#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cfm h PRO 2 N 0.00 0.01 0.00 -0.72 0.11 -1.89 -0.41 132.00 129.10 1cfm h PRO 2 Ca 0.00 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.07 1cfm h PRO 2 Cb 0.00 -0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.10 1cfm h PRO 2 CO 0.00 0.01 -0.20 -0.24 -0.21 0.00 0.00 178.00 177.36 1cfm h VAL 3 N 0.01 0.75 -0.45 3.15 3.04 -1.98 -1.53 116.25 119.24 1cfm h VAL 3 Ca 0.04 -0.81 -0.10 0.00 -1.01 0.00 0.00 66.70 64.82 1cfm h VAL 3 Cb 0.15 1.50 -0.02 0.00 -2.01 0.00 0.00 31.29 30.91 1cfm h VAL 3 CO -0.00 0.20 -0.12 -0.26 -1.01 0.00 0.00 177.57 176.37 1cfm h PHE 4 N 0.00 0.90 -0.06 3.17 0.04 -1.50 -0.44 116.94 119.06 1cfm h PHE 4 Ca -0.00 -0.17 -0.01 0.00 2.80 0.00 0.00 57.97 60.59 1cfm h PHE 4 Cb 0.48 -0.23 -0.00 0.00 2.20 0.00 0.00 35.95 38.40 1cfm h PHE 4 CO 0.00 0.88 -0.00 0.00 -0.60 0.00 0.00 178.31 178.59 1cfm h ALA 5 N 1.13 0.08 -0.53 2.45 0.00 -1.27 -1.91 119.26 119.20 1cfm h ALA 5 Ca 0.12 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 54.92 1cfm h ALA 5 Cb 0.61 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 1cfm h ALA 5 CO 0.04 -0.24 0.20 1.96 0.00 0.00 0.00 179.25 181.21 1cfm h GLN 6 N -0.20 0.38 0.00 0.00 4.20 -1.13 0.49 115.11 118.85 1cfm h GLN 6 Ca 0.02 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.70 1cfm h GLN 6 Cb 0.35 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1cfm h GLN 6 CO 0.00 0.25 0.00 1.96 -0.67 0.00 0.00 178.83 180.37 1cfm h GLN 7 N 0.39 0.00 0.00 1.46 4.20 -1.06 -3.36 115.11 116.74 1cfm h GLN 7 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 1cfm h GLN 7 Cb 0.26 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1cfm h GLN 7 CO -0.24 0.00 -0.69 0.09 -0.67 0.00 0.00 178.83 177.31 1cfm n ASN 8 N -3.05 2.17 -3.85 1.46 3.02 -0.72 -4.98 115.26 109.31 1cfm n ASN 8 Ca 0.03 -0.29 -0.27 0.00 -0.03 0.00 0.00 54.58 54.02 1cfm n ASN 8 Cb 0.42 1.09 -0.17 0.00 -0.61 0.00 0.00 39.78 40.52 1cfm n ASN 8 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1cfm s TYR 9 N -1.83 1.37 0.29 3.10 2.02 0.17 -5.01 117.35 117.46 1cfm s TYR 9 Ca -0.00 -0.80 -0.01 0.00 -0.37 0.00 0.00 57.07 55.89 1cfm s TYR 9 Cb 0.03 -1.16 0.44 0.00 -0.40 0.00 0.00 41.96 40.87 1cfm s TYR 9 CO 0.16 -0.54 1.88 0.00 -1.57 0.00 0.00 175.55 175.48 1cfm h ALA 10 N 8.19 1.30 -3.09 3.71 0.00 -1.84 -3.40 119.26 124.13 1cfm h ALA 10 Ca -0.24 -0.16 -0.64 0.00 0.00 0.00 0.00 54.91 53.88 1cfm h ALA 10 Cb 1.12 -0.24 -0.35 0.00 0.00 0.00 0.00 17.79 18.31 1cfm h ALA 10 CO 0.37 0.52 -0.85 1.21 0.00 0.00 0.00 179.25 180.50 1cfm s ASN 11 N -6.52 2.94 0.00 0.00 3.84 -1.26 -5.02 114.94 108.91 1cfm s ASN 11 Ca -0.10 -0.58 0.13 0.00 0.21 0.00 0.00 52.86 52.53 1cfm s ASN 11 Cb 0.16 -1.35 0.67 0.00 -0.55 0.00 0.00 41.25 40.18 1cfm s ASN 11 CO 0.79 -0.02 1.35 -0.81 -2.79 0.00 0.00 177.10 175.63 1cfm n PRO 12 N 4.67 0.18 -4.03 0.43 -0.04 -1.26 -4.63 135.00 130.32 1cfm n PRO 12 Ca -0.19 0.16 -0.27 0.00 -0.04 0.00 0.00 63.50 63.16 1cfm n PRO 12 Cb 0.50 -1.50 -0.17 0.00 -0.04 0.00 0.00 33.50 32.29 1cfm n PRO 12 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 1cfm s ARG 13 N -2.59 1.75 0.82 0.54 3.52 -1.26 -1.09 118.95 120.63 1cfm s ARG 13 Ca 0.12 -0.35 -0.12 0.00 -0.13 0.00 0.00 55.73 55.26 1cfm s ARG 13 Cb 0.09 -1.70 0.08 0.00 -1.56 0.00 0.00 34.95 31.87 1cfm s ARG 13 CO 0.21 -0.22 1.11 -1.21 -0.81 0.00 0.00 175.30 174.38 1cfm s GLU 14 N 1.52 1.90 0.28 5.12 2.02 0.46 -4.89 118.70 125.11 1cfm s GLU 14 Ca 0.02 0.49 0.01 0.00 0.02 0.00 0.00 54.97 55.52 1cfm s GLU 14 Cb -0.13 -1.91 0.55 0.00 0.10 0.00 0.00 34.13 32.74 1cfm s GLU 14 CO -0.07 -1.72 1.82 0.00 0.02 0.00 0.00 175.26 175.32 1cfm h ALA 15 N -1.15 1.48 0.00 5.21 0.00 -1.99 0.21 119.26 123.01 1cfm h ALA 15 Ca -0.48 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1cfm h ALA 15 Cb 1.29 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.90 1cfm h ALA 15 CO 0.61 0.18 0.00 0.27 0.00 0.00 0.00 179.25 180.30 1cfm n ASN 16 N -4.66 0.00 0.00 0.00 6.94 -1.26 -4.85 115.26 111.43 1cfm n ASN 16 Ca 0.19 -0.27 0.00 0.00 -0.02 0.00 0.00 54.58 54.48 1cfm n ASN 16 Cb 0.37 -0.16 0.00 0.00 -2.36 0.00 0.00 39.78 37.62 1cfm n ASN 16 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cfm n GLY 17 N 0.32 0.72 3.73 4.83 0.00 0.73 -5.05 105.19 110.48 1cfm n GLY 17 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 1cfm n GLY 17 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1cfm s ARG 18 N -0.64 4.61 -0.12 1.61 3.52 -1.26 -4.72 118.95 121.95 1cfm s ARG 18 Ca 0.00 1.64 -0.19 0.00 -0.13 0.00 0.00 55.73 57.06 1cfm s ARG 18 Cb 0.00 -3.31 -0.04 0.00 -1.56 0.00 0.00 34.95 30.04 1cfm s ARG 18 CO 0.00 0.09 0.50 0.42 -0.81 0.00 0.00 175.30 175.50 1cfm s ILE 19 N -0.07 5.17 0.47 4.11 1.01 -1.26 -0.40 121.20 130.23 1cfm s ILE 19 Ca 0.49 0.99 0.10 0.00 0.00 0.00 0.00 60.65 62.23 1cfm s ILE 19 Cb -0.28 -3.83 0.10 0.00 0.01 0.00 0.00 42.46 38.46 1cfm s ILE 19 CO 0.33 0.31 1.24 -0.37 0.00 0.00 0.00 174.94 176.44 1cfm h VAL 20 N 4.76 0.00 -0.57 2.92 -1.51 -1.43 -0.67 116.25 119.74 1cfm h VAL 20 Ca -0.40 0.00 0.01 0.00 -1.23 0.00 0.00 66.70 65.08 1cfm h VAL 20 Cb 1.18 0.23 -0.03 0.00 -2.13 0.00 0.00 31.29 30.53 1cfm h VAL 20 CO 0.75 0.00 0.38 0.00 -1.23 0.00 0.00 177.57 177.47 1cfm n ALA 22 N -2.45 1.25 0.74 0.00 0.00 -0.26 -1.37 120.51 118.41 1cfm n ALA 22 Ca 0.06 0.07 0.12 0.00 0.00 0.00 0.00 53.44 53.69 1cfm n ALA 22 Cb 0.08 -1.21 0.48 0.00 0.00 0.00 0.00 19.45 18.80 1cfm n ALA 22 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1cfm n ASN 23 N -1.88 0.17 0.00 0.00 3.02 -0.58 -4.04 115.26 111.94 1cfm n ASN 23 Ca 0.01 0.52 0.00 0.00 -0.03 0.00 0.00 54.58 55.08 1cfm n ASN 23 Cb 0.08 -0.57 0.00 0.00 -0.61 0.00 0.00 39.78 38.69 1cfm n ASN 23 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1cfm s HIS 25 N -0.97 3.80 -0.67 0.00 3.76 -0.47 -0.80 115.29 119.93 1cfm s HIS 25 Ca 0.00 -2.30 0.21 0.00 -0.15 0.00 0.00 55.06 52.82 1cfm s HIS 25 Cb 0.00 -3.68 0.87 0.00 1.11 0.00 0.00 32.58 30.87 1cfm s HIS 25 CO 0.00 -0.94 1.65 1.28 -0.85 0.00 0.00 174.74 175.87 1cfm n LEU 26 N 3.57 0.45 -4.69 0.89 4.77 -1.26 -4.53 117.00 116.20 1cfm n LEU 26 Ca 0.15 0.61 -0.36 0.00 -0.03 0.00 0.00 56.01 56.38 1cfm n LEU 26 Cb 0.44 -0.54 -0.09 0.00 -2.33 0.00 0.00 43.42 40.90 1cfm n LEU 26 CO 0.36 -0.43 -0.16 0.00 -1.33 0.00 0.00 177.39 175.83 1cfm s ALA 27 N -3.20 3.64 0.07 -1.18 0.00 -1.26 -5.03 121.76 114.80 1cfm s ALA 27 Ca 0.06 -0.77 -0.26 0.00 0.00 0.00 0.00 51.96 50.98 1cfm s ALA 27 Cb 0.10 -2.28 -0.06 0.00 0.00 0.00 0.00 23.12 20.88 1cfm s ALA 27 CO 0.37 -0.04 0.82 -1.14 0.00 0.00 0.00 175.76 175.76 1cfm s GLN 28 N 0.76 4.56 -0.14 0.00 0.74 -1.26 -0.21 119.66 124.11 1cfm s GLN 28 Ca 0.09 1.18 -0.05 0.00 0.05 0.00 0.00 55.36 56.62 1cfm s GLN 28 Cb -0.13 -3.36 0.07 0.00 1.10 0.00 0.00 33.01 30.69 1cfm s GLN 28 CO 0.02 0.28 0.29 0.21 -0.55 0.00 0.00 175.29 175.55 1cfm s LYS 29 N -0.11 0.18 0.46 1.67 2.20 -0.33 -4.74 119.74 119.07 1cfm s LYS 29 Ca 0.41 0.80 -0.22 0.00 -0.36 0.00 0.00 55.97 56.59 1cfm s LYS 29 Cb -0.21 0.03 -0.10 0.00 -1.51 0.00 0.00 37.83 36.04 1cfm s LYS 29 CO 0.25 -0.27 0.79 0.00 -0.36 0.00 0.00 175.35 175.76 1cfm n ALA 30 N 5.30 -0.54 -2.29 3.13 0.00 -1.26 -2.34 120.51 122.51 1cfm n ALA 30 Ca -0.07 0.15 -0.16 0.00 0.00 0.00 0.00 53.44 53.35 1cfm n ALA 30 Cb 0.50 -1.95 -0.10 0.00 0.00 0.00 0.00 19.45 17.90 1cfm n ALA 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1cfm s VAL 31 N -1.43 0.28 -0.00 0.00 -7.23 -1.26 -4.43 120.40 106.33 1cfm s VAL 31 Ca 0.66 -2.00 -0.08 0.00 -1.81 0.00 0.00 61.98 58.74 1cfm s VAL 31 Cb -0.54 -2.55 0.00 0.00 0.56 0.00 0.00 36.38 33.86 1cfm s VAL 31 CO 0.56 0.00 0.16 -1.61 -0.31 0.00 0.00 175.10 173.90 1cfm s GLU 32 N -3.96 0.50 -0.14 4.82 2.02 -0.61 -4.85 118.70 116.49 1cfm s GLU 32 Ca 0.38 -0.36 -0.12 0.00 0.02 0.00 0.00 54.97 54.89 1cfm s GLU 32 Cb 0.06 0.21 0.04 0.00 0.10 0.00 0.00 34.13 34.54 1cfm s GLU 32 CO 0.15 -0.12 0.37 -1.50 0.02 0.00 0.00 175.26 174.18 1cfm s ILE 33 N -1.34 -0.00 -0.02 -1.63 2.07 -1.26 -0.10 121.20 118.92 1cfm s ILE 33 Ca -0.14 0.01 0.01 0.00 -1.41 0.00 0.00 60.65 59.12 1cfm s ILE 33 Cb -0.07 -0.52 0.01 0.00 0.13 0.00 0.00 42.46 42.01 1cfm s ILE 33 CO 0.02 0.01 -0.02 -0.70 -1.91 0.00 0.00 174.94 172.33 1cfm s GLU 34 N 0.34 0.31 0.07 3.50 2.12 -0.37 -4.96 118.70 119.72 1cfm s GLU 34 Ca -0.01 -0.04 0.04 0.00 0.36 0.00 0.00 54.97 55.31 1cfm s GLU 34 Cb -0.03 -0.38 -0.03 0.00 0.26 0.00 0.00 34.13 33.95 1cfm s GLU 34 CO -0.01 -0.02 -0.11 0.14 -0.54 0.00 0.00 175.26 174.72 1cfm s VAL 35 N 0.40 0.87 0.96 3.70 -7.23 -1.26 -1.01 120.40 116.82 1cfm s VAL 35 Ca -0.04 -1.30 -0.11 0.00 -1.81 0.00 0.00 61.98 58.72 1cfm s VAL 35 Cb -0.07 -0.97 0.14 0.00 0.56 0.00 0.00 36.38 36.04 1cfm s VAL 35 CO -0.01 -0.36 0.93 -0.81 -0.31 0.00 0.00 175.10 174.55 1cfm n PRO 36 N 1.18 -0.69 0.22 4.82 -0.04 -1.26 -4.85 135.00 134.38 1cfm n PRO 36 Ca -0.21 -0.14 0.07 0.00 -0.04 0.00 0.00 63.50 63.18 1cfm n PRO 36 Cb 0.55 -2.22 0.48 0.00 -0.04 0.00 0.00 33.50 32.28 1cfm n PRO 36 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1cfm h GLN 37 N -1.92 0.00 -3.46 0.54 4.20 -1.96 -3.44 115.11 109.07 1cfm h GLN 37 Ca -0.45 0.00 -0.09 0.00 0.06 0.00 0.00 58.65 58.17 1cfm h GLN 37 Cb 1.28 0.00 -0.16 0.00 0.30 0.00 0.00 27.48 28.91 1cfm h GLN 37 CO 0.40 0.27 -0.26 0.00 -0.67 0.00 0.00 178.83 178.57 1cfm s ALA 38 N -4.05 -0.58 -0.01 3.87 0.00 -1.26 -0.38 121.76 119.34 1cfm s ALA 38 Ca -0.02 -0.18 -0.13 0.00 0.00 0.00 0.00 51.96 51.63 1cfm s ALA 38 Cb 0.13 0.42 0.02 0.00 0.00 0.00 0.00 23.12 23.69 1cfm s ALA 38 CO 0.66 -0.47 0.27 0.54 0.00 0.00 0.00 175.76 176.77 1cfm s VAL 39 N -3.07 0.06 0.61 0.00 0.11 -0.09 -4.89 120.40 113.13 1cfm s VAL 39 Ca -0.01 -0.53 -0.10 0.00 -2.93 0.00 0.00 61.98 58.40 1cfm s VAL 39 Cb 0.01 -0.59 -0.04 0.00 -1.53 0.00 0.00 36.38 34.24 1cfm s VAL 39 CO -0.07 -0.29 1.01 -0.76 -3.33 0.00 0.00 175.10 171.66 1cfm s LEU 40 N -1.37 3.25 0.75 2.54 1.43 -1.26 -0.95 118.68 123.07 1cfm s LEU 40 Ca -0.14 1.34 -0.15 0.00 -1.03 0.00 0.00 54.13 54.16 1cfm s LEU 40 Cb -0.06 -4.37 0.05 0.00 0.03 0.00 0.00 46.19 41.85 1cfm s LEU 40 CO 0.03 -0.87 1.24 -2.84 0.23 0.00 0.00 176.35 174.14 1cfm s PRO 41 N -5.14 1.97 -1.50 1.29 0.02 -1.26 -3.25 135.00 127.13 1cfm s PRO 41 Ca 0.54 1.87 -0.05 0.00 0.02 0.00 0.00 61.00 63.38 1cfm s PRO 41 Cb -0.11 -1.80 0.01 0.00 0.02 0.00 0.00 34.50 32.62 1cfm s PRO 41 CO 0.53 -1.99 0.11 -3.47 -0.33 0.00 0.00 177.00 171.85 1cfm n ASP 42 N -2.78 0.18 -4.22 2.53 2.03 -0.06 -4.94 116.55 109.28 1cfm n ASP 42 Ca 0.14 -1.27 -0.24 0.00 0.52 0.00 0.00 54.79 53.94 1cfm n ASP 42 Cb 0.50 -1.65 -0.14 0.00 -0.72 0.00 0.00 41.12 39.11 1cfm n ASP 42 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 1cfm s THR 43 N -4.25 1.50 -0.23 5.18 2.01 -1.20 -4.88 115.64 113.76 1cfm s THR 43 Ca 0.07 -1.13 -0.18 0.00 0.31 0.00 0.00 61.69 60.77 1cfm s THR 43 Cb -0.04 -1.31 -0.03 0.00 0.01 0.00 0.00 72.50 71.13 1cfm s THR 43 CO 0.99 0.15 0.49 -0.69 -0.69 0.00 0.00 174.62 174.88 1cfm s VAL 44 N -0.80 5.11 0.37 3.82 1.01 -1.26 -0.51 120.40 128.14 1cfm s VAL 44 Ca 0.06 0.87 0.04 0.00 0.00 0.00 0.00 61.98 62.94 1cfm s VAL 44 Cb -0.08 -3.81 -0.05 0.00 0.00 0.00 0.00 36.38 32.43 1cfm s VAL 44 CO 0.02 0.14 0.07 0.72 0.00 0.00 0.00 175.10 176.05 1cfm s PHE 45 N 1.93 1.93 0.03 5.22 -0.71 0.44 -4.95 117.98 121.87 1cfm s PHE 45 Ca 0.22 -1.04 0.05 0.00 -1.04 0.00 0.00 56.93 55.11 1cfm s PHE 45 Cb -0.15 -1.30 -0.03 0.00 -1.21 0.00 0.00 43.02 40.32 1cfm s PHE 45 CO 0.09 -0.04 -0.09 -1.21 -1.34 0.00 0.00 175.22 172.63 1cfm s GLU 46 N -3.83 2.40 -0.21 1.99 2.02 -1.26 -0.45 118.70 119.36 1cfm s GLU 46 Ca 0.30 -0.82 -0.02 0.00 0.02 0.00 0.00 54.97 54.45 1cfm s GLU 46 Cb 0.06 -2.41 0.00 0.00 0.10 0.00 0.00 34.13 31.89 1cfm s GLU 46 CO 0.14 0.57 -0.09 0.00 0.02 0.00 0.00 175.26 175.90 1cfm s ALA 47 N -1.02 2.66 -0.33 5.21 0.00 -0.52 -4.39 121.76 123.37 1cfm s ALA 47 Ca 0.17 -1.18 -0.08 0.00 0.00 0.00 0.00 51.96 50.87 1cfm s ALA 47 Cb -0.11 -1.53 0.03 0.00 0.00 0.00 0.00 23.12 21.50 1cfm s ALA 47 CO 0.08 -0.40 0.13 0.54 0.00 0.00 0.00 175.76 176.11 1cfm s VAL 48 N 1.41 4.09 0.02 0.00 0.11 -0.18 -0.57 120.40 125.28 1cfm s VAL 48 Ca 0.05 -0.90 0.01 0.00 -2.93 0.00 0.00 61.98 58.22 1cfm s VAL 48 Cb -0.14 -3.23 -0.04 0.00 -1.53 0.00 0.00 36.38 31.44 1cfm s VAL 48 CO -0.06 -0.11 0.05 0.27 -3.33 0.00 0.00 175.10 171.92 1cfm s ILE 49 N 1.48 4.44 -0.06 7.04 -4.36 0.07 -1.23 121.20 128.57 1cfm s ILE 49 Ca 0.01 -0.60 0.03 0.00 -0.26 0.00 0.00 60.65 59.84 1cfm s ILE 49 Cb -0.19 -3.04 0.00 0.00 1.25 0.00 0.00 42.46 40.48 1cfm s ILE 49 CO 0.04 0.29 -0.17 -1.61 0.24 0.00 0.00 174.94 173.74 1cfm s GLU 50 N -1.86 2.00 -0.55 0.37 2.02 0.85 -0.70 118.70 120.84 1cfm s GLU 50 Ca 0.23 -0.59 0.07 0.00 0.02 0.00 0.00 54.97 54.70 1cfm s GLU 50 Cb -0.12 -1.64 0.27 0.00 0.10 0.00 0.00 34.13 32.75 1cfm s GLU 50 CO 0.15 0.15 0.73 1.28 0.02 0.00 0.00 175.26 177.59 1cfm n LEU 51 N 3.47 2.80 -4.73 1.80 4.77 0.23 -1.57 117.00 123.77 1cfm n LEU 51 Ca -0.20 -5.27 -0.40 0.00 -0.03 0.00 0.00 56.01 50.11 1cfm n LEU 51 Cb 0.52 -0.22 0.03 0.00 -2.33 0.00 0.00 43.42 41.42 1cfm n LEU 51 CO 0.26 2.14 0.96 -0.81 -1.33 0.00 0.00 177.39 178.60 1cfm n PRO 52 N 0.73 1.89 -3.57 3.23 -0.04 -1.26 -4.80 135.00 131.17 1cfm n PRO 52 Ca 0.28 0.68 -0.07 0.00 -0.04 0.00 0.00 63.50 64.35 1cfm n PRO 52 Cb 0.46 -2.52 -0.03 0.00 -0.04 0.00 0.00 33.50 31.36 1cfm n PRO 52 CO 0.00 0.00 0.00 1.52 -0.04 0.00 0.00 175.50 176.98 1cfm s TYR 53 N -1.25 -0.24 -0.66 0.54 1.13 -1.26 -4.94 117.35 110.66 1cfm s TYR 53 Ca 0.66 0.27 -0.26 0.00 -1.41 0.00 0.00 57.07 56.32 1cfm s TYR 53 Cb -0.45 0.50 -0.02 0.00 -1.10 0.00 0.00 41.96 40.89 1cfm s TYR 53 CO 0.54 -0.31 1.80 0.34 -2.51 0.00 0.00 175.55 175.41 1cfm s ASP 54 N -1.81 5.37 0.13 -0.18 -1.08 -1.26 -4.84 116.67 113.00 1cfm s ASP 54 Ca 0.05 0.11 0.08 0.00 -0.52 0.00 0.00 52.55 52.27 1cfm s ASP 54 Cb -0.01 -2.54 0.46 0.00 -1.46 0.00 0.00 42.92 39.37 1cfm s ASP 54 CO -0.04 -2.34 1.25 0.29 0.52 0.00 0.00 175.17 174.84 1cfm n LYS 55 N 9.17 0.05 0.14 4.34 4.01 -1.26 -1.39 118.16 133.22 1cfm n LYS 55 Ca 0.21 0.55 0.12 0.00 -0.51 0.00 0.00 58.31 58.67 1cfm n LYS 55 Cb 0.51 -1.69 0.12 0.00 -0.51 0.00 0.00 35.03 33.46 1cfm n LYS 55 CO 0.00 0.00 0.00 1.96 -1.11 0.00 0.00 177.40 178.25 1cfm h GLN 56 N 0.00 0.00 -5.60 1.97 1.08 -2.03 -3.44 115.11 107.09 1cfm h GLN 56 Ca 0.00 0.00 -0.61 0.00 -1.45 0.00 0.00 58.65 56.59 1cfm h GLN 56 Cb 0.02 0.00 -0.12 0.00 -0.05 0.00 0.00 27.48 27.33 1cfm h GLN 56 CO 0.00 0.00 0.24 0.08 -0.95 0.00 0.00 178.83 178.20 1cfm s VAL 57 N -3.26 4.88 0.38 -0.54 1.01 -0.49 -5.05 120.40 117.33 1cfm s VAL 57 Ca 0.04 0.96 -0.14 0.00 0.00 0.00 0.00 61.98 62.83 1cfm s VAL 57 Cb 0.09 -4.06 -0.08 0.00 0.00 0.00 0.00 36.38 32.33 1cfm s VAL 57 CO 0.72 -0.19 0.79 -0.54 0.00 0.00 0.00 175.10 175.88 1cfm s LYS 58 N 2.74 3.95 0.44 2.72 1.02 -1.26 -4.87 119.74 124.47 1cfm s LYS 58 Ca 0.28 0.67 0.08 0.00 0.02 0.00 0.00 55.97 57.02 1cfm s LYS 58 Cb -0.15 -2.37 -0.00 0.00 -0.52 0.00 0.00 37.83 34.79 1cfm s LYS 58 CO 0.12 0.04 0.45 1.14 -0.92 0.00 0.00 175.35 176.18 1cfm s GLN 59 N -3.37 2.56 -0.05 1.68 -2.07 0.49 -4.78 119.66 114.12 1cfm s GLN 59 Ca 0.54 -1.52 -0.26 0.00 -1.82 0.00 0.00 55.36 52.31 1cfm s GLN 59 Cb -0.10 -2.46 -0.03 0.00 -1.09 0.00 0.00 33.01 29.33 1cfm s GLN 59 CO 0.23 -0.29 0.79 0.08 -1.32 0.00 0.00 175.29 174.78 1cfm s VAL 60 N -2.48 4.98 0.48 3.63 1.01 -1.26 -0.74 120.40 126.01 1cfm s VAL 60 Ca 0.49 1.65 -0.00 0.00 0.00 0.00 0.00 61.98 64.12 1cfm s VAL 60 Cb -0.05 -4.13 0.00 0.00 0.00 0.00 0.00 36.38 32.20 1cfm s VAL 60 CO 0.29 0.21 0.71 -0.76 0.00 0.00 0.00 175.10 175.55 1cfm s LEU 61 N 0.95 3.55 0.57 3.92 1.02 0.16 -4.87 118.68 123.99 1cfm s LEU 61 Ca 0.42 0.29 0.28 0.00 0.02 0.00 0.00 54.13 55.14 1cfm s LEU 61 Cb -0.19 -3.16 1.71 0.00 0.02 0.00 0.00 46.19 44.57 1cfm s LEU 61 CO 0.21 -0.80 2.22 0.00 0.02 0.00 0.00 176.35 177.99 1cfm h ALA 62 N 0.29 1.53 -0.01 4.21 0.00 -1.95 -0.61 119.26 122.72 1cfm h ALA 62 Ca -0.45 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.44 1cfm h ALA 62 Cb 1.26 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1cfm h ALA 62 CO 0.57 0.03 -0.00 0.27 0.00 0.00 0.00 179.25 180.11 1cfm n ASN 63 N -3.88 0.56 0.00 0.00 2.04 -1.26 -4.90 115.26 107.82 1cfm n ASN 63 Ca -0.03 -1.17 0.00 0.00 -0.44 0.00 0.00 54.58 52.94 1cfm n ASN 63 Cb 0.11 -0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.36 1cfm n ASN 63 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1cfm n GLY 64 N 1.07 2.69 2.65 4.83 0.00 -0.24 -4.95 105.19 111.25 1cfm n GLY 64 Ca 0.22 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 46.05 1cfm n GLY 64 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1cfm n LYS 65 N -2.00 -0.68 -4.19 1.61 5.02 -1.26 -4.09 118.16 112.57 1cfm n LYS 65 Ca 0.00 -1.51 -0.30 0.00 -2.02 