 55 Cb 0.09 -2.18 0.31 0.00 -0.02 0.00 0.00 31.44 29.64 1mtl n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1mtl h ALA 56 N 3.79 1.49 -0.03 0.62 0.00 -0.90 0.22 119.26 124.46 1mtl h ALA 56 Ca 0.00 0.13 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1mtl h ALA 56 Cb 1.81 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.67 1mtl h ALA 56 CO 0.44 -0.26 0.03 1.96 0.00 0.00 0.00 179.25 181.41 1mtl h GLN 57 N 0.51 0.00 0.00 0.00 1.08 -1.85 -0.40 115.11 114.45 1mtl h GLN 57 Ca 0.56 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.76 1mtl h GLN 57 Cb 1.00 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.43 1mtl h GLN 57 CO -0.48 0.00 0.00 1.25 -0.95 0.00 0.00 178.83 178.65 1mtl h HIS 58 N 0.00 0.00 -0.56 2.96 2.76 -1.30 -1.87 115.15 117.14 1mtl h HIS 58 Ca 0.01 0.00 0.13 0.00 -2.20 0.00 0.00 60.37 58.31 1mtl h HIS 58 Cb 0.07 0.00 -0.03 0.00 1.55 0.00 0.00 27.41 29.00 1mtl h HIS 58 CO 0.00 0.00 0.39 -0.07 -1.30 0.00 0.00 177.93 176.95 1mtl h LEU 59 N 0.00 0.19 -1.03 0.26 3.38 -1.20 0.95 115.31 117.86 1mtl h LEU 59 Ca 0.00 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1mtl h LEU 59 Cb 0.05 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 40.73 1mtl h LEU 59 CO 0.00 0.11 0.61 -0.07 0.09 0.00 0.00 178.44 179.17 1mtl h LEU 60 N 0.21 1.11 -2.73 1.67 3.38 -1.33 0.19 115.31 117.82 1mtl h LEU 60 Ca 0.27 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1mtl h LEU 60 Cb 0.78 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 1mtl h LEU 60 CO -0.05 0.82 0.09 0.44 0.09 0.00 0.00 178.44 179.83 1mtl h ASP 61 N 1.30 0.00 -0.43 -0.43 3.32 -1.00 1.08 116.42 120.25 1mtl h ASP 61 Ca 0.35 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.40 1mtl h ASP 61 Cb -0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.43 1mtl h ASP 61 CO -0.07 0.00 0.00 -1.22 -1.72 0.00 0.00 179.24 176.23 1mtl n TYR 62 N -3.06 1.00 -3.61 4.55 4.02 0.52 -4.95 117.16 115.63 1mtl n TYR 62 Ca -0.03 -0.66 -0.20 0.00 -0.01 0.00 0.00 57.90 57.00 1mtl n TYR 62 Cb 0.15 -0.20 0.06 0.00 -0.02 0.00 0.00 39.34 39.33 1mtl n TYR 62 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 1mtl n ARG 63 N 0.43 -5.73 -4.15 -0.72 1.74 0.37 -4.82 116.66 103.78 1mtl n ARG 63 Ca 0.20 0.71 -0.17 0.00 -0.77 0.00 0.00 57.85 57.82 1mtl n ARG 63 Cb 0.74 -5.48 -0.12 0.00 -1.02 0.00 0.00 32.46 26.58 1mtl n ARG 63 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1mtl s GLY 65 N -1.73 1.06 -0.00 0.00 0.00 0.14 -3.31 107.32 103.47 1mtl s GLY 65 Ca -0.03 -1.51 0.02 0.00 0.00 0.00 0.00 44.72 43.21 1mtl s GLY 65 CO 0.02 -1.50 -0.07 0.14 0.00 0.00 0.00 173.10 171.68 1mtl s VAL 66 N -3.64 0.55 0.17 1.40 1.01 0.13 0.44 120.40 120.47 1mtl s VAL 66 Ca 0.20 -0.37 -0.05 0.00 0.00 0.00 0.00 61.98 61.76 1mtl s VAL 66 Cb 0.06 -0.48 0.02 0.00 0.00 0.00 0.00 36.38 35.97 1mtl s VAL 66 CO 0.01 0.11 0.31 1.07 0.00 0.00 0.00 175.10 176.59 1mtl n THR 67 N 2.77 0.00 -4.10 3.92 5.66 0.01 -1.58 114.28 120.96 1mtl n THR 67 Ca -0.14 -0.57 -0.10 0.00 -3.05 0.00 0.00 64.05 60.19 1mtl n THR 67 Cb 0.57 0.46 -0.09 0.00 -1.55 0.00 0.00 70.33 69.73 1mtl n THR 67 CO 0.00 0.00 0.00 -1.59 -3.05 0.00 0.00 175.07 170.43 1mtl s LYS 68 N -2.15 1.20 0.04 1.09 -2.85 -1.26 0.66 119.74 116.47 1mtl s LYS 68 Ca 0.09 -1.43 -0.16 0.00 -1.00 0.00 0.00 55.97 53.47 1mtl s LYS 68 Cb -0.02 0.32 -0.29 0.00 -2.06 0.00 0.00 37.83 35.79 1mtl s LYS 68 CO 0.07 -0.42 1.09 1.25 0.10 0.00 0.00 175.35 177.44 1mtl h LEU 69 N 2.59 0.83 0.00 2.77 5.85 -0.83 -3.46 115.31 