#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3cm6 n PRO 7 N 7.97 1.16 -4.25 0.00 -0.04 -1.26 -4.80 135.00 133.78 3cm6 n PRO 7 Ca 0.22 -0.24 -0.35 0.00 -0.04 0.00 0.00 63.50 63.09 3cm6 n PRO 7 Cb 0.44 -1.20 -0.09 0.00 -0.04 0.00 0.00 33.50 32.62 3cm6 n PRO 7 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 3cm6 s PHE 8 N -1.93 3.25 -0.10 0.54 0.08 -1.26 -4.98 117.98 113.57 3cm6 s PHE 8 Ca 0.19 0.25 0.13 0.00 0.12 0.00 0.00 56.93 57.62 3cm6 s PHE 8 Cb 0.09 -1.80 0.02 0.00 -0.57 0.00 0.00 43.02 40.75 3cm6 s PHE 8 CO 0.14 0.53 1.41 -0.44 -0.10 0.00 0.00 175.22 176.77 3cm6 h ASP 9 N 4.96 0.00 -3.51 1.36 3.32 -1.83 -3.44 116.42 117.29 3cm6 h ASP 9 Ca -0.51 0.00 -0.17 0.00 0.02 0.00 0.00 57.03 56.37 3cm6 h ASP 9 Cb 1.20 0.00 -0.27 0.00 0.22 0.00 0.00 39.33 40.47 3cm6 h ASP 9 CO 0.56 0.60 -0.41 0.28 -1.72 0.00 0.00 179.24 178.55 3cm6 s THR 10 N -2.92 -0.02 -0.07 0.35 -1.32 -1.23 -1.81 115.64 108.62 3cm6 s THR 10 Ca 0.03 0.08 0.03 0.00 -1.21 0.00 0.00 61.69 60.62 3cm6 s THR 10 Cb 0.08 -0.43 -0.02 0.00 -1.51 0.00 0.00 72.50 70.62 3cm6 s THR 10 CO 0.76 0.03 -0.14 -0.76 -2.21 0.00 0.00 174.62 172.30 3cm6 s LEU 11 N 0.87 2.73 -0.27 9.08 1.43 -0.33 -3.05 118.68 129.15 3cm6 s LEU 11 Ca -0.06 -0.23 -0.03 0.00 -1.03 0.00 0.00 54.13 52.78 3cm6 s LEU 11 Cb -0.07 -1.57 0.02 0.00 0.03 0.00 0.00 46.19 44.61 3cm6 s LEU 11 CO -0.06 0.30 -0.01 -0.76 0.23 0.00 0.00 176.35 176.05 3cm6 s LEU 12 N -0.46 3.49 -0.37 1.79 1.43 0.20 -0.22 118.68 124.54 3cm6 s LEU 12 Ca 0.06 -0.87 -0.22 0.00 -1.03 0.00 0.00 54.13 52.07 3cm6 s LEU 12 Cb -0.12 -1.74 0.01 0.00 0.03 0.00 0.00 46.19 44.37 3cm6 s LEU 12 CO 0.02 -0.16 0.72 -0.63 0.23 0.00 0.00 176.35 176.52 3cm6 s ILE 13 N 1.37 4.79 -0.07 -0.59 1.09 0.02 -0.47 121.20 127.35 3cm6 s ILE 13 Ca 0.00 0.68 0.03 0.00 -1.10 0.00 0.00 60.65 60.27 3cm6 s ILE 13 Cb -0.17 -4.17 -0.02 0.00 -1.06 0.00 0.00 42.46 37.04 3cm6 s ILE 13 CO -0.02 -0.43 -0.16 -0.22 -0.10 0.00 0.00 174.94 174.02 3cm6 s LEU 14 N 2.96 2.61 -0.03 2.97 0.20 -0.53 -0.78 118.68 126.08 3cm6 s LEU 14 Ca 0.28 -0.28 -0.03 0.00 0.69 0.00 0.00 54.13 54.79 3cm6 s LEU 14 Cb -0.14 -1.54 0.01 0.00 -0.43 0.00 0.00 46.19 44.10 3cm6 s LEU 14 CO 0.17 0.29 0.08 -0.62 -0.29 0.00 0.00 176.35 175.98 3cm6 s ASP 15 N -0.39 -0.08 0.04 3.68 2.15 -0.01 -4.53 116.67 117.53 3cm6 s ASP 15 Ca 0.04 0.16 0.06 0.00 0.43 0.00 0.00 52.55 53.24 3cm6 s ASP 15 Cb -0.12 0.17 -0.03 0.00 -0.30 0.00 0.00 42.92 42.63 3cm6 s ASP 15 CO 0.02 -0.03 -0.15 -0.36 -0.17 0.00 0.00 175.17 174.48 3cm6 s PHE 16 N 0.02 2.65 0.12 -5.34 0.08 -1.26 -1.32 117.98 112.93 3cm6 s PHE 16 Ca -0.00 -0.20 0.08 0.00 0.12 0.00 0.00 56.93 56.93 3cm6 s PHE 16 Cb -0.01 -1.49 -0.04 0.00 -0.57 0.00 0.00 43.02 40.92 3cm6 s PHE 16 CO 0.00 0.30 -0.15 -1.21 -0.10 0.00 0.00 175.22 174.06 3cm6 s GLU 17 N -1.54 1.89 0.16 0.44 0.41 -0.57 -4.95 118.70 114.54 3cm6 s GLU 17 Ca 0.16 -1.15 0.05 0.00 -0.41 0.00 0.00 54.97 53.62 3cm6 s GLU 17 Cb -0.11 -2.17 -0.04 0.00 -1.78 0.00 0.00 34.13 30.03 3cm6 s GLU 17 CO 0.07 0.48 -0.11 0.95 -0.49 0.00 0.00 175.26 176.16 3cm6 s THR 18 N -1.22 1.31 0.55 3.63 -4.23 -1.26 -0.45 115.64 113.98 3cm6 s THR 18 Ca 0.19 -2.06 -0.20 0.00 -1.18 0.00 0.00 61.69 58.44 3cm6 s THR 18 Cb -0.11 -1.86 -0.06 0.00 1.34 0.00 0.00 72.50 71.81 3cm6 s THR 18 CO 0.12 -0.68 1.03 0.35 -0.54 0.00 