0.00 0.00 58.31 54.49 1cfm n LYS 65 Cb 0.00 -0.84 -0.09 0.00 -0.02 0.00 0.00 35.03 34.08 1cfm n LYS 65 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1cfm s LYS 66 N -4.84 2.29 0.02 1.97 -0.14 -1.26 0.39 119.74 118.17 1cfm s LYS 66 Ca 0.50 -0.96 -0.04 0.00 -1.36 0.00 0.00 55.97 54.11 1cfm s LYS 66 Cb -0.02 -2.39 0.01 0.00 -1.68 0.00 0.00 37.83 33.76 1cfm s LYS 66 CO 0.35 0.52 0.19 0.41 -0.76 0.00 0.00 175.35 176.06 1cfm n GLY 67 N 0.61 0.98 3.70 -3.33 0.00 0.08 -4.87 105.19 102.36 1cfm n GLY 67 Ca -0.12 -0.93 -0.30 0.00 0.00 0.00 0.00 46.02 44.67 1cfm n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1cfm s ASP 68 N -1.44 3.40 -0.03 1.61 1.01 -1.26 -0.38 116.67 119.57 1cfm s ASP 68 Ca 0.04 1.66 -0.00 0.00 0.71 0.00 0.00 52.55 54.96 1cfm s ASP 68 Cb -0.00 -2.31 -0.04 0.00 1.01 0.00 0.00 42.92 41.58 1cfm s ASP 68 CO 0.01 -2.71 0.03 -0.76 0.21 0.00 0.00 175.17 171.94 1cfm s LEU 69 N -6.30 3.68 0.16 1.23 1.02 -1.26 -4.71 118.68 112.50 1cfm s LEU 69 Ca 0.64 0.10 0.03 0.00 0.02 0.00 0.00 54.13 54.92 1cfm s LEU 69 Cb -0.19 -2.04 -0.04 0.00 0.02 0.00 0.00 46.19 43.94 1cfm s LEU 69 CO 0.58 0.31 0.26 0.20 0.02 0.00 0.00 176.35 177.72 1cfm s ASN 70 N -1.42 6.17 0.31 2.29 0.02 -1.26 -0.78 114.94 120.27 1cfm s ASN 70 Ca 0.19 0.10 0.06 0.00 -1.02 0.00 0.00 52.86 52.19 1cfm s ASN 70 Cb -0.12 -1.81 -0.06 0.00 0.02 0.00 0.00 41.25 39.28 1cfm s ASN 70 CO 0.09 0.04 -0.04 0.68 0.02 0.00 0.00 177.10 177.90 1cfm s VAL 71 N -1.78 1.67 0.06 1.60 -7.23 0.15 -1.28 120.40 113.60 1cfm s VAL 71 Ca 0.34 -2.10 -0.28 0.00 -1.81 0.00 0.00 61.98 58.13 1cfm s VAL 71 Cb -0.11 -2.58 0.09 0.00 0.56 0.00 0.00 36.38 34.34 1cfm s VAL 71 CO 0.28 -0.21 1.08 -0.83 -0.31 0.00 0.00 175.10 175.11 1cfm s GLY 72 N -3.50 -0.32 0.21 2.32 0.00 -0.59 -1.78 107.32 103.67 1cfm s GLY 72 Ca 0.32 0.48 -0.23 0.00 0.00 0.00 0.00 44.72 45.29 1cfm s GLY 72 CO 0.14 0.10 0.88 -3.16 0.00 0.00 0.00 173.10 171.05 1cfm s MET 73 N -2.92 1.48 -0.03 2.90 0.23 -0.71 -0.47 119.30 119.78 1cfm s MET 73 Ca 0.12 -0.84 0.01 0.00 -1.03 0.00 0.00 55.69 53.95 1cfm s MET 73 Cb 0.01 0.49 0.01 0.00 -1.53 0.00 0.00 34.83 33.81 1cfm s MET 73 CO -0.01 -0.68 -0.05 0.54 -2.03 0.00 0.00 175.02 172.79 1cfm s VAL 74 N -3.33 0.51 -0.19 5.16 0.11 -0.03 -2.62 120.40 120.01 1cfm s VAL 74 Ca 0.13 -0.18 0.01 0.00 -2.93 0.00 0.00 61.98 59.00 1cfm s VAL 74 Cb -0.03 -0.49 0.04 0.00 -1.53 0.00 0.00 36.38 34.37 1cfm s VAL 74 CO 0.05 0.18 -0.12 -0.22 -3.33 0.00 0.00 175.10 171.67 1cfm s LEU 75 N 0.43 2.21 -0.54 2.54 2.96 0.22 -1.54 118.68 124.96 1cfm s LEU 75 Ca -0.05 -0.82 -0.17 0.00 -0.22 0.00 0.00 54.13 52.87 1cfm s LEU 75 Cb -0.09 -1.25 0.12 0.00 0.50 0.00 0.00 46.19 45.47 1cfm s LEU 75 CO -0.00 -0.12 0.53 -0.63 -1.32 0.00 0.00 176.35 174.81 1cfm s ILE 76 N 1.39 5.13 0.40 6.68 1.01 0.63 -0.56 121.20 135.89 1cfm s ILE 76 Ca -0.00 -1.35 0.00 0.00 0.00 0.00 0.00 60.65 59.31 1cfm s ILE 76 Cb -0.16 -4.35 -0.02 0.00 0.01 0.00 0.00 42.46 37.95 1cfm s ILE 76 CO -0.09 -0.89 0.62 -0.76 0.00 0.00 0.00 174.94 173.82 1cfm s LEU 77 N 1.83 3.81 0.74 2.97 1.43 0.51 -1.83 118.68 128.14 1cfm s LEU 77 Ca 0.05 0.37 -0.14 0.00 -1.03 0.00 0.00 54.13 53.38 1cfm s LEU 77 Cb -0.28 -3.25 0.04 0.00 0.03 0.00 0.00 46.19 42.73 1cfm s LEU 77 CO 0.04 -0.52 1.18 -2.84 0.23 0.00 0.00 176.35 174.45 1cfm s PRO 78 N -4.45 2.15 0.37 1.29 0.02 -1.26 -4.74 135.00 128.38 1cfm s PRO 78 Ca 0.45 1.67 -0.27 0.00 0.02 0.00 0.00 61.00 62.87 1cfm s PRO 78 Cb -0.10 -1.84 -0.12 0.00 0.02 0.00 0.00 34.50 32.46 1cfm s PRO 78 CO 0.37 -1.81 1.22 -1.91 -0.33 0.00 0.00 177.00 174.55 1cfm n GLU 79 N -2.82 1.90 0.00 5.54 2.13 -1.26 -1.78 120.64 124.35 1cfm n GLU 79 Ca 0.13 0.67 0.00 0.00 0.66 0.00 0.00 57.16 58.62 1cfm n GLU 79 Cb 0.51 -2.26 0.00 0.00 0.27 0.00 0.00 31.44 29.96 1cfm n GLU 79 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1cfm n GLY 80 N 0.88 2.88 3.81 8.31 0.00 -1.26 -4.90 105.19 114.90 1cfm n GLY 80 Ca 0.06 -0.06 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 1cfm n GLY 80 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1cfm s PHE 81 N -2.25 3.29 0.31 1.61 0.40 -0.73 -4.06 117.98 116.56 1cfm s PHE 81 Ca 0.00 1.63 -0.10 0.00 -0.60 0.00 0.00 56.93 57.87 1cfm s PHE 81 Cb 0.00 -2.93 0.01 0.00 0.51 0.00 0.00 43.02 40.61 1cfm s PHE 81 CO 0.00 -0.26 0.54 -1.21 0.70 0.00 0.00 175.22 174.99 1cfm s GLU 82 N -2.97 1.83 0.22 0.44 2.02 -1.10 -3.65 118.70 115.48 1cfm s GLU 82 Ca 0.61 -1.48 -0.30 0.00 0.02 0.00 0.00 54.97 53.82 1cfm s GLU 82 Cb -0.13 0.49 -0.09 0.00 0.10 0.00 0.00 34.13 34.50 1cfm s GLU 82 CO 0.17 -0.78 1.29 -1.17 0.02 0.00 0.00 175.26 174.79 1cfm s LEU 83 N -3.11 4.43 0.02 1.80 2.96 -1.26 -0.85 118.68 122.66 1cfm s LEU 83 Ca 0.24 2.42 -0.30 0.00 -0.22 0.00 0.00 54.13 56.26 1cfm s LEU 83 Cb -0.02 -3.62 -0.06 0.00 0.50 0.00 0.00 46.19 43.00 1cfm s LEU 83 CO 0.14 -0.49 1.35 0.00 -1.32 0.00 0.00 176.35 176.03 1cfm s ALA 84 N -0.13 3.55 0.80 5.97 0.00 0.96 -4.57 121.76 128.34 1cfm s ALA 84 Ca 0.55 0.88 -0.14 0.00 0.00 0.00 0.00 51.96 53.25 1cfm s ALA 84 Cb -0.36 -3.56 0.07 0.00 0.00 0.00 0.00 23.12 19.26 1cfm s ALA 84 CO 0.40 -0.80 1.12 -2.30 0.00 0.00 0.00 175.76 174.19 1cfm n PRO 85 N 4.98 0.23 -0.13 0.00 -0.02 -1.26 -4.81 135.00 133.99 1cfm n PRO 85 Ca 0.12 0.15 -0.04 0.00 -2.02 0.00 0.00 63.50 61.71 1cfm n PRO 85 Cb 0.44 -2.37 0.04 0.00 -0.02 0.00 0.00 33.50 31.59 1cfm n PRO 85 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 1cfm h PRO 86 N -0.80 0.14 0.00 0.52 0.11 -1.94 -1.14 132.00 128.90 1cfm h PRO 86 Ca -0.46 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1cfm h PRO 86 Cb 1.31 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1cfm h PRO 86 CO 0.46 0.09 0.12 0.38 -0.21 0.00 0.00 178.00 178.84 1cfm h ASP 87 N 0.14 0.00 -0.29 -2.05 2.03 -2.04 -0.05 116.42 114.17 1cfm h ASP 87 Ca 0.21 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 1cfm h ASP 87 Cb 0.30 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.80 1cfm h ASP 87 CO -0.33 0.00 0.00 0.54 -1.03 0.00 0.00 179.24 178.42 1cfm n ARG 88 N -2.92 2.32 -3.80 4.15 5.12 -0.44 -4.90 116.66 116.19 1cfm n ARG 88 Ca -0.02 -2.11 -0.36 0.00 -1.93 0.00 0.00 57.85 53.42 1cfm n ARG 88 Cb 0.18 -1.46 -0.13 0.00 -1.16 0.00 0.00 32.46 29.89 1cfm n ARG 88 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1cfm s VAL 89 N -1.50 3.92 0.44 1.55 1.01 -0.03 -4.84 120.40 120.94 1cfm s VAL 89 Ca 0.34 -0.43 -0.26 0.00 0.00 0.00 0.00 61.98 61.63 1cfm s VAL 89 Cb 0.20 -2.88 -0.09 0.00 0.00 0.00 0.00 36.38 33.62 1cfm s VAL 89 CO 0.29 0.29 1.43 -2.84 0.00 0.00 0.00 175.10 174.26 1cfm s PRO 90 N 1.54 3.76 0.49 2.72 0.02 -1.26 -4.68 135.00 137.58 1cfm s PRO 90 Ca 0.05 2.43 0.29 0.00 0.02 0.00 0.00 61.00 63.79 1cfm s PRO 90 Cb -0.15 -2.71 1.37 0.00 0.02 0.00 0.00 34.50 33.03 1cfm s PRO 90 CO 0.01 -0.76 1.81 0.00 -0.33 0.00 0.00 177.00 177.73 1cfm h ALA 91 N 2.44 2.73 -0.35 -1.55 0.00 -1.98 0.38 119.26 120.94 1cfm h ALA 91 Ca -0.51 -0.00 0.04 0.00 0.00 0.00 0.00 54.91 54.44 1cfm h ALA 91 Cb 1.26 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 19.07 1cfm h ALA 91 CO 0.62 -1.08 0.12 0.93 0.00 0.00 0.00 179.25 179.83 1cfm h GLU 92 N 0.15 0.25 0.01 0.00 4.39 -2.00 -1.47 114.58 115.91 1cfm h GLU 92 Ca 0.55 -0.02 -0.17 0.00 0.34 0.00 0.00 59.36 60.06 1cfm h GLU 92 Cb 1.87 -0.06 0.01 0.00 -0.10 0.00 0.00 28.75 30.47 1cfm h GLU 92 CO -0.12 0.17 -0.68 0.82 -1.16 0.00 0.00 179.01 178.04 1cfm h ILE 93 N 0.26 1.42 -0.79 3.13 2.04 -0.67 -3.13 117.51 119.77 1cfm h ILE 93 Ca 0.16 -2.14 0.16 0.00 1.00 0.00 0.00 64.86 64.04 1cfm h ILE 93 Cb 0.14 2.62 -0.05 0.00 -0.74 0.00 0.00 36.82 38.79 1cfm h ILE 93 CO -0.17 0.63 0.53 0.11 0.00 0.00 0.00 178.15 179.25 1cfm h LYS 94 N -0.06 0.41 -0.32 2.37 1.57 -0.91 0.37 116.57 120.00 1cfm h LYS 94 Ca -0.09 -0.02 -0.13 0.00 -1.87 0.00 0.00 60.65 58.54 1cfm h LYS 94 Cb 1.39 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.60 1cfm h LYS 94 CO 0.13 0.27 -0.31 1.49 -0.57 0.00 0.00 179.45 180.46 1cfm h GLU 95 N 0.42 0.70 -0.19 3.15 4.81 -1.28 -1.85 114.58 120.34 1cfm h GLU 95 Ca 0.39 -0.32 -0.15 0.00 -0.13 0.00 0.00 59.36 59.16 1cfm h GLU 95 Cb 0.91 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1cfm h GLU 95 CO -0.13 0.92 -0.47 0.87 -0.73 0.00 0.00 179.01 179.47 1cfm h LYS 96 N 0.59 0.66 -0.83 1.92 1.57 -0.59 -3.13 116.57 116.76 1cfm h LYS 96 Ca 0.07 -0.45 0.07 0.00 -1.87 0.00 0.00 60.65 58.47 1cfm h LYS 96 Cb 0.82 0.07 -0.05 0.00 0.08 