123.05 1mtl h LEU 69 Ca -0.33 -0.83 0.00 0.00 0.84 0.00 0.00 57.88 57.56 1mtl h LEU 69 Cb 1.24 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 42.01 1mtl h LEU 69 CO 0.50 1.57 0.00 1.33 -0.34 0.00 0.00 178.44 181.50 1mtl n VAL 70 N -3.86 0.00 -1.68 1.05 0.24 -0.85 -4.30 118.33 108.93 1mtl n VAL 70 Ca -0.13 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 61.79 1mtl n VAL 70 Cb 0.94 0.00 0.06 0.00 -1.47 0.00 0.00 33.84 33.37 1mtl n VAL 70 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1mtl n ALA 77 N -3.00 6.40 0.00 2.33 0.00 -1.26 -4.93 120.51 120.06 1mtl n ALA 77 Ca 0.00 -3.84 0.00 0.00 0.00 0.00 0.00 53.44 49.60 1mtl n ALA 77 Cb 0.00 -1.85 0.00 0.00 0.00 0.00 0.00 19.45 17.60 1mtl n ALA 77 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1mtl n ASN 78 N -0.71 0.00 -0.92 0.00 6.94 -1.26 -5.13 115.26 114.19 1mtl n ASN 78 Ca 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 55.13 1mtl n ASN 78 Cb 0.44 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.86 1mtl n ASN 78 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1mtl n GLU 79 N 0.00 0.00 0.00 -3.83 1.02 -1.26 -5.03 120.64 111.54 1mtl n GLU 79 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1mtl n GLU 79 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1mtl n GLU 79 CO 0.00 0.00 0.00 1.33 1.18 0.00 0.00 177.13 179.64 1mtl n VAL 80 N 0.00 0.00 -3.59 2.62 0.24 -1.26 -5.16 118.33 111.18 1mtl n VAL 80 Ca 0.00 0.00 -0.14 0.00 -2.04 0.00 0.00 64.34 62.16 1mtl n VAL 80 Cb 0.00 0.00 -0.06 0.00 -1.47 0.00 0.00 33.84 32.31 1mtl n VAL 80 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 1mtl s SER 81 N 1.00 -0.43 0.20 -1.34 0.15 -1.26 -5.03 113.70 106.98 1mtl s SER 81 Ca 0.00 0.21 -0.09 0.00 0.70 0.00 0.00 55.95 56.78 1mtl s SER 81 Cb 0.00 0.48 0.11 0.00 -1.71 0.00 0.00 66.02 64.90 1mtl s SER 81 CO 0.00 -0.68 1.72 0.11 1.20 0.00 0.00 173.24 175.59 1mtl h LYS 82 N 2.90 1.11 -0.16 5.44 1.57 -2.03 -2.43 116.57 122.97 1mtl h LYS 82 Ca -0.30 -0.25 0.01 0.00 -1.87 0.00 0.00 60.65 58.23 1mtl h LYS 82 Cb 1.20 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1mtl h LYS 82 CO 0.41 0.97 0.09 1.96 -0.57 0.00 0.00 179.45 182.30 1mtl h GLN 83 N 1.05 0.18 -0.86 3.15 1.08 -1.99 -1.99 115.11 115.73 1mtl h GLN 83 Ca 0.23 -0.01 0.07 0.00 -1.45 0.00 0.00 58.65 57.49 1mtl h GLN 83 Cb 0.33 -0.04 -0.06 0.00 -0.05 0.00 0.00 27.48 27.67 1mtl h GLN 83 CO -0.00 0.12 0.56 0.93 -0.95 0.00 0.00 178.83 179.49 1mtl h GLU 84 N 0.18 0.91 -0.07 1.46 5.08 -1.91 0.88 114.58 121.12 1mtl h GLU 84 Ca 0.06 -0.05 -0.23 0.00 -1.00 0.00 0.00 59.36 58.14 1mtl h GLU 84 Cb 0.00 -0.21 0.01 0.00 0.50 0.00 0.00 28.75 29.06 1mtl h GLU 84 CO -0.04 0.60 -0.84 -0.07 -1.00 0.00 0.00 179.01 177.67 1mtl h LEU 85 N 0.94 0.86 -0.70 1.33 3.38 -1.15 -0.96 115.31 119.01 1mtl h LEU 85 Ca 0.38 -0.69 -0.09 0.00 0.09 0.00 0.00 57.88 57.57 1mtl h LEU 85 Cb 0.26 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.73 1mtl h LEU 85 CO -0.14 1.42 -0.03 0.45 0.09 0.00 0.00 178.44 180.23 1mtl h HIS 86 N 0.37 1.06 -0.17 1.13 3.86 -0.98 -0.43 115.15 120.00 1mtl h HIS 86 Ca -0.08 -0.18 0.01 0.00 -1.16 0.00 0.00 60.37 58.95 1mtl h HIS 86 Cb 1.49 -0.28 -0.01 0.00 1.06 0.00 0.00 27.41 29.67 1mtl h HIS 86 CO 0.10 0.96 0.08 0.00 0.86 0.00 0.00 177.93 179.94 1mtl h ALA 87 N 1.07 0.20 -0.72 2.45 0.00 -0.80 -1.78 119.26 119.68 1mtl h ALA 87 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.08 1mtl h ALA 87 Cb 0.56 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.29 