0.00 174.62 174.89 3cm6 n THR 19 N -0.17 3.40 -3.87 3.99 -2.24 0.42 -4.84 114.28 110.97 3cm6 n THR 19 Ca -0.10 -0.50 -0.08 0.00 -2.27 0.00 0.00 64.05 61.10 3cm6 n THR 19 Cb 0.60 -1.22 -0.01 0.00 -2.10 0.00 0.00 70.33 67.60 3cm6 n THR 19 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3cm6 s SER 20 N -1.08 -0.09 -0.35 3.42 1.04 -1.26 -4.18 113.70 111.21 3cm6 s SER 20 Ca 0.72 -0.88 0.02 0.00 0.48 0.00 0.00 55.95 56.29 3cm6 s SER 20 Cb -0.45 0.75 0.15 0.00 0.10 0.00 0.00 66.02 66.58 3cm6 s SER 20 CO 0.50 -1.45 0.35 -0.62 0.98 0.00 0.00 173.24 173.01 3cm6 s ASP 21 N -3.00 1.30 0.03 7.02 3.68 -1.26 -4.49 116.67 119.95 3cm6 s ASP 21 Ca 0.15 -1.34 -0.06 0.00 2.13 0.00 0.00 52.55 53.43 3cm6 s ASP 21 Cb -0.05 0.55 -0.01 0.00 -1.45 0.00 0.00 42.92 41.96 3cm6 s ASP 21 CO 0.09 -0.30 0.30 0.00 0.13 0.00 0.00 175.17 175.40 3cm6 n ALA 22 N 4.55 -0.12 0.88 3.66 0.00 -1.26 0.14 120.51 128.36 3cm6 n ALA 22 Ca 0.07 0.16 0.12 0.00 0.00 0.00 0.00 53.44 53.80 3cm6 n ALA 22 Cb 0.45 -0.03 0.55 0.00 0.00 0.00 0.00 19.45 20.42 3cm6 n ALA 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3cm6 n ALA 23 N -3.85 2.18 -3.64 0.00 0.00 -1.26 -4.59 120.51 109.34 3cm6 n ALA 23 Ca 0.00 -0.09 -0.35 0.00 0.00 0.00 0.00 53.44 53.01 3cm6 n ALA 23 Cb 0.05 -1.42 -0.14 0.00 0.00 0.00 0.00 19.45 17.94 3cm6 n ALA 23 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3cm6 s ASN 24 N -3.03 4.38 0.11 0.00 2.47 0.12 -4.55 114.94 114.45 3cm6 s ASN 24 Ca 0.12 -0.80 0.24 0.00 0.42 0.00 0.00 52.86 52.84 3cm6 s ASN 24 Cb 0.17 -1.69 0.22 0.00 -1.45 0.00 0.00 41.25 38.49 3cm6 s ASN 24 CO 0.47 -0.12 1.20 1.67 -3.72 0.00 0.00 177.10 176.60 3cm6 n GLN 25 N 4.70 0.34 -1.73 0.43 -0.06 0.06 -4.29 117.38 116.83 3cm6 n GLN 25 Ca -0.16 0.07 -0.41 0.00 -2.00 0.00 0.00 57.00 54.49 3cm6 n GLN 25 Cb 0.48 -1.68 -0.01 0.00 -4.06 0.00 0.00 30.24 24.97 3cm6 n GLN 25 CO 0.00 0.00 0.00 -3.47 -0.20 0.00 0.00 177.06 173.39 3cm6 n ASP 26 N -2.16 5.40 -4.07 1.69 -0.08 -1.26 -4.90 116.55 111.17 3cm6 n ASP 26 Ca 0.02 -2.83 -0.25 0.00 -1.51 0.00 0.00 54.79 50.22 3cm6 n ASP 26 Cb 0.46 -1.59 -0.16 0.00 2.34 0.00 0.00 41.12 42.16 3cm6 n ASP 26 CO 0.00 0.00 0.00 -0.47 0.12 0.00 0.00 177.20 176.85 3cm6 s TYR 27 N 2.32 1.50 -1.47 -0.67 5.04 -1.26 -4.46 117.35 118.36 3cm6 s TYR 27 Ca 0.52 -0.47 -0.12 0.00 -2.44 0.00 0.00 57.07 54.56 3cm6 s TYR 27 Cb 0.15 -1.05 0.03 0.00 0.35 0.00 0.00 41.96 41.44 3cm6 s TYR 27 CO -0.07 -0.20 2.37 -0.35 -1.34 0.00 0.00 175.55 175.97 3cm6 n PRO 28 N 3.40 3.28 -1.58 4.97 -0.04 -1.26 -4.85 135.00 138.93 3cm6 n PRO 28 Ca -0.20 -2.69 -0.60 0.00 -0.04 0.00 0.00 63.50 59.98 3cm6 n PRO 28 Cb 0.53 -3.07 -0.08 0.00 -0.04 0.00 0.00 33.50 30.83 3cm6 n PRO 28 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3cm6 s GLU 30 N 0.90 1.75 0.15 0.00 2.02 -1.26 -4.61 118.70 117.65 3cm6 s GLU 30 Ca 0.93 -0.91 -0.31 0.00 0.02 0.00 0.00 54.97 54.71 3cm6 s GLU 30 Cb -1.26 -1.78 -0.09 0.00 0.10 0.00 0.00 34.13 31.10 3cm6 s GLU 30 CO 0.61 0.48 1.44 0.08 0.02 0.00 0.00 175.26 177.89 3cm6 s VAL 31 N -0.65 3.02 0.00 2.63 1.01 -1.26 -0.44 120.40 124.71 3cm6 s VAL 31 Ca 0.09 0.76 0.00 0.00 0.00 0.00 0.00 61.98 62.83 3cm6 s VAL 31 Cb -0.09 -3.48 0.00 0.00 0.00 0.00 0.00 36.38 32.81 3cm6 s VAL 31 CO 0.00 0.07 0.00 2.30 0.00 0.00 0.00 175.10 177.47 3cm6 n ILE 32 N 3.63 0.00 -3.71 