0.00 0.00 32.23 33.14 1cfm h LYS 96 CO 0.07 1.07 0.54 0.28 -0.57 0.00 0.00 179.45 180.84 1cfm h VAL 97 N 0.34 1.04 -0.36 0.50 2.07 -0.29 -3.42 116.25 116.14 1cfm h VAL 97 Ca -0.00 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.21 1cfm h VAL 97 Cb 1.08 0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.90 1cfm h VAL 97 CO 0.10 0.17 0.00 0.61 0.02 0.00 0.00 177.57 178.47 1cfm n GLY 98 N -1.42 -1.41 2.30 2.17 0.00 -0.71 -4.08 105.19 102.05 1cfm n GLY 98 Ca 0.13 -1.27 -0.28 0.00 0.00 0.00 0.00 46.02 44.59 1cfm n GLY 98 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1cfm n ASN 99 N -0.29 7.03 -4.87 1.61 4.05 -1.26 -4.93 115.26 116.61 1cfm n ASN 99 Ca 0.00 -2.82 -0.34 0.00 0.45 0.00 0.00 54.58 51.87 1cfm n ASN 99 Cb 0.00 -1.40 -0.06 0.00 1.23 0.00 0.00 39.78 39.56 1cfm n ASN 99 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 1cfm s LEU 100 N -0.94 4.25 -0.75 1.20 1.43 -1.26 -5.06 118.68 117.55 1cfm s LEU 100 Ca 0.63 0.32 0.04 0.00 -1.03 0.00 0.00 54.13 54.09 1cfm s LEU 100 Cb 0.27 -2.41 0.20 0.00 0.03 0.00 0.00 46.19 44.27 1cfm s LEU 100 CO -0.09 0.30 0.62 -1.22 0.23 0.00 0.00 176.35 176.18 1cfm n TYR 101 N 1.23 3.52 -1.95 0.29 4.01 -1.26 -5.08 117.16 117.92 1cfm n TYR 101 Ca -0.13 -4.22 -0.42 0.00 -0.16 0.00 0.00 57.90 52.97 1cfm n TYR 101 Cb 0.53 -0.74 -0.02 0.00 -0.31 0.00 0.00 39.34 38.80 1cfm n TYR 101 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1cfm s TYR 102 N -1.64 2.98 0.08 -0.72 2.02 -1.26 -4.80 117.35 114.01 1cfm s TYR 102 Ca 0.28 0.89 0.05 0.00 -0.37 0.00 0.00 57.07 57.92 1cfm s TYR 102 Cb -0.02 -3.89 -0.03 0.00 -0.40 0.00 0.00 41.96 37.62 1cfm s TYR 102 CO -0.13 -3.00 -0.14 -0.65 -1.57 0.00 0.00 175.55 170.05 1cfm s GLN 103 N -0.05 0.86 0.53 -0.62 -0.21 -0.57 -4.94 119.66 114.65 1cfm s GLN 103 Ca 0.62 -1.02 -0.21 0.00 0.02 0.00 0.00 55.36 54.78 1cfm s GLN 103 Cb -0.43 -0.85 -0.05 0.00 1.00 0.00 0.00 33.01 32.67 1cfm s GLN 103 CO 0.41 0.18 1.22 -1.25 -2.12 0.00 0.00 175.29 173.73 1cfm s PRO 104 N -1.94 3.34 0.25 2.91 0.04 -1.26 -1.24 135.00 137.10 1cfm s PRO 104 Ca 0.00 1.88 -0.03 0.00 0.04 0.00 0.00 61.00 62.89 1cfm s PRO 104 Cb -0.09 -2.18 0.46 0.00 0.04 0.00 0.00 34.50 32.72 1cfm s PRO 104 CO 0.02 -0.92 1.77 -0.92 0.04 0.00 0.00 177.00 176.99 1cfm h TYR 105 N 1.47 0.74 -3.50 0.56 3.20 -0.32 -3.44 116.97 115.69 1cfm h TYR 105 Ca -0.50 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.35 1cfm h TYR 105 Cb 1.28 -0.21 -0.12 0.00 1.54 0.00 0.00 36.73 39.22 1cfm h TYR 105 CO 0.49 0.22 -0.11 -1.54 -1.64 0.00 0.00 178.16 175.59 1cfm s SER 106 N -5.48 -0.16 0.62 -2.11 1.04 -1.26 -4.90 113.70 101.46 1cfm s SER 106 Ca -0.12 -0.54 0.31 0.00 0.48 0.00 0.00 55.95 56.08 1cfm s SER 106 Cb 0.20 0.50 1.71 0.00 0.10 0.00 0.00 66.02 68.54 1cfm s SER 106 CO 0.78 -0.94 2.04 -0.65 0.98 0.00 0.00 173.24 175.44 1cfm h PRO 107 N 2.36 0.00 -0.02 4.02 0.11 -2.01 0.53 132.00 137.00 1cfm h PRO 107 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1cfm h PRO 107 Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 1cfm h PRO 107 CO 0.44 0.00 -0.11 0.39 -0.21 0.00 0.00 178.00 178.51 1cfm n GLU 108 N -3.40 1.59 -3.14 1.05 4.71 -1.26 -4.48 120.64 115.72 1cfm n GLU 108 Ca 0.01 -1.09 -0.24 0.00 -0.01 0.00 0.00 57.16 55.82 1cfm n GLU 108 Cb 0.38 -1.48 -0.05 0.00 -1.01 0.00 0.00 31.44 29.28 1cfm n GLU 108 CO 0.00 0.00 0.00 1.04 0.09 0.00 0.00 177.13 178.26 1cfm n GLN 109 N 0.25 2.18 0.25 3.49 6.02 0.18 -4.88 117.38 124.86 1cfm n GLN 109 Ca 0.15 -4.23 0.17 0.00 -0.01 0.00 0.00 57.00 53.08 1cfm n GLN 109 Cb 0.42 -1.97 0.82 0.00 1.02 0.00 0.00 30.24 30.54 1cfm n GLN 109 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 1cfm h LYS 110 N 3.38 0.00 -0.00 -1.09 1.79 -1.79 -1.79 116.57 117.08 1cfm h LYS 110 Ca 0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1cfm h LYS 110 Cb 0.70 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.35 1cfm h LYS 110 CO 0.70 0.00 -0.07 0.27 -1.08 0.00 0.00 179.45 179.26 1cfm n ASN 111 N -2.76 0.33 -4.17 0.86 6.94 -1.24 -4.25 115.26 110.97 1cfm n ASN 111 Ca -0.01 -0.51 -0.34 0.00 -0.02 0.00 0.00 54.58 53.71 1cfm n ASN 111 Cb 0.15 -0.12 -0.15 0.00 -2.36 0.00 0.00 39.78 37.30 1cfm n ASN 111 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1cfm s ILE 112 N -2.46 2.61 0.01 1.53 1.01 -0.68 -0.36 121.20 122.87 1cfm s ILE 112 Ca 0.30 -1.04 0.03 0.00 0.00 0.00 0.00 60.65 59.94 1cfm s ILE 112 Cb 0.20 -2.29 -0.04 0.00 0.01 0.00 0.00 42.46 40.35 1cfm s ILE 112 CO 0.46 0.27 -0.03 -0.76 0.00 0.00 0.00 174.94 174.88 1cfm s LEU 113 N 1.30 3.33 0.12 2.97 1.43 0.27 0.10 118.68 128.20 1cfm s LEU 113 Ca 0.01 -0.10 0.03 0.00 -1.03 0.00 0.00 54.13 53.03 1cfm s LEU 113 Cb -0.16 -1.94 -0.04 0.00 0.03 0.00 0.00 46.19 44.08 1cfm s LEU 113 CO -0.07 0.27 -0.08 0.68 0.23 0.00 0.00 176.35 177.38 1cfm s VAL 114 N -1.07 0.87 0.04 -1.59 -7.23 -0.37 0.72 120.40 111.76 1cfm s VAL 114 Ca 0.19 -1.97 -0.26 0.00 -1.81 0.00 0.00 61.98 58.13 1cfm s VAL 114 Cb -0.11 -1.73 0.06 0.00 0.56 0.00 0.00 36.38 35.16 1cfm s VAL 114 CO 0.10 -0.82 0.61 0.54 -0.31 0.00 0.00 175.10 175.22 1cfm s VAL 115 N -3.48 0.01 0.00 1.32 0.11 -1.08 -1.52 120.40 115.76 1cfm s VAL 115 Ca 0.13 -0.07 0.00 0.00 -2.93 0.00 0.00 61.98 59.12 1cfm s VAL 115 Cb 0.04 -0.99 0.00 0.00 -1.53 0.00 0.00 36.38 33.90 1cfm s VAL 115 CO -0.03 -0.04 0.00 0.61 -3.33 0.00 0.00 175.10 172.32 1cfm n GLY 116 N 0.39 2.27 3.76 6.54 0.00 -1.26 -1.74 105.19 115.15 1cfm n GLY 116 Ca -0.18 -1.96 -0.41 0.00 0.00 0.00 0.00 46.02 43.47 1cfm n GLY 116 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1cfm s PRO 117 N -2.68 4.43 0.03 1.61 0.04 -1.26 -4.58 135.00 132.59 1cfm s PRO 117 Ca 0.00 2.09 -0.04 0.00 0.04 0.00 0.00 61.00 63.09 1cfm s PRO 117 Cb 0.00 -3.12 -0.01 0.00 0.04 0.00 0.00 34.50 31.41 1cfm s PRO 117 CO 0.00 -0.10 0.07 0.14 0.04 0.00 0.00 177.00 177.15 1cfm s VAL 118 N -0.94 0.12 0.10 -0.36 -7.23 -0.73 -4.93 120.40 106.43 1cfm s VAL 118 Ca 0.49 -1.00 -0.32 0.00 -1.81 0.00 0.00 61.98 59.34 1cfm s VAL 118 Cb -0.37 -0.69 -0.11 0.00 0.56 0.00 0.00 36.38 35.77 1cfm s VAL 118 CO 0.48 -0.55 1.81 -2.65 -0.31 0.00 0.00 175.10 173.87 1cfm n PRO 119 N 1.07 2.63 0.21 4.82 -0.02 -1.26 0.31 135.00 142.75 1cfm n PRO 119 Ca -0.21 0.95 0.06 0.00 -2.02 0.00 0.00 63.50 62.29 1cfm n PRO 119 Cb 0.57 -2.83 0.48 0.00 -0.02 0.00 0.00 33.50 31.70 1cfm n PRO 119 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1cfm h GLY 120 N 8.24 0.00 0.20 -1.23 0.00 -1.24 -0.18 103.07 108.87 1cfm h GLY 120 Ca -0.46 0.00 0.17 0.00 0.00 0.00 0.00 47.33 47.04 1cfm h GLY 120 CO 0.94 0.00 0.61 0.50 0.00 0.00 0.00 176.54 178.59 1cfm h LYS 121 N 0.00 0.79 0.00 4.80 1.79 -1.90 -1.16 116.57 120.88 1cfm h LYS 121 Ca -0.00 -0.05 -0.16 0.00 -2.18 0.00 0.00 60.65 58.26 1cfm h LYS 121 Cb 0.57 -0.18 -0.03 0.00 -1.58 0.00 0.00 32.23 31.01 1cfm h LYS 121 CO 0.04 0.52 -1.95 1.17 -1.08 0.00 0.00 179.45 178.14 1cfm n LYS 122 N -4.74 1.01 -0.54 3.15 4.81 -1.05 -4.66 118.16 116.14 1cfm n LYS 122 Ca 0.22 -0.07 0.03 0.00 -0.87 0.00 0.00 58.31 57.62 1cfm n LYS 122 Cb 0.52 -1.41 0.21 0.00 0.02 0.00 0.00 35.03 34.37 1cfm n LYS 122 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 1cfm n TYR 123 N -2.37 0.67 0.32 5.64 4.01 -0.10 -4.62 117.16 120.71 1cfm n TYR 123 Ca -0.16 -1.28 0.21 0.00 -0.16 0.00 0.00 57.90 56.51 1cfm n TYR 123 Cb 0.76 -0.34 1.12 0.00 -0.31 0.00 0.00 39.34 40.57 1cfm n TYR 123 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1cfm h SER 124 N 1.01 0.00 -3.38 7.72 4.64 -1.42 -3.37 113.55 118.75 1cfm h SER 124 Ca 0.09 0.00 -0.52 0.00 -0.47 0.00 0.00 61.79 60.88 1cfm h SER 124 Cb 1.37 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 63.12 1cfm h SER 124 CO 0.21 0.00 -0.82 -0.70 -0.87 0.00 0.00 176.83 174.65 1cfm s GLU 125 N -4.05 1.75 0.14 4.77 2.12 -1.26 0.77 118.70 122.95 1cfm s GLU 125 Ca -0.04 -0.42 0.08 0.00 0.36 0.00 0.00 54.97 54.95 1cfm s GLU 125 Cb 0.12 -1.48 -0.04 0.00 0.26 0.00 0.00 34.13 33.00 1cfm s GLU 125 CO 0.40 -0.00 -0.17 -1.64 -0.54 0.00 0.00 175.26 173.31 1cfm s MET 126 N 0.77 1.18 -0.11 4.30 -1.94 0.13 -4.99 119.30 118.64 1cfm s MET 126 Ca -0.12 -1.33 0.03 0.00 -1.71 0.00 0.00 55.69 52.56 1cfm s MET 126 Cb -0.15 -1.21 0.01 0.00 2.01 0.00 0.00 34.83 35.49 1cfm s MET 126 CO 0.02 0.25 -0.20 0.08 -0.01 0.00 0.00 175.02 175.16 1cfm s VAL 127 N -1.96 1.84 -0.24 -6.03 1.01 -1.26 -0.75 120.40 113.00 1cfm s VAL 127 Ca 0.12 -0.87 -0.02 0.00 0.00 0.00 0.00 61.98 