1mtl h ALA 87 CO 0.03 -0.34 0.47 0.78 0.00 0.00 0.00 179.25 180.19 1mtl h GLY 88 N 0.18 1.02 0.14 0.00 0.00 -0.97 -1.96 103.07 101.48 1mtl h GLY 88 Ca 0.07 -0.39 0.12 0.00 0.00 0.00 0.00 47.33 47.13 1mtl h GLY 88 CO -0.05 0.38 0.14 -1.33 0.00 0.00 0.00 176.54 175.68 1mtl h GLY 89 N 0.98 0.81 0.61 4.60 0.00 -0.43 0.15 103.07 109.79 1mtl h GLY 89 Ca 0.26 -0.03 -0.02 0.00 0.00 0.00 0.00 47.33 47.54 1mtl h GLY 89 CO -0.06 -0.13 -0.51 3.21 0.00 0.00 0.00 176.54 179.06 1mtl h ARG 90 N 0.26 -1.05 -0.96 4.80 2.47 -0.59 0.39 114.38 119.70 1mtl h ARG 90 Ca 0.33 0.07 0.11 0.00 -1.26 0.00 0.00 59.98 59.23 1mtl h ARG 90 Cb 0.50 0.24 -0.08 0.00 -1.65 0.00 0.00 29.97 28.99 1mtl h ARG 90 CO -0.42 -0.70 0.61 0.87 0.56 0.00 0.00 179.97 180.89 1mtl h LYS 91 N -1.09 0.91 0.75 0.04 1.57 -1.06 -2.15 116.57 115.54 1mtl h LYS 91 Ca -0.08 -0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 58.61 1mtl h LYS 91 Cb 0.92 -0.21 0.01 0.00 0.08 0.00 0.00 32.23 33.03 1mtl h LYS 91 CO -0.00 0.60 -0.37 1.25 -0.57 0.00 0.00 179.45 180.36 1mtl h LEU 92 N 0.94 -0.89 -1.16 2.94 5.85 0.21 -2.28 115.31 120.92 1mtl h LEU 92 Ca 0.46 0.03 0.18 0.00 0.84 0.00 0.00 57.88 59.40 1mtl h LEU 92 Cb 0.47 0.24 -0.09 0.00 0.37 0.00 0.00 40.66 41.65 1mtl h LEU 92 CO -0.22 -0.62 0.61 0.40 -0.34 0.00 0.00 178.44 178.27 1mtl h ILE 93 N -1.02 0.73 -0.20 4.05 2.04 0.35 0.17 117.51 123.63 1mtl h ILE 93 Ca -0.10 -0.24 0.03 0.00 1.00 0.00 0.00 64.86 65.55 1mtl h ILE 93 Cb 0.79 -0.02 -0.03 0.00 -0.74 0.00 0.00 36.82 36.82 1mtl h ILE 93 CO 0.16 0.13 0.03 -0.33 0.00 0.00 0.00 178.15 178.13 1mtl h GLU 94 N 0.69 0.10 -0.69 2.37 5.08 -0.99 0.22 114.58 121.37 1mtl h GLU 94 Ca 0.54 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.94 1mtl h GLU 94 Cb 0.93 -0.02 -0.05 0.00 0.50 0.00 0.00 28.75 30.10 1mtl h GLU 94 CO -0.30 0.07 0.41 0.87 -1.00 0.00 0.00 179.01 179.05 1mtl h LYS 95 N 0.11 0.75 0.00 2.33 1.57 -0.16 0.16 116.57 121.32 1mtl h LYS 95 Ca 0.09 -0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.75 1mtl h LYS 95 Cb 0.09 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1mtl h LYS 95 CO -0.13 0.50 -0.36 0.82 -0.57 0.00 0.00 179.45 179.71 1mtl h ILE 96 N 0.77 1.14 -0.01 1.86 1.08 -0.51 -1.16 117.51 120.69 1mtl h ILE 96 Ca 0.29 -1.30 -0.15 0.00 -0.39 0.00 0.00 64.86 63.31 1mtl h ILE 96 Cb 0.11 1.73 -0.02 0.00 -3.07 0.00 0.00 36.82 35.57 1mtl h ILE 96 CO -0.15 0.36 -0.69 -0.33 -0.69 0.00 0.00 178.15 176.65 1mtl h GLU 97 N 0.00 0.03 0.00 2.37 5.08 0.10 0.28 114.58 122.44 1mtl h GLU 97 Ca -0.00 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1mtl h GLU 97 Cb 0.70 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.95 1mtl h GLU 97 CO 0.05 0.71 0.00 -3.47 -1.00 0.00 0.00 179.01 175.30 1mtl n ASP 98 N -3.73 0.00 0.08 1.42 -0.08 0.40 -4.06 116.55 110.58 1mtl n ASP 98 Ca -0.01 0.71 0.13 0.00 -1.51 0.00 0.00 54.79 54.11 1mtl n ASP 98 Cb 0.68 -0.39 0.45 0.00 2.34 0.00 0.00 41.12 44.20 1mtl n ASP 98 CO 0.00 0.00 0.00 -1.22 0.12 0.00 0.00 177.20 176.10 1mtl n TYR 99 N -1.67 0.69 -0.81 -0.67 4.02 -0.54 -4.98 117.16 113.21 1mtl n TYR 99 Ca 0.00 0.20 0.00 0.00 -0.01 0.00 0.00 57.90 58.09 1mtl n TYR 99 Cb 0.00 -0.82 0.00 0.00 -0.02 0.00 0.00 39.34 38.50 1mtl n TYR 99 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1mtl n GLN 100 N -2.07 0.00 -1.77 -0.72 10.64 0.97 -4.25 117.38 120.18 1mtl n GLN 100 Ca 0.06 0.00 -0.30 0.00 -1.83 0.00 0.00 57.00 54.93 1mtl n GLN 100 Cb 0.41 0.00 0.17 0.00 -0.86 0.00 0.00 30.24 29.96 