2.22 -5.35 0.40 -4.55 119.36 112.00 3cm6 n ILE 32 Ca 0.11 -0.39 -0.12 0.00 -0.27 0.00 0.00 62.75 62.08 3cm6 n ILE 32 Cb 0.41 0.90 -0.10 0.00 -1.74 0.00 0.00 39.64 39.11 3cm6 n ILE 32 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 3cm6 s GLN 33 N -1.16 0.49 -0.19 6.28 0.74 -1.17 -0.24 119.66 124.41 3cm6 s GLN 33 Ca 0.00 0.68 -0.02 0.00 0.05 0.00 0.00 55.36 56.06 3cm6 s GLN 33 Cb 0.00 0.18 0.06 0.00 1.10 0.00 0.00 33.01 34.35 3cm6 s GLN 33 CO 0.00 -0.09 0.02 0.12 -0.55 0.00 0.00 175.29 174.79 3cm6 s PHE 34 N 0.57 1.21 -0.02 1.67 5.99 -0.08 -1.50 117.98 125.82 3cm6 s PHE 34 Ca -0.03 -0.95 0.04 0.00 0.00 0.00 0.00 56.93 56.00 3cm6 s PHE 34 Cb -0.04 -1.10 -0.01 0.00 0.00 0.00 0.00 43.02 41.87 3cm6 s PHE 34 CO -0.03 -0.62 -0.15 0.00 -0.00 0.00 0.00 175.22 174.42 3cm6 s ALA 35 N 1.79 1.23 -0.01 11.12 0.00 -0.43 -1.20 121.76 134.27 3cm6 s ALA 35 Ca -0.01 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.33 3cm6 s ALA 35 Cb -0.17 -0.33 0.01 0.00 0.00 0.00 0.00 23.12 22.62 3cm6 s ALA 35 CO -0.08 0.29 -0.00 0.42 0.00 0.00 0.00 175.76 176.39 3cm6 s ILE 36 N -0.27 0.07 -0.07 0.00 1.01 0.63 -0.83 121.20 121.75 3cm6 s ILE 36 Ca 0.04 0.01 0.03 0.00 0.00 0.00 0.00 60.65 60.73 3cm6 s ILE 36 Cb -0.06 -0.11 0.01 0.00 0.01 0.00 0.00 42.46 42.31 3cm6 s ILE 36 CO -0.00 0.05 -0.16 0.54 0.00 0.00 0.00 174.94 175.37 3cm6 s VAL 37 N 0.28 1.39 0.41 2.92 0.11 0.04 -1.35 120.40 124.21 3cm6 s VAL 37 Ca -0.02 -0.64 -0.23 0.00 -2.93 0.00 0.00 61.98 58.16 3cm6 s VAL 37 Cb -0.04 -1.24 -0.09 0.00 -1.53 0.00 0.00 36.38 33.48 3cm6 s VAL 37 CO -0.01 0.41 1.01 0.00 -3.33 0.00 0.00 175.10 173.18 3cm6 s ALA 38 N 0.50 3.05 -0.08 1.54 0.00 -1.04 -0.80 121.76 124.94 3cm6 s ALA 38 Ca -0.14 0.59 -0.00 0.00 0.00 0.00 0.00 51.96 52.40 3cm6 s ALA 38 Cb -0.16 -3.23 0.02 0.00 0.00 0.00 0.00 23.12 19.76 3cm6 s ALA 38 CO 0.05 -0.09 -0.05 -0.47 0.00 0.00 0.00 175.76 175.20 3cm6 s TYR 39 N -1.83 1.05 -0.32 0.00 5.04 0.70 -1.39 117.35 120.60 3cm6 s TYR 39 Ca 0.59 -0.42 -0.27 0.00 -2.44 0.00 0.00 57.07 54.54 3cm6 s TYR 39 Cb -0.17 -0.96 0.01 0.00 0.35 0.00 0.00 41.96 41.19 3cm6 s TYR 39 CO 0.22 -0.37 0.96 0.34 -1.34 0.00 0.00 175.55 175.37 3cm6 s ASP 40 N 1.56 6.82 -0.07 4.32 -1.08 0.30 -1.18 116.67 127.34 3cm6 s ASP 40 Ca 0.00 0.87 -0.13 0.00 -0.52 0.00 0.00 52.55 52.77 3cm6 s ASP 40 Cb -0.13 -2.49 -0.09 0.00 -1.46 0.00 0.00 42.92 38.75 3cm6 s ASP 40 CO -0.04 -0.79 0.52 0.58 0.52 0.00 0.00 175.17 175.96 3cm6 h VAL 41 N 5.70 0.35 -0.80 1.11 2.07 -1.64 -1.43 116.25 121.62 3cm6 h VAL 41 Ca -0.22 -0.98 0.23 0.00 0.82 0.00 0.00 66.70 66.55 3cm6 h VAL 41 Cb 1.07 0.62 -0.03 0.00 -1.52 0.00 0.00 31.29 31.43 3cm6 h VAL 41 CO 0.98 0.10 0.57 -0.65 0.02 0.00 0.00 177.57 178.59 3cm6 h PRO 42 N -1.02 0.03 -0.05 1.57 0.11 -1.86 -1.76 132.00 129.03 3cm6 h PRO 42 Ca -0.03 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.08 3cm6 h PRO 42 Cb 0.37 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 31.47 3cm6 h PRO 42 CO 0.04 0.02 0.00 0.09 -0.21 0.00 0.00 178.00 177.94 3cm6 n ASN 43 N -4.32 2.94 -3.90 -2.05 3.02 -1.25 -4.99 115.26 104.72 3cm6 n ASN 43 Ca 0.16 -1.96 -0.38 0.00 -0.03 0.00 0.00 54.58 52.37 3cm6 n ASN 43 Cb 0.85 -0.01 0.02 0.00 -0.61 0.00 0.00 39.78 40.03 3cm6 n ASN 43 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 3cm6 n ASP 44 N 1.30 -4.23 -3.83 6.41 2.03 -0.66 -4.96 116.55 112.61 3cm6 n ASP 44 Ca 0.14 -1.15 -0.27 0.00 0.52 0.00 0.00 54.79 54.02 3cm6 n ASP 44 Cb 0.58 -2.54 -0.17 0.00 -0.72 0.00 0.00 41.12 38.27 3cm6 n ASP 44 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3cm6 s LYS 45 N -6.72 1.09 -0.19 -0.67 2.36 -0.61 -4.98 119.74 110.02 3cm6 s LYS 45 Ca 0.44 -0.36 -0.29 0.00 -2.55 0.00 0.00 55.97 53.20 3cm6 s LYS 45 Cb -0.20 -1.81 -0.02 0.00 -1.05 0.00 0.00 37.83 34.75 3cm6 s LYS 45 CO 0.92 -0.45 1.38 0.42 1.55 0.00 0.00 175.35 179.17 3cm6 s ILE 46 N 1.75 4.06 -1.00 5.43 1.01 -1.26 -0.54 121.20 130.65 3cm6 s ILE 46 Ca 0.01 1.26 -0.05 0.00 0.00 0.00 0.00 60.65 61.87 3cm6 s ILE 46 Cb -0.15 -3.91 0.25 0.00 0.01 0.00 0.00 42.46 38.66 3cm6 s ILE 46 CO -0.07 -0.22 0.96 -1.14 0.00 0.00 0.00 174.94 174.47 3cm6 n ARG 47 N 6.99 3.11 0.29 2.79 3.00 -0.49 -4.88 116.66 127.48 3cm6 n ARG 47 Ca 0.15 -4.48 0.19 0.00 -0.00 0.00 0.00 57.85 53.72 3cm6 n ARG 47 Cb 0.45 -2.47 0.96 0.00 0.00 0.00 0.00 32.46 31.40 3cm6 n ARG 47 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 3cm6 h GLU 48 N 6.22 0.00 -0.00 -0.14 5.08 -1.93 -1.41 114.58 122.39 3cm6 h GLU 48 Ca 0.17 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.53 3cm6 h GLU 48 Cb 0.82 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.07 3cm6 h GLU 48 CO 0.95 0.00 -0.25 -0.40 -1.00 0.00 0.00 179.01 178.31 3cm6 n ASP 49 N -2.94 0.57 -4.11 1.42 5.75 -1.26 -4.41 116.55 111.57 3cm6 n ASP 49 Ca -0.02 -0.43 -0.37 0.00 -0.01 0.00 0.00 54.79 53.97 3cm6 n ASP 49 Cb 0.14 0.03 -0.10 0.00 -1.03 0.00 0.00 41.12 40.15 3cm6 n ASP 49 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 3cm6 s ILE 50 N -2.70 3.59 0.18 2.12 1.01 -0.53 -5.07 121.20 119.80 3cm6 s ILE 50 Ca 0.20 -2.52 -0.13 0.00 0.00 0.00 0.00 60.65 58.20 3cm6 s ILE 50 Cb 0.19 -3.39 0.01 0.00 0.01 0.00 0.00 42.46 39.28 3cm6 s ILE 50 CO 0.56 -0.80 0.41 -0.94 0.00 0.00 0.00 174.94 174.17 3cm6 s SER 51 N 1.29 -0.12 -0.08 3.58 1.04 -1.26 -2.49 113.70 115.66 3cm6 s SER 51 Ca 0.13 -0.66 -0.00 0.00 0.48 0.00 0.00 55.95 55.89 3cm6 s SER 51 Cb -0.22 0.51 0.02 0.00 0.10 0.00 0.00 66.02 66.44 3cm6 s SER 51 CO -0.04 -0.98 -0.05 0.12 0.98 0.00 0.00 173.24 173.28 3cm6 s PHE 52 N -3.92 1.05 -0.20 5.02 5.36 -0.46 -4.98 117.98 119.85 3cm6 s PHE 52 Ca 0.13 -0.41 -0.04 0.00 -0.96 0.00 0.00 56.93 55.65 3cm6 s PHE 52 Cb 0.01 -0.94 0.08 0.00 -0.34 0.00 0.00 43.02 41.83 3cm6 s PHE 52 CO -0.01 -0.35 0.15 1.21 -1.46 0.00 0.00 175.22 174.75 3cm6 s ASN 53 N 1.50 2.12 0.03 6.13 2.47 -1.26 -0.27 114.94 125.66 3cm6 s ASN 53 Ca -0.01 -0.57 0.02 0.00 0.42 0.00 0.00 52.86 52.73 3cm6 s ASN 53 Cb -0.13 0.00 -0.02 0.00 -1.45 0.00 0.00 41.25 39.65 3cm6 s ASN 53 CO -0.04 -0.35 -0.08 -0.54 -3.72 0.00 0.00 177.10 172.37 3cm6 s LYS 54 N 2.21 0.55 0.46 0.43 1.02 -0.34 -5.00 119.74 119.08 3cm6 s LYS 54 Ca 0.05 -0.58 -0.12 0.00 0.02 0.00 0.00 55.97 55.34 3cm6 s LYS 54 Cb -0.16 -0.42 -0.06 0.00 -0.52 0.00 0.00 37.83 36.67 3cm6 s LYS 54 CO -0.15 0.09 0.85 0.71 -0.92 0.00 0.00 175.35 175.94 3cm6 s TYR 55 N -0.92 3.49 -0.01 3.18 2.02 -1.26 -0.90 117.35 122.94 3cm6 s TYR 55 Ca -0.05 1.16 0.03 0.00 -0.37 0.00 0.00 57.07 57.84 3cm6 s TYR 55 Cb -0.07 -2.55 -0.01 0.00 -0.40 0.00 0.00 41.96 38.93 3cm6 s TYR 55 CO 0.00 -0.25 -0.11 0.08 -1.57 0.00 0.00 175.55 173.70 3cm6 s VAL 56 N -2.55 