61.22 1cfm s VAL 127 Cb -0.06 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.71 1cfm s VAL 127 CO 0.05 0.51 -0.06 -0.69 0.00 0.00 0.00 175.10 174.91 1cfm s VAL 128 N 0.70 2.89 -0.49 2.92 1.01 0.27 -4.55 120.40 123.14 1cfm s VAL 128 Ca -0.11 -0.98 -0.28 0.00 0.00 0.00 0.00 61.98 60.60 1cfm s VAL 128 Cb -0.16 -2.45 0.02 0.00 0.00 0.00 0.00 36.38 33.79 1cfm s VAL 128 CO 0.02 0.22 1.33 -2.16 0.00 0.00 0.00 175.10 174.51 1cfm s PRO 129 N 1.34 3.52 -0.08 2.72 0.04 -1.26 -1.43 135.00 139.84 1cfm s PRO 129 Ca 0.01 0.63 -0.01 0.00 0.04 0.00 0.00 61.00 61.67 1cfm s PRO 129 Cb -0.16 -4.03 -0.03 0.00 0.04 0.00 0.00 34.50 30.32 1cfm s PRO 129 CO -0.05 -1.65 -0.03 0.42 0.04 0.00 0.00 177.00 175.73 1cfm s ILE 130 N 5.35 4.04 -0.26 0.56 -1.09 0.40 -0.03 121.20 130.18 1cfm s ILE 130 Ca 0.54 -0.35 -0.08 0.00 -2.23 0.00 0.00 60.65 58.52 1cfm s ILE 130 Cb -0.11 -2.68 -0.03 0.00 -1.58 0.00 0.00 42.46 38.06 1cfm s ILE 130 CO 0.29 0.60 0.11 -0.22 -1.23 0.00 0.00 174.94 174.49 1cfm s LEU 131 N -0.81 3.63 0.44 2.97 2.96 -0.03 -0.42 118.68 127.41 1cfm s LEU 131 Ca 0.12 -0.18 -0.22 0.00 -0.22 0.00 0.00 54.13 53.64 1cfm s LEU 131 Cb -0.11 -1.98 -0.09 0.00 0.50 0.00 0.00 46.19 44.51 1cfm s LEU 131 CO 0.02 -0.05 1.02 -0.94 -1.32 0.00 0.00 176.35 175.08 1cfm s SER 132 N 1.65 6.65 1.11 3.68 1.04 0.33 -2.71 113.70 125.45 1cfm s SER 132 Ca 0.06 1.92 -0.13 0.00 0.48 0.00 0.00 55.95 58.29 1cfm s SER 132 Cb -0.15 -2.57 0.18 0.00 0.10 0.00 0.00 66.02 63.58 1cfm s SER 132 CO 0.06 -0.56 0.76 -0.81 0.98 0.00 0.00 173.24 173.66 1cfm n PRO 133 N -0.50 -1.91 -3.54 4.02 -0.04 -1.26 -2.41 135.00 129.36 1cfm n PRO 133 Ca 0.07 -1.20 -0.26 0.00 -0.04 0.00 0.00 63.50 62.07 1cfm n PRO 133 Cb 0.52 -1.01 -0.15 0.00 -0.04 0.00 0.00 33.50 32.82 1cfm n PRO 133 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1cfm s ASP 134 N -3.66 2.76 0.14 3.54 2.15 -1.26 -0.88 116.67 119.46 1cfm s ASP 134 Ca 0.47 -0.92 0.07 0.00 0.43 0.00 0.00 52.55 52.61 1cfm s ASP 134 Cb -0.04 -0.16 0.39 0.00 -0.30 0.00 0.00 42.92 42.82 1cfm s ASP 134 CO 0.35 -0.40 1.13 -2.65 -0.17 0.00 0.00 175.17 173.44 1cfm n PRO 135 N 5.27 0.05 0.13 4.34 -0.02 -1.26 -0.49 135.00 143.02 1cfm n PRO 135 Ca -0.06 0.48 -0.01 0.00 -2.02 0.00 0.00 63.50 61.89 1cfm n PRO 135 Cb 0.45 -1.79 0.15 0.00 -0.02 0.00 0.00 33.50 32.29 1cfm n PRO 135 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1cfm h ALA 136 N 1.55 0.89 0.00 3.55 0.00 -1.94 -3.37 119.26 119.94 1cfm h ALA 136 Ca 0.00 -0.58 -0.15 0.00 0.00 0.00 0.00 54.91 54.18 1cfm h ALA 136 Cb 0.27 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 1cfm h ALA 136 CO 0.00 0.80 -1.53 1.63 0.00 0.00 0.00 179.25 180.15 1cfm n LYS 137 N -3.70 0.22 -3.10 0.00 5.02 0.27 -4.84 118.16 112.03 1cfm n LYS 137 Ca -0.01 0.07 -0.45 0.00 -2.02 0.00 0.00 58.31 55.90 1cfm n LYS 137 Cb 0.65 -1.04 -0.03 0.00 -0.02 0.00 0.00 35.03 34.60 1cfm n LYS 137 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 1cfm s ASN 138 N -5.33 6.57 0.00 4.39 3.84 0.35 -4.88 114.94 119.89 1cfm s ASN 138 Ca -0.13 -2.11 0.18 0.00 0.21 0.00 0.00 52.86 51.01 1cfm s ASN 138 Cb 0.04 -2.32 1.06 0.00 -0.55 0.00 0.00 41.25 39.48 1cfm s ASN 138 CO 0.19 -0.92 1.49 0.29 -2.79 0.00 0.00 177.10 175.36 1cfm n LYS 139 N 5.67 0.68 0.03 0.43 5.02 -1.26 -2.31 118.16 126.42 1cfm n LYS 139 Ca 0.13 0.00 0.13 0.00 -2.02 0.00 0.00 58.31 56.55 1cfm n LYS 139 Cb 0.47 -1.41 0.43 0.00 -0.02 0.00 0.00 35.03 34.50 1cfm n LYS 139 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1cfm n ASN 140 N -0.91 0.39 -4.43 4.39 3.02 -1.26 -4.80 115.26 111.65 1cfm n ASN 140 Ca 0.13 0.30 -0.29 0.00 -0.03 0.00 0.00 54.58 54.69 1cfm n ASN 140 Cb 0.06 -0.30 -0.12 0.00 -0.61 0.00 0.00 39.78 38.81 1cfm n ASN 140 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1cfm s VAL 141 N -3.05 2.47 0.19 2.41 0.11 -0.98 -5.05 120.40 116.51 1cfm s VAL 141 Ca 0.11 -1.75 0.03 0.00 -2.93 0.00 0.00 61.98 57.44 1cfm s VAL 141 Cb 0.16 -2.13 -0.01 0.00 -1.53 0.00 0.00 36.38 32.87 1cfm s VAL 141 CO 0.61 0.04 0.10 -0.24 -3.33 0.00 0.00 175.10 172.28 1cfm n SER 142 N 0.70 0.56 -3.62 3.54 2.88 -1.26 -4.44 113.62 111.98 1cfm n SER 142 Ca -0.16 -2.11 -0.41 0.00 -1.33 0.00 0.00 58.87 54.86 1cfm n SER 142 Cb 0.54 0.65 -0.00 0.00 -0.75 0.00 0.00 64.21 64.64 1cfm n SER 142 CO 0.00 0.00 0.00 -1.22 -1.23 0.00 0.00 175.04 172.59 1cfm n TYR 143 N -0.42 2.81 -4.36 0.66 4.01 -1.26 -4.80 117.16 113.80 1cfm n TYR 143 Ca -0.00 -2.87 -0.28 0.00 -0.16 0.00 0.00 57.90 54.58 1cfm n TYR 143 Cb 0.31 -2.08 -0.04 0.00 -0.31 0.00 0.00 39.34 37.23 1cfm n TYR 143 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1cfm n LEU 144 N 3.36 0.00 -4.59 7.72 7.99 -1.26 -4.76 117.00 125.47 1cfm n LEU 144 Ca 0.56 -2.83 -0.40 0.00 -0.01 0.00 0.00 56.01 53.32 1cfm n LEU 144 Cb 0.30 0.18 -0.08 0.00 -0.11 0.00 0.00 43.42 43.71 1cfm n LEU 144 CO 0.79 -0.48 0.17 -0.75 -1.51 0.00 0.00 177.39 175.62 1cfm s LYS 145 N -3.86 3.85 -0.05 3.23 2.20 -1.26 -1.65 119.74 122.20 1cfm s LYS 145 Ca 0.12 0.01 0.02 0.00 -0.36 0.00 0.00 55.97 55.75 1cfm s LYS 145 Cb -0.01 -3.72 -0.03 0.00 -1.51 0.00 0.00 37.83 32.56 1cfm s LYS 145 CO 0.07 -0.45 -0.09 0.71 -0.36 0.00 0.00 175.35 175.24 1cfm s TYR 146 N 2.26 2.88 0.54 4.03 2.02 0.32 -4.92 117.35 124.48 1cfm s TYR 146 Ca 0.18 -0.02 -0.16 0.00 -0.37 0.00 0.00 57.07 56.70 1cfm s TYR 146 Cb -0.16 -1.68 -0.07 0.00 -0.40 0.00 0.00 41.96 39.66 1cfm s TYR 146 CO 0.11 0.31 1.00 -1.25 -1.57 0.00 0.00 175.55 174.15 1cfm s PRO 147 N -0.87 3.80 -0.03 -1.71 0.04 -1.26 -0.97 135.00 133.99 1cfm s PRO 147 Ca 0.13 0.98 0.02 0.00 0.04 0.00 0.00 61.00 62.16 1cfm s PRO 147 Cb -0.11 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.33 1cfm s PRO 147 CO 0.02 -0.40 -0.07 0.42 0.04 0.00 0.00 177.00 177.01 1cfm s ILE 148 N -2.65 0.66 -0.05 0.56 1.01 -0.10 -4.19 121.20 116.43 1cfm s ILE 148 Ca 0.59 -0.25 0.05 0.00 0.00 0.00 0.00 60.65 61.04 1cfm s ILE 148 Cb -0.11 -0.62 -0.02 0.00 0.01 0.00 0.00 42.46 41.72 1cfm s ILE 148 CO 0.35 0.23 -0.20 -0.31 0.00 0.00 0.00 174.94 175.01 1cfm s TYR 149 N 0.46 2.56 -0.00 3.97 2.02 -0.76 -1.45 117.35 124.15 1cfm s TYR 149 Ca -0.07 -0.42 0.03 0.00 -0.37 0.00 0.00 57.07 56.24 1cfm s TYR 149 Cb -0.11 -1.61 -0.01 0.00 -0.40 0.00 0.00 41.96 39.83 1cfm s TYR 149 CO 0.01 -0.01 -0.09 0.12 -1.57 0.00 0.00 175.55 174.00 1cfm s PHE 150 N -0.44 0.79 -0.09 2.71 5.36 0.01 -0.27 117.98 126.04 1cfm s PHE 150 Ca 0.05 -0.16 -0.01 0.00 -0.96 0.00 0.00 56.93 55.85 1cfm s PHE 150 Cb -0.12 -0.51 0.03 0.00 -0.34 0.00 0.00 43.02 42.09 1cfm s PHE 150 CO 0.01 -0.01 -0.00 0.20 -1.46 0.00 0.00 175.22 173.96 1cfm s GLY 151 N -0.26 0.55 -0.03 13.12 0.00 -0.59 -1.24 107.32 118.87 1cfm s GLY 151 Ca 0.03 -0.25 0.04 0.00 0.00 0.00 0.00 44.72 44.54 1cfm s GLY 151 CO -0.00 1.14 -0.17 -0.32 0.00 0.00 0.00 173.10 173.75 1cfm s GLY 152 N 1.93 0.88 0.18 0.20 0.00 0.17 -0.85 107.32 109.82 1cfm s GLY 152 Ca 0.04 -0.68 0.07 0.00 0.00 0.00 0.00 44.72 44.14 1cfm s GLY 152 CO -0.06 -0.41 -0.14 0.21 0.00 0.00 0.00 173.10 172.70 1cfm s ASN 153 N -0.07 2.31 -0.11 1.64 2.47 0.38 -1.24 114.94 120.32 1cfm s ASN 153 Ca -0.01 -0.98 -0.09 0.00 0.42 0.00 0.00 52.86 52.20 1cfm s ASN 153 Cb -0.10 -0.10 0.03 0.00 -1.45 0.00 0.00 41.25 39.63 1cfm s ASN 153 CO 0.01 -0.20 0.29 0.00 -3.72 0.00 0.00 177.10 173.48 1cfm s ARG 154 N -3.49 0.32 0.00 0.43 3.03 -0.97 -1.54 118.95 116.74 1cfm s ARG 154 Ca 0.19 0.43 0.00 0.00 2.03 0.00 0.00 55.73 58.38 1cfm s ARG 154 Cb -0.01 0.12 0.00 0.00 -1.03 0.00 0.00 34.95 34.04 1cfm s ARG 154 CO 0.05 -0.06 0.00 0.41 -1.13 0.00 0.00 175.30 174.57 1cfm n GLY 155 N 3.13 0.18 3.77 3.88 0.00 -0.41 -0.99 105.19 114.76 1cfm n GLY 155 Ca -0.15 -1.62 -0.38 0.00 0.00 0.00 0.00 46.02 43.87 1cfm n GLY 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1cfm s ARG 156 N -3.63 4.09 1.03 1.61 0.52 -1.26 -4.81 118.95 116.51 1cfm s ARG 156 Ca 0.00 1.86 -0.15 0.00 -0.52 0.00 0.00 55.73 56.92 1cfm s ARG 156 Cb 0.00 -2.72 0.21 0.00 0.52 0.00 0.00 34.95 32.96 1cfm s ARG 156 CO 0.00 -0.29 1.14 0.20 0.02 0.00 0.00 175.30 176.36 1cfm s GLY 157 N -1.08 1.60 -0.03 -3.53 0.00 -1.26 -4.92 107.32 98.09 1cfm s GLY 157 Ca 0.56 -0.70 0.20 0.00 0.00 0.00 0.00 44.72 44.78 1cfm s GLY 157 CO 0.40 0.00 0.51 -1.06 0.00 0.00 0.00 173.10 172.95 1cfm n GLN 158 N -4.19 0.65 -3.86 2.90 3.00 0.02 -4.59 117.38 111.30 1cfm n GLN 158 Ca 0.09 -0.01 -0.11 0.00 -0.01 0.00 0.00 57.00 56.96 1cfm n GLN 158 Cb 0.59 -1.62 -0.11 