1mtl n GLN 100 CO 0.00 0.00 0.00 -1.25 -1.83 0.00 0.00 177.06 173.98 1mtl s PRO 101 N 0.00 0.65 0.21 2.61 0.04 -1.26 -4.73 135.00 132.52 1mtl s PRO 101 Ca 0.00 -0.20 -0.09 0.00 0.04 0.00 0.00 61.00 60.75 1mtl s PRO 101 Cb 0.00 -1.83 0.15 0.00 0.04 0.00 0.00 34.50 32.87 1mtl s PRO 101 CO 0.00 -2.44 1.80 1.96 0.04 0.00 0.00 177.00 178.36 1mtl h GLN 102 N -1.66 1.12 -3.07 4.56 4.20 -1.35 -3.37 115.11 115.54 1mtl h GLN 102 Ca -0.45 -0.17 -0.11 0.00 0.06 0.00 0.00 58.65 57.98 1mtl h GLN 102 Cb 1.27 -0.20 -0.19 0.00 0.30 0.00 0.00 27.48 28.66 1mtl h GLN 102 CO 0.45 0.87 -0.24 0.00 -0.67 0.00 0.00 178.83 179.23 1mtl s ALA 103 N -5.70 -0.80 -0.09 3.87 0.00 -0.51 -2.01 121.76 116.52 1mtl s ALA 103 Ca -0.13 0.27 0.03 0.00 0.00 0.00 0.00 51.96 52.13 1mtl s ALA 103 Cb 0.15 0.15 -0.01 0.00 0.00 0.00 0.00 23.12 23.42 1mtl s ALA 103 CO 0.82 -0.32 -0.19 -1.17 0.00 0.00 0.00 175.76 174.90 1mtl s LEU 104 N -1.56 2.38 -0.16 0.00 2.96 -0.25 -1.69 118.68 120.35 1mtl s LEU 104 Ca -0.11 -0.42 0.01 0.00 -0.22 0.00 0.00 54.13 53.39 1mtl s LEU 104 Cb -0.04 -1.49 0.02 0.00 0.50 0.00 0.00 46.19 45.18 1mtl s LEU 104 CO 0.02 0.21 -0.20 0.00 -1.32 0.00 0.00 176.35 175.06 1mtl s ALA 105 N 0.08 2.21 -0.23 5.97 0.00 -0.50 0.11 121.76 129.41 1mtl s ALA 105 Ca -0.09 -1.11 -0.14 0.00 0.00 0.00 0.00 51.96 50.62 1mtl s ALA 105 Cb -0.15 -1.08 -0.04 0.00 0.00 0.00 0.00 23.12 21.84 1mtl s ALA 105 CO 0.05 -0.23 0.32 0.42 0.00 0.00 0.00 175.76 176.32 1mtl s ILE 106 N 1.14 5.24 -1.41 0.00 -1.09 0.21 -0.07 121.20 125.22 1mtl s ILE 106 Ca 0.00 0.52 -0.09 0.00 -2.23 0.00 0.00 60.65 58.85 1mtl s ILE 106 Cb -0.14 -3.65 0.06 0.00 -1.58 0.00 0.00 42.46 37.15 1mtl s ILE 106 CO -0.08 0.26 2.39 0.18 -1.23 0.00 0.00 174.94 176.46 1mtl n LEU 107 N 4.57 7.72 0.00 2.97 4.77 -0.51 -0.78 117.00 135.73 1mtl n LEU 107 Ca -0.10 -4.58 0.00 0.00 -0.03 0.00 0.00 56.01 51.30 1mtl n LEU 107 Cb 0.51 -1.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.12 1mtl n LEU 107 CO 0.38 1.75 0.00 0.61 -1.33 0.00 0.00 177.39 178.80 1mtl n GLY 108 N 2.84 2.87 0.22 -0.72 0.00 -0.69 -3.78 105.19 105.93 1mtl n GLY 108 Ca 0.60 0.11 -0.08 0.00 0.00 0.00 0.00 46.02 46.65 1mtl n GLY 108 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1mtl h LYS 109 N 0.00 -0.49 -0.35 1.61 3.64 -1.87 -2.49 116.57 116.63 1mtl h LYS 109 Ca 0.00 0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.45 1mtl h LYS 109 Cb 0.00 0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1mtl h LYS 109 CO 0.00 -0.33 0.23 1.96 -2.27 0.00 0.00 179.45 179.05 1mtl h GLN 110 N -0.87 0.32 -0.48 1.90 4.20 -1.98 0.85 115.11 119.04 1mtl h GLN 110 Ca -0.05 -0.02 -0.09 0.00 0.06 0.00 0.00 58.65 58.54 1mtl h GLN 110 Cb 0.39 -0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 1mtl h GLN 110 CO 0.09 0.21 -0.07 0.00 -0.67 0.00 0.00 178.83 178.38 1mtl h ALA 111 N 1.80 0.96 -0.09 3.87 0.00 -1.95 -0.58 119.26 123.27 1mtl h ALA 111 Ca 0.14 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 1mtl h ALA 111 Cb 0.16 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1mtl h ALA 111 CO -0.03 0.62 -0.26 -0.92 0.00 0.00 0.00 179.25 178.65 1mtl h TYR 112 N 0.78 0.44 -0.57 0.00 3.20 -0.65 0.02 116.97 120.19 1mtl h TYR 112 Ca 0.14 -0.18 0.12 0.00 3.14 0.00 0.00 58.73 61.95 1mtl h TYR 112 Cb 0.58 -0.08 -0.10 0.00 1.54 0.00 0.00 36.73 38.67 1mtl h TYR 112 CO 0.03 0.88 -0.01 0.93 -1.64 0.00 0.00 178.16 178.35 1mtl h GLU 113 N -0.12 0.11 0.00 1.82 5.08 -0.73 -0.89 114.58 119.85 1mtl h GLU 113 Ca -0.01 