0.90 -0.20 0.71 1.01 0.66 -4.47 120.40 116.46 3cm6 s VAL 56 Ca 0.53 -0.47 -0.19 0.00 0.00 0.00 0.00 61.98 61.85 3cm6 s VAL 56 Cb -0.10 -0.76 -0.03 0.00 0.00 0.00 0.00 36.38 35.49 3cm6 s VAL 56 CO 0.35 0.26 0.56 -0.75 0.00 0.00 0.00 175.10 175.52 3cm6 s LYS 57 N -0.18 4.20 0.89 2.72 2.20 0.94 -4.35 119.74 126.16 3cm6 s LYS 57 Ca 0.03 0.49 -0.12 0.00 -0.36 0.00 0.00 55.97 56.01 3cm6 s LYS 57 Cb -0.05 -3.57 0.13 0.00 -1.51 0.00 0.00 37.83 32.83 3cm6 s LYS 57 CO -0.00 -0.18 1.10 -2.14 -0.36 0.00 0.00 175.35 173.76 3cm6 s PRO 58 N 1.73 1.29 -0.00 4.03 0.02 -1.26 -4.05 135.00 136.76 3cm6 s PRO 58 Ca 0.26 0.70 0.00 0.00 0.02 0.00 0.00 61.00 61.98 3cm6 s PRO 58 Cb -0.16 -1.82 -0.00 0.00 0.02 0.00 0.00 34.50 32.54 3cm6 s PRO 58 CO 0.10 -2.18 0.00 1.33 -0.33 0.00 0.00 177.00 175.92 3cm6 n VAL 59 N -3.83 0.00 -0.05 3.83 0.24 -1.26 -4.71 118.33 112.56 3cm6 n VAL 59 Ca 0.07 -0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.24 3cm6 n VAL 59 Cb 0.56 -0.57 -0.11 0.00 -1.47 0.00 0.00 33.84 32.26 3cm6 n VAL 59 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 3cm6 h LEU 60 N 0.00 -0.02 -7.34 1.34 3.38 -1.95 -3.42 115.31 107.30 3cm6 h LEU 60 Ca -0.00 -0.75 -0.64 0.00 0.09 0.00 0.00 57.88 56.58 3cm6 h LEU 60 Cb 0.71 0.01 -0.41 0.00 0.09 0.00 0.00 40.66 41.06 3cm6 h LEU 60 CO 0.00 0.81 -0.64 0.20 0.09 0.00 0.00 178.44 178.90 3cm6 s ASN 61 N -5.99 4.24 0.40 -0.43 -0.87 -1.26 -4.97 114.94 106.06 3cm6 s ASN 61 Ca -0.16 -2.98 0.22 0.00 -1.57 0.00 0.00 52.86 48.37 3cm6 s ASN 61 Cb -0.02 -1.58 0.59 0.00 -0.02 0.00 0.00 41.25 40.23 3cm6 s ASN 61 CO 0.59 -0.23 1.68 0.03 -2.57 0.00 0.00 177.10 176.60 3cm6 h ARG 62 N 6.51 0.00 -4.77 -0.60 3.08 -1.84 -3.42 114.38 113.35 3cm6 h ARG 62 Ca -0.07 0.00 -0.68 0.00 0.07 0.00 0.00 59.98 59.30 3cm6 h ARG 62 Cb 0.89 0.00 -0.24 0.00 0.08 0.00 0.00 29.97 30.71 3cm6 h ARG 62 CO 0.67 0.25 -0.57 0.99 -1.07 0.00 0.00 179.97 180.24 3cm6 s THR 63 N -3.36 4.44 0.19 2.04 2.01 -1.26 -4.89 115.64 114.80 3cm6 s THR 63 Ca 0.03 -0.53 -0.32 0.00 0.31 0.00 0.00 61.69 61.18 3cm6 s THR 63 Cb 0.08 -3.29 -0.11 0.00 0.01 0.00 0.00 72.50 69.19 3cm6 s THR 63 CO 0.67 0.04 1.73 -0.76 -0.69 0.00 0.00 174.62 175.61 3cm6 s LEU 64 N 1.58 4.38 0.81 4.42 1.43 -1.26 -4.96 118.68 125.07 3cm6 s LEU 64 Ca 0.04 2.82 -0.13 0.00 -1.03 0.00 0.00 54.13 55.82 3cm6 s LEU 64 Cb -0.17 -3.59 0.08 0.00 0.03 0.00 0.00 46.19 42.53 3cm6 s LEU 64 CO 0.05 -0.96 1.14 0.35 0.23 0.00 0.00 176.35 177.16 3cm6 n THR 65 N 4.13 1.91 -0.33 5.49 -2.24 -1.26 -4.82 114.28 117.16 3cm6 n THR 65 Ca 0.16 -0.21 -0.01 0.00 -2.27 0.00 0.00 64.05 61.72 3cm6 n THR 65 Cb 0.36 -1.15 0.12 0.00 -2.10 0.00 0.00 70.33 67.56 3cm6 n THR 65 CO 0.00 0.00 0.00 0.50 -0.57 0.00 0.00 175.07 175.00 3cm6 h LYS 66 N -0.93 1.10 0.00 -0.78 3.64 -1.94 -1.83 116.57 115.84 3cm6 h LYS 66 Ca -0.46 -0.07 -0.10 0.00 -1.27 0.00 0.00 60.65 58.75 3cm6 h LYS 66 Cb 1.30 -0.25 -0.01 0.00 -0.41 0.00 0.00 32.23 32.86 3cm6 h LYS 66 CO 0.45 0.73 -0.48 -2.95 -2.27 0.00 0.00 179.45 174.94 3cm6 h ASN 67 N 1.14 0.00 -0.51 4.20 -1.07 -1.92 0.19 115.58 117.60 3cm6 h ASN 67 Ca 0.36 0.00 -0.08 0.00 0.07 0.00 0.00 56.30 56.65 3cm6 h ASN 67 Cb 0.01 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.24 3cm6 h ASN 67 CO -0.12 0.48 0.04 0.00 0.07 0.00 0.00 177.43 177.89 3cm6 h VAL 69 N 0.87 1.29 0.35 0.00 2.07 -0.40 -1.43 116.25 119.00 3cm6 h VAL 69 Ca 0.17 -1.19 -0.01 0.00 0.82 0.00 0.00 66.70 66.49 3cm6 h VAL 69 Cb 0.46 1.