0.00 0.00 0.00 0.00 30.24 29.09 1cfm n GLN 158 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.06 177.60 1cfm s VAL 159 N -3.08 0.05 0.62 5.09 0.11 -1.24 -1.01 120.40 120.95 1cfm s VAL 159 Ca -0.06 -0.39 -0.02 0.00 -2.93 0.00 0.00 61.98 58.57 1cfm s VAL 159 Cb 0.10 -0.30 0.05 0.00 -1.53 0.00 0.00 36.38 34.70 1cfm s VAL 159 CO 0.85 -0.22 0.89 -0.31 -3.33 0.00 0.00 175.10 172.98 1cfm s TYR 160 N -0.71 2.83 0.50 1.54 1.51 0.41 -4.82 117.35 118.60 1cfm s TYR 160 Ca -0.08 0.17 0.25 0.00 -1.01 0.00 0.00 57.07 56.40 1cfm s TYR 160 Cb -0.05 -2.96 1.32 0.00 -0.11 0.00 0.00 41.96 40.17 1cfm s TYR 160 CO 0.01 -1.14 1.92 -1.35 -1.11 0.00 0.00 175.55 173.88 1cfm h PRO 161 N -0.24 0.13 -0.36 -1.71 0.11 -1.97 -0.39 132.00 127.57 1cfm h PRO 161 Ca -0.43 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1cfm h PRO 161 Cb 1.30 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1cfm h PRO 161 CO 0.55 0.08 0.00 -0.40 -0.21 0.00 0.00 178.00 178.02 1cfm n ASP 162 N -4.38 2.07 0.00 -2.05 5.75 -1.26 -4.92 116.55 111.77 1cfm n ASP 162 Ca 0.15 -1.95 0.00 0.00 -0.01 0.00 0.00 54.79 52.99 1cfm n ASP 162 Cb 0.74 -0.24 0.00 0.00 -1.03 0.00 0.00 41.12 40.60 1cfm n ASP 162 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1cfm n GLY 163 N 1.14 1.38 3.78 6.12 0.00 -0.16 -5.04 105.19 112.41 1cfm n GLY 163 Ca 0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.80 1cfm n GLY 163 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1cfm s LYS 164 N -0.46 3.69 0.41 1.61 1.02 -1.26 -4.73 119.74 120.01 1cfm s LYS 164 Ca 0.00 1.64 -0.15 0.00 0.02 0.00 0.00 55.97 57.48 1cfm s LYS 164 Cb 0.00 -2.26 -0.08 0.00 -0.52 0.00 0.00 37.83 34.96 1cfm s LYS 164 CO 0.00 -0.58 0.84 0.15 -0.92 0.00 0.00 175.35 174.84 1cfm s LYS 165 N -2.92 3.97 0.73 1.68 1.02 -1.26 -0.44 119.74 122.52 1cfm s LYS 165 Ca 0.66 0.75 -0.01 0.00 0.02 0.00 0.00 55.97 57.40 1cfm s LYS 165 Cb -0.25 -2.31 0.14 0.00 -0.52 0.00 0.00 37.83 34.89 1cfm s LYS 165 CO 0.30 -0.02 1.01 -1.54 -0.92 0.00 0.00 175.35 174.17 1cfm s SER 166 N -2.68 4.27 0.00 2.83 1.04 -0.18 -4.84 113.70 114.14 1cfm s SER 166 Ca 0.56 -0.42 0.15 0.00 0.48 0.00 0.00 55.95 56.72 1cfm s SER 166 Cb -0.10 0.09 0.49 0.00 0.10 0.00 0.00 66.02 66.60 1cfm s SER 166 CO 0.24 -1.92 1.38 -0.46 0.98 0.00 0.00 173.24 173.45 1cfm n ASN 167 N -2.86 1.95 -2.74 7.02 6.94 -1.26 -4.16 115.26 120.15 1cfm n ASN 167 Ca 0.16 -1.90 -0.36 0.00 -0.02 0.00 0.00 54.58 52.47 1cfm n ASN 167 Cb 0.61 -0.20 0.03 0.00 -2.36 0.00 0.00 39.78 37.85 1cfm n ASN 167 CO 0.00 0.00 0.00 -3.20 -1.03 0.00 0.00 177.26 173.03 1cfm n ASN 168 N 0.54 6.65 -3.19 0.53 5.15 -1.26 -3.98 115.26 119.69 1cfm n ASN 168 Ca 0.14 -3.80 -0.10 0.00 -0.60 0.00 0.00 54.58 50.22 1cfm n ASN 168 Cb 0.33 -0.87 -0.00 0.00 -0.53 0.00 0.00 39.78 38.71 1cfm n ASN 168 CO 0.00 0.00 0.00 0.28 1.40 0.00 0.00 177.26 178.94 1cfm s THR 169 N -5.20 0.00 0.16 -0.44 -1.32 -1.26 -4.15 115.64 103.44 1cfm s THR 169 Ca 0.51 -1.17 -0.30 0.00 -1.21 0.00 0.00 61.69 59.53 1cfm s THR 169 Cb 0.43 -2.67 -0.07 0.00 -1.51 0.00 0.00 72.50 68.68 1cfm s THR 169 CO -0.32 0.00 1.01 -0.63 -2.21 0.00 0.00 174.62 172.46 1cfm s ILE 170 N -2.80 4.18 -0.12 5.08 1.01 -1.26 -4.57 121.20 122.72 1cfm s ILE 170 Ca 0.19 1.91 -0.02 0.00 0.00 0.00 0.00 60.65 62.73 1cfm s ILE 170 Cb -0.04 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.18 1cfm s ILE 170 CO 0.13 0.34 -0.05 -0.31 0.00 0.00 0.00 174.94 175.05 1cfm s TYR 171 N -0.34 3.01 0.21 3.97 1.51 -1.26 -5.02 117.35 119.43 1cfm s TYR 171 Ca 0.46 -0.15 0.11 0.00 -1.01 0.00 0.00 57.07 56.48 1cfm s TYR 171 Cb -0.26 -1.86 -0.05 0.00 -0.11 0.00 0.00 41.96 39.69 1cfm s TYR 171 CO 0.32 0.13 -0.21 -0.80 -1.11 0.00 0.00 175.55 173.88 1cfm s ASN 172 N -0.15 3.57 0.32 2.29 -0.87 -1.26 0.72 114.94 119.57 1cfm s ASN 172 Ca 0.03 -0.87 -0.29 0.00 -1.57 0.00 0.00 52.86 50.15 1cfm s ASN 172 Cb -0.13 -0.32 -0.11 0.00 -0.02 0.00 0.00 41.25 40.67 1cfm s ASN 172 CO 0.03 0.10 1.53 0.00 -2.57 0.00 0.00 177.10 176.18 1cfm s ALA 173 N -1.87 3.66 -0.02 0.60 0.00 0.18 -4.80 121.76 119.51 1cfm s ALA 173 Ca 0.23 1.54 0.17 0.00 0.00 0.00 0.00 51.96 53.91 1cfm s ALA 173 Cb -0.07 -3.62 0.36 0.00 0.00 0.00 0.00 23.12 19.79 1cfm s ALA 173 CO 0.12 -0.98 1.58 0.66 0.00 0.00 0.00 175.76 177.14 1cfm h SER 174 N 4.14 0.00 -5.03 0.00 4.64 -1.91 0.21 113.55 115.59 1cfm h SER 174 Ca -0.48 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.78 1cfm h SER 174 Cb 1.23 0.00 -0.15 0.00 -0.31 0.00 0.00 62.40 63.17 1cfm h SER 174 CO 0.73 0.43 0.03 0.00 -0.87 0.00 0.00 176.83 177.15 1cfm s ALA 175 N -3.24 -1.25 0.21 5.18 0.00 -1.26 -4.72 121.76 116.68 1cfm s ALA 175 Ca 0.02 0.39 -0.30 0.00 0.00 0.00 0.00 51.96 52.08 1cfm s ALA 175 Cb 0.09 0.55 -0.08 0.00 0.00 0.00 0.00 23.12 23.68 1cfm s ALA 175 CO 0.71 -0.58 1.08 0.00 0.00 0.00 0.00 175.76 176.97 1cfm s ALA 176 N -3.03 3.37 0.00 0.00 0.00 -1.26 -4.32 121.76 116.53 1cfm s ALA 176 Ca -0.02 0.81 0.00 0.00 0.00 0.00 0.00 51.96 52.75 1cfm s ALA 176 Cb -0.00 -3.33 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1cfm s ALA 176 CO -0.06 -0.14 0.00 0.41 0.00 0.00 0.00 175.76 175.96 1cfm n GLY 177 N 1.76 -1.03 3.47 0.00 0.00 -0.89 -4.29 105.19 104.21 1cfm n GLY 177 Ca 0.01 -0.94 -0.33 0.00 0.00 0.00 0.00 46.02 44.75 1cfm n GLY 177 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1cfm s LYS 178 N -0.94 3.17 -0.50 1.61 2.20 -0.23 -0.97 119.74 124.08 1cfm s LYS 178 Ca 0.00 -0.61 -0.28 0.00 -0.36 0.00 0.00 55.97 54.73 1cfm s LYS 178 Cb 0.00 -2.66 -0.01 0.00 -1.51 0.00 0.00 37.83 33.65 1cfm s LYS 178 CO 0.00 0.39 1.72 0.42 -0.36 0.00 0.00 175.35 177.53 1cfm s ILE 179 N -0.10 3.52 -0.74 5.43 1.01 0.55 -0.36 121.20 130.52 1cfm s ILE 179 Ca -0.00 0.44 0.25 0.00 0.00 0.00 0.00 60.65 61.33 1cfm s ILE 179 Cb -0.13 -3.96 0.06 0.00 0.01 0.00 0.00 42.46 38.44 1cfm s ILE 179 CO 0.03 -0.78 1.39 1.33 0.00 0.00 0.00 174.94 176.91 1cfm n VAL 180 N 7.20 0.27 -3.60 2.92 0.24 0.21 0.23 118.33 125.80 1cfm n VAL 180 Ca 0.19 -0.20 -0.11 0.00 -2.04 0.00 0.00 64.34 62.18 1cfm n VAL 180 Cb 0.50 -0.09 -0.06 0.00 -1.47 0.00 0.00 33.84 32.72 1cfm n VAL 180 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1cfm s ALA 181 N -3.12 -1.92 -0.12 2.33 0.00 -1.21 -4.85 121.76 112.87 1cfm s ALA 181 Ca 0.08 1.70 -0.03 0.00 0.00 0.00 0.00 51.96 53.71 1cfm s ALA 181 Cb 0.14 -0.94 0.04 0.00 0.00 0.00 0.00 23.12 22.37 1cfm s ALA 181 CO 0.70 -0.29 0.04 0.42 0.00 0.00 0.00 175.76 176.63 1cfm s ILE 182 N -0.50 0.25 0.26 0.00 1.01 -1.26 -0.02 121.20 120.94 1cfm s ILE 182 Ca -0.01 -0.07 0.08 0.00 0.00 0.00 0.00 60.65 60.65 1cfm s ILE 182 Cb -0.02 -0.62 -0.05 0.00 0.01 0.00 0.00 42.46 41.77 1cfm s ILE 182 CO -0.00 0.02 -0.13 -0.89 0.00 0.00 0.00 174.94 173.94 1cfm s THR 183 N 2.00 1.91 -0.03 2.92 2.01 -0.75 -4.94 115.64 118.76 1cfm s THR 183 Ca 0.03 -2.23 -0.30 0.00 0.31 0.00 0.00 61.69 59.50 1cfm s THR 183 Cb -0.14 -2.28 -0.04 0.00 0.01 0.00 0.00 72.50 70.05 1cfm s THR 183 CO -0.06 -0.43 1.16 0.00 -0.69 0.00 0.00 174.62 174.60 1cfm s ALA 184 N -2.85 3.43 0.22 7.40 0.00 -1.26 -0.13 121.76 128.57 1cfm s ALA 184 Ca 0.27 0.64 -0.08 0.00 0.00 0.00 0.00 51.96 52.79 1cfm s ALA 184 Cb -0.00 -3.47 0.18 0.00 0.00 0.00 0.00 23.12 19.83 1cfm s ALA 184 CO 0.11 -0.62 1.83 1.25 0.00 0.00 0.00 175.76 178.33 1cfm h LEU 185 N 7.72 1.08 -8.01 0.00 5.85 -1.13 -3.41 115.31 117.41 1cfm h LEU 185 Ca -0.36 -0.12 -0.53 0.00 0.84 0.00 0.00 57.88 57.71 1cfm h LEU 185 Cb 1.18 -0.28 -0.33 0.00 0.37 0.00 0.00 40.66 41.60 1cfm h LEU 185 CO 0.85 0.89 -0.82 -0.55 -0.34 0.00 0.00 178.44 178.47 1cfm s SER 186 N -6.22 1.92 0.25 1.25 0.15 -0.31 -4.98 113.70 105.76 1cfm s SER 186 Ca -0.13 -0.33 -0.04 0.00 0.70 0.00 0.00 55.95 56.16 1cfm s SER 186 Cb 0.16 -0.89 0.40 0.00 -1.71 0.00 0.00 66.02 63.98 1cfm s SER 186 CO 0.82 0.04 1.84 -0.33 1.20 0.00 0.00 173.24 176.82 1cfm h GLU 187 N 6.97 0.92 0.00 5.44 5.08 -1.85 -3.05 114.58 128.09 1cfm h GLU 187 Ca -0.30 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.01 1cfm h GLU 187 Cb 1.19 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 30.23 1cfm h GLU 187 CO 0.47 0.61 -0.37 0.36 -1.00 0.00 0.00 179.01 179.08 1cfm n LYS 188 N -4.64 4.67 -0.04 2.33 2.85 -1.26 -4.70 118.16 117.36 1cfm n LYS 188 Ca 0.14 -0.01 0.08 0.00 -1.05 0.00 0.00 58.31 57.48 1cfm n LYS 188 Cb 0.24 -0.79 0.09 0.00 -0.65 0.00 0.00 35.03 33.92 1cfm n LYS 188 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 177.40 178.98 