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1mtl h GLU 113 Cb 0.88 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.11 1mtl h GLU 113 CO 0.06 0.07 0.00 1.04 -1.00 0.00 0.00 179.01 179.18 1mtl n GLN 114 N -5.27 0.00 -0.51 2.33 6.02 -0.24 -0.45 117.38 119.25 1mtl n GLN 114 Ca 0.08 0.18 0.41 0.00 -0.01 0.00 0.00 57.00 57.65 1mtl n GLN 114 Cb 0.32 -0.88 0.62 0.00 1.02 0.00 0.00 30.24 31.33 1mtl n GLN 114 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1mtl n GLY 115 N 1.15 -0.79 0.52 1.08 0.00 -0.01 0.14 105.19 107.28 1mtl n GLY 115 Ca 0.00 0.53 0.07 0.00 0.00 0.00 0.00 46.02 46.62 1mtl n GLY 115 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1mtl n PHE 116 N -3.46 0.49 -4.23 1.61 3.01 -0.34 -4.05 117.46 110.48 1mtl n PHE 116 Ca 0.34 -0.78 -0.34 0.00 1.01 0.00 0.00 57.45 57.67 1mtl n PHE 116 Cb 1.61 -0.18 -0.05 0.00 -0.01 0.00 0.00 39.48 40.86 1mtl n PHE 116 CO 0.00 0.00 0.00 0.43 1.01 0.00 0.00 176.76 178.20 1mtl n SER 117 N -0.53 -1.73 -4.86 4.37 7.64 0.38 -4.97 113.62 113.92 1mtl n SER 117 Ca 0.15 -1.09 -0.22 0.00 1.01 0.00 0.00 58.87 58.72 1mtl n SER 117 Cb 0.65 -2.45 -0.03 0.00 -1.01 0.00 0.00 64.21 61.37 1mtl n SER 117 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 1mtl s GLN 118 N -6.97 2.44 -0.01 1.43 -1.52 0.40 -5.02 119.66 110.41 1mtl s GLN 118 Ca 0.48 -1.65 -0.20 0.00 -1.95 0.00 0.00 55.36 52.04 1mtl s GLN 118 Cb -0.27 -2.28 0.04 0.00 -0.22 0.00 0.00 33.01 30.29 1mtl s GLN 118 CO 0.95 -0.24 0.43 1.03 -0.25 0.00 0.00 175.29 177.21 1mtl s ARG 119 N -4.11 0.84 -1.50 2.91 0.52 -1.26 -4.42 118.95 111.93 1mtl s ARG 119 Ca 0.45 -0.13 0.00 0.00 -0.52 0.00 0.00 55.73 55.53 1mtl s ARG 119 Cb -0.02 0.38 0.00 0.00 0.52 0.00 0.00 34.95 35.83 1mtl s ARG 119 CO 0.26 -0.26 0.00 0.41 0.02 0.00 0.00 175.30 175.73 1mtl n GLY 120 N 0.95 1.09 3.77 -3.53 0.00 -1.26 -4.95 105.19 101.25 1mtl n GLY 120 Ca -0.20 -0.31 -0.39 0.00 0.00 0.00 0.00 46.02 45.12 1mtl n GLY 120 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1mtl s ALA 121 N -2.60 3.21 0.21 4.61 0.00 -1.26 -5.04 121.76 120.89 1mtl s ALA 121 Ca 0.00 1.13 0.07 0.00 0.00 0.00 0.00 51.96 53.16 1mtl s ALA 121 Cb 0.00 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.64 1mtl s ALA 121 CO 0.00 -0.71 0.07 -0.65 0.00 0.00 0.00 175.76 174.46 1mtl s GLN 122 N -2.26 2.58 0.86 0.00 -1.52 -1.26 -5.02 119.66 113.04 1mtl s GLN 122 Ca 0.57 -1.11 -0.13 0.00 -1.95 0.00 0.00 55.36 52.74 1mtl s GLN 122 Cb -0.35 -2.42 0.06 0.00 -0.22 0.00 0.00 33.01 30.08 1mtl s GLN 122 CO 0.45 0.43 0.82 0.91 -0.25 0.00 0.00 175.29 177.65 1mtl n TRP 123 N -0.53 -0.03 -0.52 0.91 7.02 -1.26 -4.80 117.44 118.23 1mtl n TRP 123 Ca -0.08 0.34 0.00 0.00 -1.02 0.00 0.00 57.50 56.74 1mtl n TRP 123 Cb 0.56 -1.95 0.00 0.00 -2.42 0.00 0.00 31.31 27.50 1mtl n TRP 123 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1mtl n GLY 124 N 1.00 -0.22 3.75 6.99 0.00 -0.28 -4.95 105.19 111.48 1mtl n GLY 124 Ca 0.10 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.97 1mtl n GLY 124 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1mtl s LYS 125 N 0.00 4.55 0.36 1.61 2.20 -1.26 -1.01 119.74 126.18 1mtl s LYS 125 Ca 0.00 1.87 0.07 0.00 -0.36 0.00 0.00 55.97 57.56 1mtl s LYS 125 Cb 0.00 -3.20 -0.02 0.00 -1.51 0.00 0.00 37.83 33.10 1mtl s LYS 125 CO 0.00 0.05 0.33 -0.65 -0.36 0.00 0.00 175.35 174.72 1mtl s GLN 126 N -1.01 2.71 -0.09 4.03 -1.52 -0.14 -4.93 119.66 118.72 1mtl s GLN 126 Ca 0.48 -1.33 0.14 0.00 -1.95 0.00 0.00 55.36 52.70 1mtl s GLN 126 