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 3cm6 h VAL 69 CO 0.02 0.38 -0.23 0.44 0.02 0.00 0.00 177.57 178.20 3cm6 h ASP 70 N 0.32 -0.58 -0.18 0.57 3.32 -0.64 -0.14 116.42 119.09 3cm6 h ASP 70 Ca 0.06 0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 3cm6 h ASP 70 Cb 0.62 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.34 3cm6 h ASP 70 CO 0.04 -0.36 0.10 0.15 -1.72 0.00 0.00 179.24 177.45 3cm6 h PHE 71 N -0.56 0.24 0.00 4.55 3.57 -1.26 -3.24 116.94 120.23 3cm6 h PHE 71 Ca -0.03 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.46 3cm6 h PHE 71 Cb 0.47 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.13 3cm6 h PHE 71 CO -0.10 0.21 -0.94 1.79 -2.23 0.00 0.00 178.31 177.04 3cm6 h THR 72 N 0.20 0.00 0.00 4.41 1.35 -1.32 -3.44 112.91 114.10 3cm6 h THR 72 Ca 0.06 -0.96 0.00 0.00 -0.55 0.00 0.00 66.41 64.97 3cm6 h THR 72 Cb 0.05 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 67.94 3cm6 h THR 72 CO -0.01 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.87 3cm6 n GLY 73 N 1.19 1.78 3.67 5.82 0.00 -0.07 -4.25 105.19 113.34 3cm6 n GLY 73 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.60 3cm6 n GLY 73 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3cm6 s ILE 74 N -2.94 4.43 0.62 -0.61 1.01 -1.25 -5.00 121.20 117.46 3cm6 s ILE 74 Ca 0.00 1.73 -0.09 0.00 0.00 0.00 0.00 60.65 62.29 3cm6 s ILE 74 Cb 0.00 -4.12 -0.01 0.00 0.01 0.00 0.00 42.46 38.34 3cm6 s ILE 74 CO 0.00 -0.08 0.98 -2.16 0.00 0.00 0.00 174.94 173.68 3cm6 s PRO 75 N 2.80 3.25 0.26 2.79 0.04 -1.26 -4.64 135.00 138.23 3cm6 s PRO 75 Ca 0.52 0.43 -0.04 0.00 0.04 0.00 0.00 61.00 61.96 3cm6 s PRO 75 Cb -0.21 -2.15 0.32 0.00 0.04 0.00 0.00 34.50 32.51 3cm6 s PRO 75 CO 0.16 -0.67 1.84 0.37 0.04 0.00 0.00 177.00 178.74 3cm6 h GLN 76 N -0.30 1.01 -0.80 4.56 5.75 -1.97 -2.77 115.11 120.60 3cm6 h GLN 76 Ca -0.45 -0.17 0.03 0.00 -0.15 0.00 0.00 58.65 57.91 3cm6 h GLN 76 Cb 1.22 -0.17 -0.04 0.00 1.07 0.00 0.00 27.48 29.55 3cm6 h GLN 76 CO 0.62 0.82 0.53 0.07 -2.65 0.00 0.00 178.83 178.22 3cm6 h ARG 77 N 1.00 0.97 0.00 1.69 0.11 -1.99 0.01 114.38 116.17 3cm6 h ARG 77 Ca 0.23 -0.06 -0.04 0.00 0.10 0.00 0.00 59.98 60.21 3cm6 h ARG 77 Cb 0.18 -0.22 -0.01 0.00 1.11 0.00 0.00 29.97 31.04 3cm6 h ARG 77 CO -0.02 0.64 -0.21 0.77 0.10 0.00 0.00 179.97 181.25 3cm6 h SER 78 N 1.00 0.00 0.48 0.08 0.02 -1.88 -2.10 113.55 111.13 3cm6 h SER 78 Ca 0.31 0.00 -0.30 0.00 -0.84 0.00 0.00 61.79 60.97 3cm6 h SER 78 Cb 0.02 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.53 3cm6 h SER 78 CO -0.09 0.21 -1.62 0.16 -1.14 0.00 0.00 176.83 174.35 3cm6 h ILE 79 N 0.00 1.00 0.00 3.27 -0.00 -1.32 -3.34 117.51 117.12 3cm6 h ILE 79 Ca -0.00 -2.75 -0.03 0.00 -0.00 0.00 0.00 64.86 62.07 3cm6 h ILE 79 Cb 0.44 2.59 -0.00 0.00 -0.00 0.00 0.00 36.82 39.84 3cm6 h ILE 79 CO 0.03 0.71 -0.15 0.44 -0.00 0.00 0.00 178.15 179.18 3cm6 h ASP 80 N 0.03 0.00 -0.62 2.16 3.32 -0.53 -2.74 116.42 118.04 3cm6 h ASP 80 Ca -0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.79 3cm6 h ASP 80 Cb 1.99 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.54 3cm6 h ASP 80 CO 0.11 0.15 0.00 0.35 -1.72 0.00 0.00 179.24 178.13 3cm6 n THR 81 N -3.67 