1cfm n LYS 189 N -1.19 1.52 0.00 -1.58 4.76 -1.24 -5.10 118.16 115.32 1cfm n LYS 189 Ca 0.01 -1.61 0.00 0.00 -2.87 0.00 0.00 58.31 53.84 1cfm n LYS 189 Cb 0.09 -1.32 0.00 0.00 -1.84 0.00 0.00 35.03 31.95 1cfm n LYS 189 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1cfm n GLY 190 N 0.92 -1.73 0.00 0.72 0.00 -1.15 -4.69 105.19 99.25 1cfm n GLY 190 Ca 0.11 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.48 1cfm n GLY 190 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cfm n GLY 191 N 0.00 -1.00 3.10 -0.02 0.00 -1.26 -1.16 105.19 104.85 1cfm n GLY 191 Ca 0.00 -1.60 -0.08 0.00 0.00 0.00 0.00 46.02 44.34 1cfm n GLY 191 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1cfm s PHE 192 N -3.00 0.59 -0.24 1.61 0.08 0.24 -0.94 117.98 116.30 1cfm s PHE 192 Ca 0.00 -1.01 -0.01 0.00 0.12 0.00 0.00 56.93 56.03 1cfm s PHE 192 Cb 0.00 -0.41 0.07 0.00 -0.57 0.00 0.00 43.02 42.11 1cfm s PHE 192 CO 0.00 -0.32 0.01 -1.21 -0.10 0.00 0.00 175.22 173.60 1cfm s GLU 193 N -3.79 1.11 -0.32 0.44 2.02 0.82 0.14 118.70 119.12 1cfm s GLU 193 Ca 0.07 -0.87 -0.15 0.00 0.02 0.00 0.00 54.97 54.04 1cfm s GLU 193 Cb 0.07 -2.34 -0.02 0.00 0.10 0.00 0.00 34.13 31.93 1cfm s GLU 193 CO -0.09 -0.71 0.35 0.08 0.02 0.00 0.00 175.26 174.91 1cfm s VAL 194 N 1.56 5.18 -0.31 2.63 1.01 0.12 -1.81 120.40 128.79 1cfm s VAL 194 Ca -0.00 0.19 -0.19 0.00 0.00 0.00 0.00 61.98 61.98 1cfm s VAL 194 Cb -0.18 -3.77 -0.01 0.00 0.00 0.00 0.00 36.38 32.42 1cfm s VAL 194 CO -0.11 -0.00 0.54 -0.44 0.00 0.00 0.00 175.10 175.09 1cfm s SER 195 N 1.71 6.40 -0.28 3.32 0.01 0.97 -0.74 113.70 125.09 1cfm s SER 195 Ca 0.12 0.29 -0.06 0.00 1.31 0.00 0.00 55.95 57.62 1cfm s SER 195 Cb -0.16 -2.29 0.01 0.00 0.21 0.00 0.00 66.02 63.79 1cfm s SER 195 CO 0.11 -0.41 0.05 -0.63 0.41 0.00 0.00 173.24 172.77 1cfm s ILE 196 N 2.43 3.80 -0.44 1.44 1.01 0.07 -0.62 121.20 128.89 1cfm s ILE 196 Ca 0.21 -0.69 -0.21 0.00 0.00 0.00 0.00 60.65 59.96 1cfm s ILE 196 Cb -0.15 -2.93 0.02 0.00 0.01 0.00 0.00 42.46 39.41 1cfm s ILE 196 CO 0.11 0.13 0.66 -0.70 0.00 0.00 0.00 174.94 175.15 1cfm s GLU 197 N 1.48 3.31 0.32 2.79 2.12 0.51 -1.97 118.70 127.27 1cfm s GLU 197 Ca 0.03 -0.32 -0.09 0.00 0.36 0.00 0.00 54.97 54.95 1cfm s GLU 197 Cb -0.17 -3.94 -0.06 0.00 0.26 0.00 0.00 34.13 30.21 1cfm s GLU 197 CO 0.01 -1.02 0.65 -1.59 -0.54 0.00 0.00 175.26 172.78 1cfm s LYS 198 N 2.89 3.77 0.00 4.30 -2.85 0.03 -1.07 119.74 126.80 1cfm s LYS 198 Ca 0.24 0.31 0.00 0.00 -1.00 0.00 0.00 55.97 55.51 1cfm s LYS 198 Cb -0.14 -2.53 0.00 0.00 -2.06 0.00 0.00 37.83 33.10 1cfm s LYS 198 CO 0.19 0.14 0.00 0.00 0.10 0.00 0.00 175.35 175.78 1cfm n ALA 199 N -0.82 0.00 0.02 0.59 0.00 -1.26 0.30 120.51 119.34 1cfm n ALA 199 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.40 1cfm n ALA 199 Cb 0.53 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.00 1cfm n ALA 199 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1cfm n ASN 200 N -3.98 4.40 0.00 0.00 6.94 -1.26 -4.83 115.26 116.54 1cfm n ASN 200 Ca 0.00 -2.43 0.00 0.00 -0.02 0.00 0.00 54.58 52.13 1cfm n ASN 200 Cb 0.00 -0.83 0.00 0.00 -2.36 0.00 0.00 39.78 36.59 1cfm n ASN 200 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1cfm n GLY 201 N 0.69 0.96 3.75 4.83 0.00 0.15 -4.95 105.19 110.62 1cfm n GLY 201 Ca 0.09 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.74 1cfm n GLY 201 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1cfm s GLU 202 N 0.00 2.96 -0.06 1.61 2.02 -1.22 -4.68 118.70 119.32 1cfm s GLU 202 Ca 0.00 2.08 0.04 0.00 0.02 0.00 0.00 54.97 57.11 1cfm s GLU 202 Cb 0.00 -2.08 -0.00 0.00 0.10 0.00 0.00 34.13 32.15 1cfm s GLU 202 CO 0.00 -1.28 -0.19 0.08 0.02 0.00 0.00 175.26 173.89 1cfm s VAL 203 N -1.40 1.64 0.19 2.63 1.01 -1.26 -0.79 120.40 122.42 1cfm s VAL 203 Ca 0.76 -0.81 0.11 0.00 0.00 0.00 0.00 61.98 62.04 1cfm s VAL 203 Cb -0.37 -1.42 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1cfm s VAL 203 CO 0.42 0.46 -0.23 0.68 0.00 0.00 0.00 175.10 176.44 1cfm s VAL 204 N 0.20 2.43 -0.22 2.92 -7.23 -0.83 -4.96 120.40 112.71 1cfm s VAL 204 Ca -0.10 -2.01 0.01 0.00 -1.81 0.00 0.00 61.98 58.08 1cfm s VAL 204 Cb -0.14 -2.17 0.05 0.00 0.56 0.00 0.00 36.38 34.68 1cfm s VAL 204 CO 0.04 -0.12 -0.09 -0.69 -0.31 0.00 0.00 175.10 173.93 1cfm s VAL 205 N -1.68 1.71 -0.18 1.32 1.01 -1.26 -0.75 120.40 120.57 1cfm s VAL 205 Ca 0.21 -1.17 -0.19 0.00 0.00 0.00 0.00 61.98 60.84 1cfm s VAL 205 Cb -0.08 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.43 1cfm s VAL 205 CO 0.10 0.07 0.52 -1.81 0.00 0.00 0.00 175.10 173.98 1cfm s ASP 206 N 1.34 6.61 -0.22 3.32 1.01 0.08 -4.87 116.67 123.94 1cfm s ASP 206 Ca -0.04 0.73 -0.17 0.00 0.71 0.00 0.00 52.55 53.78 1cfm s ASP 206 Cb -0.17 -2.30 -0.03 0.00 1.01 0.00 0.00 42.92 41.43 1cfm s ASP 206 CO -0.07 -0.14 0.47 -0.54 0.21 0.00 0.00 175.17 175.10 1cfm s LYS 207 N 1.37 4.15 -0.22 8.23 1.02 -1.26 -0.70 119.74 132.33 1cfm s LYS 207 Ca 0.25 0.30 -0.00 0.00 0.02 0.00 0.00 55.97 56.54 1cfm s LYS 207 Cb -0.15 -3.58 0.02 0.00 -0.52 0.00 0.00 37.83 33.60 1cfm s LYS 207 CO 0.10 -0.16 -0.13 0.42 -0.92 0.00 0.00 175.35 174.66 1cfm s ILE 208 N 1.69 2.48 1.04 2.17 1.01 0.12 -4.98 121.20 124.73 1cfm s ILE 208 Ca 0.21 -1.01 -0.12 0.00 0.00 0.00 0.00 60.65 59.73 1cfm s ILE 208 Cb -0.15 -2.18 0.22 0.00 0.01 0.00 0.00 42.46 40.35 1cfm s ILE 208 CO 0.09 0.34 1.07 -2.16 0.00 0.00 0.00 174.94 174.28 1cfm s PRO 209 N 1.30 0.04 0.32 2.79 0.04 -1.26 0.80 135.00 139.02 1cfm s PRO 209 Ca 0.02 0.99 -0.29 0.00 0.04 0.00 0.00 61.00 61.76 1cfm s PRO 209 Cb -0.15 -1.65 -0.10 0.00 0.04 0.00 0.00 34.50 32.63 1cfm s PRO 209 CO -0.08 -3.12 1.23 0.00 0.04 0.00 0.00 177.00 175.06 1cfm s ALA 210 N -2.63 3.45 0.00 8.56 0.00 -1.26 -4.28 121.76 125.60 1cfm s ALA 210 Ca 0.67 1.12 0.00 0.00 0.00 0.00 0.00 51.96 53.75 1cfm s ALA 210 Cb -0.23 -3.42 0.00 0.00 0.00 0.00 0.00 23.12 19.47 1cfm s ALA 210 CO 0.61 -0.47 0.00 0.41 0.00 0.00 0.00 175.76 176.31 1cfm n GLY 211 N 0.93 1.25 3.79 0.00 0.00 -1.26 -4.21 105.19 105.69 1cfm n GLY 211 Ca -0.00 -0.23 -0.31 0.00 0.00 0.00 0.00 46.02 45.47 1cfm n GLY 211 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1cfm s PRO 212 N 0.00 2.54 -0.07 1.61 0.04 -1.26 -4.92 135.00 132.95 1cfm s PRO 212 Ca 0.00 1.03 -0.01 0.00 0.04 0.00 0.00 61.00 62.06 1cfm s PRO 212 Cb 0.00 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.57 1cfm s PRO 212 CO 0.00 -1.40 -0.01 -0.51 0.04 0.00 0.00 177.00 175.12 1cfm s ASP 213 N -3.62 5.09 0.32 6.66 1.01 -1.26 -4.94 116.67 119.93 1cfm s ASP 213 Ca 0.60 0.09 -0.28 0.00 0.71 0.00 0.00 52.55 53.66 1cfm s ASP 213 Cb -0.15 -1.39 -0.10 0.00 1.01 0.00 0.00 42.92 42.29 1cfm s ASP 213 CO 0.55 0.36 1.20 -0.76 0.21 0.00 0.00 175.17 176.74 1cfm s LEU 214 N -0.94 4.45 -0.01 1.23 1.43 -1.26 -1.32 118.68 122.25 1cfm s LEU 214 Ca 0.14 2.46 0.05 0.00 -1.03 0.00 0.00 54.13 55.75 1cfm s LEU 214 Cb -0.11 -3.69 0.15 0.00 0.03 0.00 0.00 46.19 42.56 1cfm s LEU 214 CO 0.03 -0.39 1.12 2.30 0.23 0.00 0.00 176.35 179.64 1cfm n ILE 215 N 0.86 1.07 -4.50 -0.59 -5.35 -0.07 -4.85 119.36 105.93 1cfm n ILE 215 Ca 0.00 -1.07 -0.25 0.00 -0.27 0.00 0.00 62.75 61.16 1cfm n ILE 215 Cb 0.44 0.45 -0.10 0.00 -1.74 0.00 0.00 39.64 38.69 1cfm n ILE 215 CO 0.00 0.00 0.00 0.68 -1.76 0.00 0.00 176.55 175.47 1cfm s VAL 216 N -1.12 2.37 0.15 7.28 -7.23 -1.25 -4.98 120.40 115.62 1cfm s VAL 216 Ca 0.12 -2.23 0.05 0.00 -1.81 0.00 0.00 61.98 58.10 1cfm s VAL 216 Cb 0.07 -2.57 -0.04 0.00 0.56 0.00 0.00 36.38 34.39 1cfm s VAL 216 CO 0.07 -0.26 -0.10 -0.54 -0.31 0.00 0.00 175.10 173.96 1cfm s LYS 217 N -3.59 1.08 0.46 4.82 3.01 -1.26 -5.10 119.74 119.15 1cfm s LYS 217 Ca 0.32 -1.46 -0.24 0.00 -1.01 0.00 0.00 55.97 53.58 1cfm s LYS 217 Cb -0.00 -0.63 -0.07 0.00 -1.01 0.00 0.00 37.83 36.11 1cfm s LYS 217 CO 0.16 0.07 1.26 -2.00 0.51 0.00 0.00 175.35 175.36 1cfm s GLU 218 N -3.75 3.69 0.00 1.68 2.12 -1.26 -2.04 118.70 119.14 1cfm s GLU 218 Ca 0.17 2.02 0.00 0.00 0.36 0.00 0.00 54.97 57.52 1cfm s GLU 218 Cb 0.03 -2.50 0.00 0.00 0.26 0.00 0.00 34.13 31.91 1cfm s GLU 218 CO 0.01 -0.68 0.00 0.41 -0.54 0.00 0.00 175.26 174.46 1cfm n GLY 219 N 0.60 3.07 3.80 -1.50 0.00 0.13 -5.01 105.19 106.28 1cfm n GLY 219 Ca 0.07 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.73 1cfm n GLY 219 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1cfm s GLN 220 N -0.59 4.31 -0.15 1.61 0.74 -0.87 -4.75 119.66 119.96 1cfm s GLN 220 