Cb -0.33 -2.48 -0.24 0.00 -0.22 0.00 0.00 33.01 29.74 1mtl s GLN 126 CO 0.41 0.02 0.49 0.25 -0.25 0.00 0.00 175.29 176.21 1mtl n THR 127 N -1.44 1.55 -1.64 -0.19 -2.24 -1.26 -4.57 114.28 104.49 1mtl n THR 127 Ca -0.00 -0.81 -0.37 0.00 -2.27 0.00 0.00 64.05 60.60 1mtl n THR 127 Cb 0.60 -0.90 0.07 0.00 -2.10 0.00 0.00 70.33 68.01 1mtl n THR 127 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1mtl n LEU 128 N -2.97 5.57 -4.12 3.22 7.94 -1.26 -4.95 117.00 120.42 1mtl n LEU 128 Ca -0.22 0.80 -0.12 0.00 -1.11 0.00 0.00 56.01 55.36 1mtl n LEU 128 Cb 1.08 -1.53 -0.08 0.00 0.53 0.00 0.00 43.42 43.42 1mtl n LEU 128 CO 0.44 -1.19 -0.05 0.42 -1.11 0.00 0.00 177.39 175.90 1mtl s THR 129 N -1.49 0.00 -0.40 1.96 -4.23 -1.26 -3.71 115.64 106.51 1mtl s THR 129 Ca 0.81 -1.75 0.01 0.00 -1.18 0.00 0.00 61.69 59.58 1mtl s THR 129 Cb -0.37 -2.41 0.12 0.00 1.34 0.00 0.00 72.50 71.18 1mtl s THR 129 CO 0.42 0.00 0.19 -0.63 -0.54 0.00 0.00 174.62 174.06 1mtl s ILE 130 N -3.95 1.32 0.00 2.99 1.01 -0.97 -5.00 121.20 116.60 1mtl s ILE 130 Ca 0.33 -2.26 0.00 0.00 0.00 0.00 0.00 60.65 58.72 1mtl s ILE 130 Cb 0.03 -1.94 0.00 0.00 0.01 0.00 0.00 42.46 40.56 1mtl s ILE 130 CO 0.13 -0.83 0.00 0.61 0.00 0.00 0.00 174.94 174.85 1mtl n GLY 131 N 3.91 1.97 0.11 6.18 0.00 -1.26 -1.95 105.19 114.14 1mtl n GLY 131 Ca 0.06 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.71 1mtl n GLY 131 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1mtl h SER 132 N 4.77 0.00 -3.12 1.61 4.64 -1.94 -3.46 113.55 116.04 1mtl h SER 132 Ca 0.00 -0.09 -0.54 0.00 -0.47 0.00 0.00 61.79 60.70 1mtl h SER 132 Cb 0.00 0.00 0.08 0.00 -0.31 0.00 0.00 62.40 62.17 1mtl h SER 132 CO 0.00 0.04 0.88 0.41 -0.87 0.00 0.00 176.83 177.29 1mtl n THR 133 N -2.39 0.85 -2.60 2.95 -1.04 -0.82 -4.94 114.28 106.29 1mtl n THR 133 Ca 0.04 -0.21 -0.28 0.00 -2.04 0.00 0.00 64.05 61.55 1mtl n THR 133 Cb 0.47 -1.92 -0.00 0.00 -1.82 0.00 0.00 70.33 67.05 1mtl n THR 133 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1mtl s GLN 134 N -0.23 3.58 -0.13 -2.82 -0.21 -0.85 -2.29 119.66 116.72 1mtl s GLN 134 Ca 0.66 0.29 0.02 0.00 0.02 0.00 0.00 55.36 56.35 1mtl s GLN 134 Cb -0.51 -2.35 -0.00 0.00 1.00 0.00 0.00 33.01 31.15 1mtl s GLN 134 CO 0.46 -0.22 -0.20 0.42 -2.12 0.00 0.00 175.29 173.64 1mtl s ILE 135 N -2.73 2.37 -0.03 1.08 1.01 -1.24 -1.10 121.20 120.56 1mtl s ILE 135 Ca 0.49 -0.89 0.05 0.00 0.00 0.00 0.00 60.65 60.29 1mtl s ILE 135 Cb -0.10 -1.95 -0.01 0.00 0.01 0.00 0.00 42.46 40.40 1mtl s ILE 135 CO 0.44 0.54 -0.16 0.26 0.00 0.00 0.00 174.94 176.01 1mtl s TRP 136 N 0.59 1.57 -0.30 3.97 0.52 0.12 -0.96 118.94 124.43 1mtl s TRP 136 Ca -0.11 -0.38 -0.06 0.00 0.02 0.00 0.00 56.10 55.56 1mtl s TRP 136 Cb -0.16 -1.04 0.02 0.00 -1.15 0.00 0.00 33.47 31.13 1mtl s TRP 136 CO 0.03 -0.10 0.07 0.08 0.02 0.00 0.00 176.95 177.05 1mtl s VAL 137 N -0.13 3.79 0.15 4.03 1.01 -0.18 0.67 120.40 129.74 1mtl s VAL 137 Ca 0.01 -0.84 0.11 0.00 0.00 0.00 0.00 61.98 61.25 1mtl s VAL 137 Cb -0.09 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.24 1mtl s VAL 137 CO 0.01 0.03 -0.25 -0.76 0.00 0.00 0.00 175.10 174.12 1mtl s LEU 138 N 1.45 2.38 0.18 3.92 1.43 0.04 -1.12 118.68 126.96 1mtl s LEU 138 Ca 0.01 -0.79 -0.30 0.00 -1.03 0.00 0.00 54.13 52.02 1mtl s LEU 138 Cb -0.18 -1.21 -0.08 0.00 0.03 0.00 0.00 46.19 44.74 1mtl s LEU 138 CO 0.02 0.16 1.33 -2.16 0.23 0.00 0.00 176.35 175.92 1mtl s PRO 139 N -2.31 4.37 0.42 1.29 0.04 -1.26 -1.70 135.00 135.86 1mtl s PRO 139 