1.47 -3.68 0.35 -2.24 -0.84 -4.99 114.28 100.69 3cm6 n THR 81 Ca -0.02 -1.03 -0.20 0.00 -2.27 0.00 0.00 64.05 60.53 3cm6 n THR 81 Cb 0.27 0.18 -0.02 0.00 -2.10 0.00 0.00 70.33 68.66 3cm6 n THR 81 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3cm6 s ALA 82 N -1.64 4.04 0.66 6.98 0.00 -1.03 -5.09 121.76 125.69 3cm6 s ALA 82 Ca 0.47 -1.47 -0.07 0.00 0.00 0.00 0.00 51.96 50.88 3cm6 s ALA 82 Cb 0.29 -1.53 0.03 0.00 0.00 0.00 0.00 23.12 21.91 3cm6 s ALA 82 CO 0.25 0.04 0.99 -0.51 0.00 0.00 0.00 175.76 176.52 3cm6 s ASP 83 N -4.07 5.26 0.68 0.00 1.01 -1.26 -4.50 116.67 113.78 3cm6 s ASP 83 Ca 0.41 0.71 -0.11 0.00 0.71 0.00 0.00 52.55 54.27 3cm6 s ASP 83 Cb -0.08 -1.53 0.00 0.00 1.01 0.00 0.00 42.92 42.32 3cm6 s ASP 83 CO 0.29 -1.33 1.07 0.42 0.21 0.00 0.00 175.17 175.83 3cm6 s THR 84 N -3.17 3.78 0.24 -1.27 -4.23 -1.26 -0.04 115.64 109.69 3cm6 s THR 84 Ca 0.57 0.54 -0.07 0.00 -1.18 0.00 0.00 61.69 61.54 3cm6 s THR 84 Cb -0.11 -3.57 0.25 0.00 1.34 0.00 0.00 72.50 70.42 3cm6 s THR 84 CO 0.46 -0.74 1.65 0.15 -0.54 0.00 0.00 174.62 175.61 3cm6 h PHE 85 N -0.54 0.02 -0.76 3.99 3.57 -1.91 0.43 116.94 121.75 3cm6 h PHE 85 Ca -0.45 0.05 0.17 0.00 3.53 0.00 0.00 57.97 61.27 3cm6 h PHE 85 Cb 1.24 0.10 -0.05 0.00 2.79 0.00 0.00 35.95 40.03 3cm6 h PHE 85 CO 0.54 -0.19 0.51 0.38 -2.23 0.00 0.00 178.31 177.32 3cm6 h ASP 86 N 0.14 0.31 0.00 0.41 -0.00 -1.92 0.79 116.42 116.14 3cm6 h ASP 86 Ca 0.39 0.02 -0.03 0.00 -0.00 0.00 0.00 57.03 57.42 3cm6 h ASP 86 Cb 0.68 -0.04 -0.00 0.00 -0.00 0.00 0.00 39.33 39.96 3cm6 h ASP 86 CO -0.60 0.15 -0.16 0.58 -0.00 0.00 0.00 179.24 179.21 3cm6 h VAL 87 N 0.32 1.33 -0.95 4.15 2.07 -1.30 -2.84 116.25 119.03 3cm6 h VAL 87 Ca 0.37 -2.06 0.18 0.00 0.82 0.00 0.00 66.70 66.02 3cm6 h VAL 87 Cb 0.99 2.58 -0.08 0.00 -1.52 0.00 0.00 31.29 33.26 3cm6 h VAL 87 CO -0.10 0.45 0.61 0.58 0.02 0.00 0.00 177.57 179.12 3cm6 h VAL 88 N -1.00 0.74 -0.43 2.57 2.07 -0.90 -0.76 116.25 118.54 3cm6 h VAL 88 Ca -0.04 -0.22 -0.14 0.00 0.82 0.00 0.00 66.70 67.11 3cm6 h VAL 88 Cb 0.85 0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3cm6 h VAL 88 CO -0.02 0.12 -0.29 0.22 0.02 0.00 0.00 177.57 177.61 3cm6 h TYR 89 N 0.65 1.12 -0.20 1.57 3.20 0.54 0.01 116.97 123.85 3cm6 h TYR 89 Ca 0.51 -0.30 -0.08 0.00 3.14 0.00 0.00 58.73 62.00 3cm6 h TYR 89 Cb 0.93 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 38.94 3cm6 h TYR 89 CO -0.00 1.12 -0.22 1.49 -1.64 0.00 0.00 178.16 178.91 3cm6 h GLU 90 N 0.80 0.36 0.29 1.82 4.57 -1.15 -0.27 114.58 121.00 3cm6 h GLU 90 Ca 0.09 -0.12 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 3cm6 h GLU 90 Cb 0.88 -0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 3cm6 h GLU 90 CO 0.08 0.56 -0.14 1.96 -1.18 0.00 0.00 179.01 180.29 3cm6 h GLN 91 N 0.33 -0.38 -0.63 1.92 4.20 -0.73 -0.13 115.11 119.69 3cm6 h GLN 91 Ca 0.05 0.03 0.13 0.00 0.06 0.00 0.00 58.65 58.92 3cm6 h GLN 91 Cb 0.57 0.09 -0.11 0.00 0.30 0.00 0.00 27.48 28.32 3cm6 h GLN 91 CO 0.04 -0.18 -0.06 0.35 -0.67 0.00 0.00 178.83 178.30 3cm6 h PHE 92 N -0.49 -0.16 -0.72 2.96 3.57 -0.76 0.29 116.94 121.62 3cm6 h PHE 92 Ca -0.04 0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.55 3cm6 h PHE 92 Cb 0.37 0.17 -0.05 0.00 2.79 0.00 0.00 35.95 39.23 3cm6 h PHE 92 CO -0.03 -0.22 0.44 1.96 -2.23 0.00 0.00 178.31 178.24 