Ca 0.00 1.29 -0.05 0.00 0.05 0.00 0.00 55.36 56.66 1cfm s GLN 220 Cb 0.00 -2.47 -0.03 0.00 1.10 0.00 0.00 33.01 31.61 1cfm s GLN 220 CO 0.00 0.02 0.02 0.99 -0.55 0.00 0.00 175.29 175.77 1cfm s THR 221 N -1.86 4.38 0.36 -0.34 2.01 -1.26 -0.33 115.64 118.61 1cfm s THR 221 Ca 0.57 -0.19 0.06 0.00 0.31 0.00 0.00 61.69 62.45 1cfm s THR 221 Cb -0.16 -2.93 -0.07 0.00 0.01 0.00 0.00 72.50 69.35 1cfm s THR 221 CO 0.20 0.51 0.01 0.68 -0.69 0.00 0.00 174.62 175.32 1cfm s VAL 222 N 0.08 1.74 0.23 3.82 -7.23 -0.14 -5.00 120.40 113.90 1cfm s VAL 222 Ca 0.03 -2.04 0.09 0.00 -1.81 0.00 0.00 61.98 58.25 1cfm s VAL 222 Cb -0.13 -2.84 -0.04 0.00 0.56 0.00 0.00 36.38 33.93 1cfm s VAL 222 CO 0.02 -0.06 -0.03 -1.10 -0.31 0.00 0.00 175.10 173.62 1cfm s GLN 223 N -3.76 2.26 0.34 4.82 -0.21 -1.26 -2.11 119.66 119.74 1cfm s GLN 223 Ca 0.35 -1.33 -0.27 0.00 0.02 0.00 0.00 55.36 54.13 1cfm s GLN 223 Cb 0.08 -2.20 -0.13 0.00 1.00 0.00 0.00 33.01 31.77 1cfm s GLN 223 CO 0.16 0.40 1.02 0.00 -2.12 0.00 0.00 175.29 174.75 1cfm n ALA 224 N -0.53 0.02 -0.74 6.09 0.00 -1.26 -1.15 120.51 122.94 1cfm n ALA 224 Ca -0.08 0.33 0.00 0.00 0.00 0.00 0.00 53.44 53.69 1cfm n ALA 224 Cb 0.57 -2.05 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1cfm n ALA 224 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1cfm n ASP 225 N 0.96 -0.98 -4.73 0.00 9.92 0.74 -4.92 116.55 117.55 1cfm n ASP 225 Ca 0.09 0.00 -0.42 0.00 -0.53 0.00 0.00 54.79 53.93 1cfm n ASP 225 Cb 0.35 -1.79 -0.03 0.00 -0.64 0.00 0.00 41.12 39.01 1cfm n ASP 225 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 1cfm s GLN 226 N -0.78 4.33 0.26 -1.24 0.74 -0.30 -4.48 119.66 118.19 1cfm s GLN 226 Ca 0.00 2.11 -0.31 0.00 0.05 0.00 0.00 55.36 57.21 1cfm s GLN 226 Cb 0.00 -3.21 -0.12 0.00 1.10 0.00 0.00 33.01 30.78 1cfm s GLN 226 CO 0.00 -0.38 1.56 -0.35 -0.55 0.00 0.00 175.29 175.56 1cfm n PRO 227 N 3.35 2.48 -0.00 1.67 -0.04 -1.26 -0.64 135.00 140.55 1cfm n PRO 227 Ca 0.09 0.88 0.08 0.00 -0.04 0.00 0.00 63.50 64.52 1cfm n PRO 227 Cb 0.42 -2.64 -0.10 0.00 -0.04 0.00 0.00 33.50 31.14 1cfm n PRO 227 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1cfm n LEU 228 N 2.48 0.79 -4.26 1.53 4.77 0.22 -4.84 117.00 117.70 1cfm n LEU 228 Ca 0.11 -0.49 -0.17 0.00 -0.03 0.00 0.00 56.01 55.43 1cfm n LEU 228 Cb 0.34 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.35 1cfm n LEU 228 CO 0.63 0.20 -0.15 0.42 -1.33 0.00 0.00 177.39 177.16 1cfm s THR 229 N -2.62 0.00 0.00 -5.08 -4.23 -1.17 -0.89 115.64 101.66 1cfm s THR 229 Ca 0.06 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1cfm s THR 229 Cb 0.13 -2.50 0.00 0.00 1.34 0.00 0.00 72.50 71.47 1cfm s THR 229 CO 0.70 0.00 0.00 -0.46 -0.54 0.00 0.00 174.62 174.32 1cfm n ASN 230 N -1.15 0.00 -4.15 3.99 6.94 -0.43 -4.66 115.26 115.80 1cfm n ASN 230 Ca 0.06 -0.99 -0.35 0.00 -0.02 0.00 0.00 54.58 53.27 1cfm n ASN 230 Cb 0.63 0.00 -0.13 0.00 -2.36 0.00 0.00 39.78 37.92 1cfm n ASN 230 CO 0.00 0.00 0.00 0.21 -1.03 0.00 0.00 177.26 176.44 1cfm s ASN 231 N -1.00 5.03 0.53 0.53 2.47 -1.26 -4.19 114.94 117.06 1cfm s ASN 231 Ca 0.00 -1.61 0.34 0.00 0.42 0.00 0.00 52.86 52.01 1cfm s ASN 231 Cb 0.00 -1.76 1.47 0.00 -1.45 0.00 0.00 41.25 39.51 1cfm s ASN 231 CO 0.00 -0.38 2.00 1.55 -3.72 0.00 0.00 177.10 176.56 1cfm h PRO 232 N 8.00 0.00 -6.47 0.43 0.13 -1.85 -3.45 132.00 128.78 1cfm h PRO 232 Ca -0.17 0.00 -0.55 0.00 -0.87 0.00 0.00 66.00 64.41 1cfm h PRO 232 Cb 1.05 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.22 1cfm h PRO 232 CO 0.59 0.00 1.08 -1.71 -0.23 0.00 0.00 178.00 177.74 1cfm n ASN 233 N -2.99 3.88 0.00 1.44 5.15 -1.26 -4.53 115.26 116.95 1cfm n ASN 233 Ca 0.00 0.99 0.00 0.00 -0.60 0.00 0.00 54.58 54.97 1cfm n ASN 233 Cb 0.26 -1.51 0.00 0.00 -0.53 0.00 0.00 39.78 38.00 1cfm n ASN 233 CO 0.00 0.00 0.00 1.33 1.40 0.00 0.00 177.26 179.99 1cfm n VAL 234 N 4.68 0.46 -1.70 3.44 0.24 -1.26 -5.05 118.33 119.14 1cfm n VAL 234 Ca 0.19 -0.62 0.00 0.00 -2.04 0.00 0.00 64.34 61.86 1cfm n VAL 234 Cb 0.36 0.86 0.00 0.00 -1.47 0.00 0.00 33.84 33.58 1cfm n VAL 234 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1cfm n GLY 235 N -0.23 1.68 0.00 7.63 0.00 -1.26 -4.97 105.19 108.04 1cfm n GLY 235 Ca 0.00 -1.98 0.00 0.00 0.00 0.00 0.00 46.02 44.04 1cfm n GLY 235 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1cfm n GLY 236 N 5.00 1.88 3.34 -0.02 0.00 -0.16 -4.83 105.19 110.40 1cfm n GLY 236 Ca 0.00 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.92 1cfm n GLY 236 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1cfm s PHE 237 N -2.00 2.57 0.06 1.61 5.36 0.71 -2.28 117.98 124.01 1cfm s PHE 237 Ca 0.00 -0.55 0.02 0.00 -0.96 0.00 0.00 56.93 55.44 1cfm s PHE 237 Cb 0.00 -1.65 -0.03 0.00 -0.34 0.00 0.00 43.02 41.00 1cfm s PHE 237 CO 0.00 -0.10 -0.08 0.20 -1.46 0.00 0.00 175.22 173.78 1cfm s GLY 238 N -0.24 0.62 0.23 13.12 0.00 -0.37 -1.19 107.32 119.49 1cfm s GLY 238 Ca -0.00 -0.95 0.10 0.00 0.00 0.00 0.00 44.72 43.86 1cfm s GLY 238 CO 0.03 -1.02 -0.17 1.20 0.00 0.00 0.00 173.10 173.14 1cfm s GLN 239 N -2.23 1.47 0.08 2.90 -0.21 -1.26 -0.66 119.66 119.76 1cfm s GLN 239 Ca -0.03 -1.66 -0.15 0.00 0.02 0.00 0.00 55.36 53.54 1cfm s GLN 239 Cb -0.06 -1.39 0.03 0.00 1.00 0.00 0.00 33.01 32.59 1cfm s GLN 239 CO -0.01 0.25 0.35 0.00 -2.12 0.00 0.00 175.29 173.76 1cfm s ALA 240 N -2.77 -0.79 -0.01 6.09 0.00 -0.37 -4.64 121.76 119.27 1cfm s ALA 240 Ca 0.25 -0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.17 1cfm s ALA 240 Cb -0.03 0.50 0.01 0.00 0.00 0.00 0.00 23.12 23.61 1cfm s ALA 240 CO 0.10 -0.53 0.00 -2.00 0.00 0.00 0.00 175.76 173.34 1cfm s GLU 241 N -3.24 0.06 0.00 0.00 2.12 -1.26 -0.81 118.70 115.57 1cfm s GLU 241 Ca -0.00 0.05 0.00 0.00 0.36 0.00 0.00 54.97 55.37 1cfm s GLU 241 Cb 0.01 -0.16 0.00 0.00 0.26 0.00 0.00 34.13 34.24 1cfm s GLU 241 CO -0.08 -0.06 0.00 -2.37 -0.54 0.00 0.00 175.26 172.22 1cfm n THR 242 N 3.51 0.00 -3.78 -1.70 5.66 -0.53 -4.98 114.28 112.46 1cfm n THR 242 Ca -0.18 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.72 1cfm n THR 242 Cb 0.56 0.00 -0.05 0.00 -1.55 0.00 0.00 70.33 69.28 1cfm n THR 242 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 175.07 170.19 1cfm s GLU 243 N -1.05 1.11 -0.12 1.09 -1.05 -1.26 -0.92 118.70 116.50 1cfm s GLU 243 Ca 0.00 -0.91 -0.13 0.00 -0.15 0.00 0.00 54.97 53.79 1cfm s GLU 243 Cb 0.00 0.43 0.03 0.00 -0.44 0.00 0.00 34.13 34.16 1cfm s GLU 243 CO 0.00 -0.43 0.35 -1.50 0.95 0.00 0.00 175.26 174.63 1cfm s ILE 244 N -3.87 0.01 -0.20 1.83 2.07 -0.15 -4.73 121.20 116.16 1cfm s ILE 244 Ca 0.08 -0.06 -0.10 0.00 -1.41 0.00 0.00 60.65 59.16 1cfm s ILE 244 Cb 0.02 -0.52 -0.05 0.00 0.13 0.00 0.00 42.46 42.05 1cfm s ILE 244 CO -0.07 -0.03 0.13 -0.69 -1.91 0.00 0.00 174.94 172.36 1cfm s VAL 245 N -0.02 5.38 -0.47 4.00 1.01 0.48 -0.52 120.40 130.27 1cfm s VAL 245 Ca -0.02 0.18 -0.20 0.00 0.00 0.00 0.00 61.98 61.94 1cfm s VAL 245 Cb -0.03 -3.45 0.04 0.00 0.00 0.00 0.00 36.38 32.94 1cfm s VAL 245 CO 0.01 0.45 0.64 -0.22 0.00 0.00 0.00 175.10 175.98 1cfm s LEU 246 N 0.29 4.70 0.62 3.92 2.96 -0.66 -0.91 118.68 129.60 1cfm s LEU 246 Ca 0.08 -0.61 -0.16 0.00 -0.22 0.00 0.00 54.13 53.22 1cfm s LEU 246 Cb -0.11 -2.58 -0.02 0.00 0.50 0.00 0.00 46.19 43.98 1cfm s LEU 246 CO -0.02 -0.84 1.11 -1.10 -1.32 0.00 0.00 176.35 174.19 1cfm s GLN 247 N 2.76 2.99 -0.53 1.98 -0.21 -0.12 -3.97 119.66 122.55 1cfm s GLN 247 Ca 0.19 1.44 0.04 0.00 0.02 0.00 0.00 55.36 57.05 1cfm s GLN 247 Cb -0.16 -1.97 0.13 0.00 1.00 0.00 0.00 33.01 32.01 1cfm s GLN 247 CO 0.16 -1.10 0.28 1.21 -2.12 0.00 0.00 175.29 173.71 1cfm s ASN 248 N -2.36 4.33 0.32 5.90 2.47 -1.26 -4.16 114.94 120.18 1cfm s ASN 248 Ca 0.68 -3.07 -0.27 0.00 0.42 0.00 0.00 52.86 50.62 1cfm s ASN 248 Cb -0.21 -1.63 -0.13 0.00 -1.45 0.00 0.00 41.25 37.83 1cfm s ASN 248 CO 0.37 -0.22 1.09 -2.65 -3.72 0.00 0.00 177.10 171.97 1cfm n PRO 249 N 3.03 1.58 -1.70 0.43 -0.02 -1.26 -4.93 135.00 132.13 1cfm n PRO 249 Ca 0.06 0.56 -0.38 0.00 -2.02 0.00 0.00 63.50 61.72 1cfm n PRO 249 Cb 0.32 -2.01 0.06 0.00 -0.02 0.00 0.00 33.50 31.85 1cfm n PRO 249 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1cfm n ALA 250 N 0.15 0.97 0.54 3.55 0.00 -1.26 -5.19 120.51 119.28 1cfm n ALA 250 Ca 0.08 0.04 0.07 0.00 0.00 0.00 0.00 53.44 53.62 1cfm n ALA 250 Cb 0.34 -2.27 0.05 0.00 0.00 0.00 0.00 19.45 17.58 1cfm n ALA 250 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37