Ca 0.17 2.06 -0.26 0.00 0.04 0.00 0.00 61.00 63.00 1mtl s PRO 139 Cb -0.09 -3.21 -0.09 0.00 0.04 0.00 0.00 34.50 31.15 1mtl s PRO 139 CO 0.08 -0.30 1.42 1.21 0.04 0.00 0.00 177.00 179.45 1mtl s ASN 140 N 0.54 6.07 0.02 6.66 2.47 -1.25 -4.84 114.94 124.61 1mtl s ASN 140 Ca 0.59 2.91 0.27 0.00 0.42 0.00 0.00 52.86 57.05 1mtl s ASN 140 Cb -0.36 -2.66 0.85 0.00 -1.45 0.00 0.00 41.25 37.63 1mtl s ASN 140 CO 0.36 -1.05 1.67 -0.81 -3.72 0.00 0.00 177.10 173.55 1mtl n PRO 141 N 0.03 0.03 -1.17 0.43 -0.05 -1.26 -4.79 135.00 128.23 1mtl n PRO 141 Ca 0.04 0.02 -0.38 0.00 -0.05 0.00 0.00 63.50 63.13 1mtl n PRO 141 Cb 0.41 -1.53 0.02 0.00 -0.05 0.00 0.00 33.50 32.36 1mtl n PRO 141 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 175.50 175.90 1mtl n SER 142 N -1.58 -4.23 0.05 3.54 2.88 -1.26 -1.73 113.62 111.29 1mtl n SER 142 Ca 0.06 0.50 0.10 0.00 -1.33 0.00 0.00 58.87 58.20 1mtl n SER 142 Cb 0.35 -0.85 0.42 0.00 -0.75 0.00 0.00 64.21 63.38 1mtl n SER 142 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1mtl n GLY 143 N 2.75 -1.24 0.44 0.46 0.00 -0.82 -2.41 105.19 104.39 1mtl n GLY 143 Ca 0.05 -0.02 0.13 0.00 0.00 0.00 0.00 46.02 46.18 1mtl n GLY 143 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1mtl n LEU 144 N -1.77 1.50 -4.56 0.99 4.77 -1.26 -4.81 117.00 111.86 1mtl n LEU 144 Ca 0.04 -0.48 -0.43 0.00 -0.03 0.00 0.00 56.01 55.11 1mtl n LEU 144 Cb 0.24 -0.04 -0.04 0.00 -2.33 0.00 0.00 43.42 41.25 1mtl n LEU 144 CO 0.19 0.26 0.69 -0.55 -1.33 0.00 0.00 177.39 176.65 1mtl s SER 145 N -2.20 6.50 0.00 -1.43 0.15 -1.01 -4.91 113.70 110.79 1mtl s SER 145 Ca 0.31 0.12 0.01 0.00 0.70 0.00 0.00 55.95 57.10 1mtl s SER 145 Cb 0.20 -2.43 0.09 0.00 -1.71 0.00 0.00 66.02 62.17 1mtl s SER 145 CO 0.41 -0.97 0.37 0.54 1.20 0.00 0.00 173.24 174.78 1mtl n ARG 146 N 6.96 0.10 -2.15 5.44 1.74 -1.26 -4.75 116.66 122.74 1mtl n ARG 146 Ca 0.05 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.72 1mtl n ARG 146 Cb 0.48 -1.24 -0.02 0.00 -1.02 0.00 0.00 32.46 30.66 1mtl n ARG 146 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1mtl s VAL 147 N -2.00 2.78 0.49 1.55 1.01 -1.26 -4.99 120.40 117.99 1mtl s VAL 147 Ca 0.02 0.79 -0.18 0.00 0.00 0.00 0.00 61.98 62.61 1mtl s VAL 147 Cb 0.01 -3.50 -0.09 0.00 0.00 0.00 0.00 36.38 32.80 1mtl s VAL 147 CO 0.02 0.19 0.98 -0.94 0.00 0.00 0.00 175.10 175.35 1mtl s SER 148 N -0.50 6.63 0.28 3.32 1.04 -1.26 -4.91 113.70 118.31 1mtl s SER 148 Ca 0.49 1.67 0.02 0.00 0.48 0.00 0.00 55.95 58.60 1mtl s SER 148 Cb -0.39 -2.53 0.64 0.00 0.10 0.00 0.00 66.02 63.84 1mtl s SER 148 CO 0.52 -0.58 1.73 0.25 0.98 0.00 0.00 173.24 176.13 1mtl h LEU 149 N 1.28 0.43 -0.04 2.42 5.85 -1.96 -0.60 115.31 122.68 1mtl h LEU 149 Ca -0.48 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.37 1mtl h LEU 149 Cb 1.19 0.07 -0.00 0.00 0.37 0.00 0.00 40.66 42.29 1mtl h LEU 149 CO 0.61 0.10 0.02 -0.08 -0.34 0.00 0.00 178.44 178.75 1mtl h GLU 150 N 0.51 0.05 -0.44 1.25 4.81 -1.99 -0.80 114.58 117.96 1mtl h GLU 150 Ca 0.51 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.76 1mtl h GLU 150 Cb 0.87 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.22 1mtl h GLU 150 CO -0.45 0.13 0.30 -0.22 -0.73 0.00 0.00 179.01 178.04 1mtl h LYS 151 N -0.04 0.53 0.27 1.92 3.64 -1.53 -0.48 116.57 120.88 1mtl h LYS 151 Ca 0.01 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 59.35 1mtl h LYS 151 Cb 0.09 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 1mtl h LYS 151 CO -0.00 0.35 -0.13 1.25 -2.27 0.00 0.00 179.45 178.65 1mtl h LEU 152 N 0.54 -0.31 -0.78 5.20 5.85 -0.80 -1.26 115.31 123.76 1mtl h LEU 152 Ca 0.17 -0.14 0.01 0.00 0.84 0.00 0.00 57.88 58.76 1mtl h LEU 152 Cb 0.02 0.08 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 1mtl h LEU 152 CO -0.04 -0.02 0.51 0.58 -0.34 0.00 0.00 178.44 179.13 1mtl h VAL 153 N -0.60 1.18 -0.54 1.05 2.07 -0.41 -0.52 116.25 118.48 1mtl h VAL 153 Ca -0.04 -0.35 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 1mtl h VAL 153 Cb 0.43 0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1mtl h VAL 153 CO 0.06 0.19 0.11 -0.08 0.02 0.00 0.00 177.57 177.87 1mtl h GLU 154 N 1.03 0.83 -0.08 1.57 4.81 -1.05 0.12 114.58 121.81 1mtl h GLU 154 Ca 0.29 -0.18 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 1mtl h GLU 154 Cb -0.08 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 29.17 1mtl h GLU 154 CO -0.08 0.76 -0.06 0.00 -0.73 0.00 0.00 179.01 178.90 1mtl h ALA 155 N 1.33 0.11 -0.42 2.92 0.00 -0.03 -2.69 119.26 120.47 1mtl h ALA 155 Ca 0.17 -0.27 -0.12 0.00 0.00 0.00 0.00 54.91 54.69 1mtl h ALA 155 Cb 0.32 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1mtl h ALA 155 CO 0.00 -0.09 -0.22 1.88 0.00 0.00 0.00 179.25 180.82 1mtl h TYR 156 N -0.24 0.97 -0.58 0.00 -1.99 -1.04 -2.97 116.97 111.12 1mtl h TYR 156 Ca 0.01 -0.23 0.09 0.00 2.00 0.00 0.00 58.73 60.61 1mtl h TYR 156 Cb 0.56 -0.23 -0.07 0.00 2.00 0.00 0.00 36.73 38.99 1mtl h TYR 156 CO 0.08 0.99 0.19 -0.09 -0.00 0.00 0.00 178.16 179.33 1mtl h ARG 157 N 0.74 0.34 -0.49 4.88 2.43 -0.74 -0.77 114.38 120.76 1mtl h ARG 157 Ca 0.10 -0.02 0.09 0.00 -0.81 0.00 0.00 59.98 59.33 1mtl h ARG 157 Cb 0.76 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 30.16 1mtl h ARG 157 CO 0.06 0.22 0.08 0.93 -1.51 0.00 0.00 179.97 179.76 1mtl h GLU 158 N 0.35 0.21 0.07 0.20 5.08 -1.31 0.90 114.58 120.07 1mtl h GLU 158 Ca 0.29 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.66 1mtl h GLU 158 Cb 0.37 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.55 1mtl h GLU 158 CO -0.32 0.14 -0.19 1.25 -1.00 0.00 0.00 179.01 178.89 1mtl h LEU 159 N 0.21 -0.52 -0.75 1.33 5.85 -1.16 -0.17 115.31 120.10 1mtl h LEU 159 Ca 0.25 0.07 0.13 0.00 0.84 0.00 0.00 57.88 59.16 1mtl h LEU 159 Cb 0.34 0.21 -0.09 0.00 0.37 0.00 0.00 40.66 41.49 1mtl h LEU 159 CO -0.34 -0.26 0.32 -0.78 -0.34 0.00 0.00 178.44 177.04 1mtl h ASP 160 N -0.34 0.34 -0.03 1.25 -0.00 -0.02 -1.32 116.42 116.30 1mtl h ASP 160 Ca 0.04 0.10 -0.00 0.00 -0.00 0.00 0.00 57.03 57.16 1mtl h ASP 160 Cb 0.37 0.06 -0.00 0.00 -0.00 0.00 0.00 39.33 39.76 1mtl h ASP 160 CO -0.13 0.15 0.01 1.56 -0.00 0.00 0.00 179.24 180.83 1mtl h GLN 161 N 0.49 0.05 -0.50 0.28 1.08 -0.39 -2.83 115.11 113.28 1mtl h GLN 161 Ca 0.40 -0.01 0.15 0.00 -1.45 0.00 0.00 58.65 57.74 1mtl h GLN 161 Cb 0.56 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.97 1mtl h GLN 161 CO -0.37 0.19 0.44 0.00 -0.95 0.00 0.00 178.83 178.14 1mtl h ALA 162 N 0.86 2.32 -1.23 3.87 0.00 0.10 -3.11 119.26 122.07 1mtl h ALA 162 Ca 0.01 -0.02 -0.78 0.00 0.00 0.00 0.00 54.91 54.13 1mtl h ALA 162 Cb 0.16 0.04 -0.20 0.00 0.00 0.00 0.00 17.79 17.79 1mtl h ALA 162 CO -0.00 -0.70 1.60 1.28 0.00 0.00 0.00 179.25 181.43 1mtl n LEU 163 N -4.01 6.82 0.00 0.00 4.77 -0.90 -5.10 117.00 118.58 1mtl n LEU 163 Ca 0.09 -4.92 0.00 0.00 -0.03 0.00 0.00 56.01 51.15 1mtl n LEU 163 Cb 0.65 -1.37 0.00 0.00 -2.33 0.00 0.00 43.42 40.36 1mtl n LEU 163 CO 0.32 1.62 0.00 0.52 -1.33 0.00 0.00 177.39 178.52