3cm6 h GLN 93 N 0.06 0.83 -0.39 1.11 4.20 -0.81 -0.44 115.11 119.67 3cm6 h GLN 93 Ca 0.32 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.94 3cm6 h GLN 93 Cb 0.52 -0.19 -0.02 0.00 0.30 0.00 0.00 27.48 28.10 3cm6 h GLN 93 CO -0.59 0.55 0.06 0.37 -0.67 0.00 0.00 178.83 178.55 3cm6 h GLN 94 N 0.85 0.65 -0.79 1.46 5.75 0.14 -2.96 115.11 120.21 3cm6 h GLN 94 Ca 0.30 -0.17 0.04 0.00 -0.15 0.00 0.00 58.65 58.66 3cm6 h GLN 94 Cb 0.06 -0.08 -0.05 0.00 1.07 0.00 0.00 27.48 28.49 3cm6 h GLN 94 CO -0.13 0.70 0.49 2.35 -2.65 0.00 0.00 178.83 179.60 3cm6 h TRP 95 N 0.49 0.92 -0.32 3.99 7.01 -0.01 -2.68 115.95 125.35 3cm6 h TRP 95 Ca 0.12 0.03 0.07 0.00 2.11 0.00 0.00 58.89 61.21 3cm6 h TRP 95 Cb 0.37 -0.30 -0.07 0.00 -2.10 0.00 0.00 29.16 27.05 3cm6 h TRP 95 CO 0.03 0.51 -0.16 -0.07 -2.79 0.00 0.00 178.44 175.95 3cm6 h LEU 96 N 0.95 -0.55 -1.41 0.65 3.38 -0.93 -2.13 115.31 115.26 3cm6 h LEU 96 Ca 0.32 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.42 3cm6 h LEU 96 Cb 0.06 0.30 -0.03 0.00 0.09 0.00 0.00 40.66 41.08 3cm6 h LEU 96 CO -0.13 -0.20 0.29 0.16 0.09 0.00 0.00 178.44 178.65 3cm6 h ILE 97 N -0.12 1.15 -1.00 1.22 -0.00 -1.38 0.02 117.51 117.41 3cm6 h ILE 97 Ca 0.17 -0.36 0.20 0.00 -0.00 0.00 0.00 64.86 64.86 3cm6 h ILE 97 Cb 0.37 0.46 -0.10 0.00 -0.00 0.00 0.00 36.82 37.55 3cm6 h ILE 97 CO -0.40 0.16 0.62 0.74 -0.00 0.00 0.00 178.15 179.27 3cm6 h THR 98 N 0.70 0.67 0.00 0.16 2.02 -1.12 -2.28 112.91 113.06 3cm6 h THR 98 Ca 0.18 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 67.13 3cm6 h THR 98 Cb 0.00 -0.06 0.00 0.00 -1.74 0.00 0.00 68.15 66.35 3cm6 h THR 98 CO -0.03 0.12 0.00 -0.07 0.37 0.00 0.00 175.52 175.91 3cm6 h LEU 99 N 0.67 0.00 -1.73 2.58 4.07 -0.80 -3.47 115.31 116.64 3cm6 h LEU 99 Ca 0.57 0.00 -0.33 0.00 0.08 0.00 0.00 57.88 58.20 3cm6 h LEU 99 Cb 1.02 0.00 0.17 0.00 1.08 0.00 0.00 40.66 42.92 3cm6 h LEU 99 CO -0.35 0.00 -0.78 0.61 -1.08 0.00 0.00 178.44 176.83 3cm6 n GLY 100 N 0.59 -0.42 3.87 0.83 0.00 -0.86 -4.99 105.19 104.20 3cm6 n GLY 100 Ca 0.03 0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 3cm6 n GLY 100 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3cm6 s LEU 101 N -6.30 4.35 -0.04 0.99 1.43 -1.26 -5.06 118.68 112.79 3cm6 s LEU 101 Ca 0.04 0.74 -0.26 0.00 -1.03 0.00 0.00 54.13 53.61 3cm6 s LEU 101 Cb -0.01 -2.94 -0.03 0.00 0.03 0.00 0.00 46.19 43.24 3cm6 s LEU 101 CO 0.74 0.18 0.83 -0.70 0.23 0.00 0.00 176.35 177.63 3cm6 s GLU 102 N -1.91 4.49 0.09 1.70 2.12 -1.26 -4.98 118.70 118.95 3cm6 s GLU 102 Ca 0.32 1.13 -0.36 0.00 0.36 0.00 0.00 54.97 56.42 3cm6 s GLU 102 Cb -0.14 -3.46 -0.17 0.00 0.26 0.00 0.00 34.13 30.63 3cm6 s GLU 102 CO 0.18 0.00 1.29 -1.91 -0.54 0.00 0.00 175.26 174.28 3cm6 n GLU 103 N 3.86 1.05 -0.89 4.30 2.13 -1.26 -0.51 120.64 129.33 3cm6 n GLU 103 Ca 0.02 0.38 0.00 0.00 0.66 0.00 0.00 57.16 58.22 3cm6 n GLU 103 Cb 0.51 -1.99 0.00 0.00 0.27 0.00 0.00 31.44 30.23 3cm6 n GLU 103 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3cm6 n GLY 104 N 2.37 0.39 0.87 8.31 0.00 -1.26 -4.83 105.19 111.04 3cm6 n GLY 104 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.27 3cm6 n GLY 104 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3cm6 n LYS 105 N -1.53 2.99 -4.11 1.61 4.76 0.34 -4.93 118.16 117.30 3cm6 n LYS 105 Ca 0.00 -2.39 -0.14 0.00 -2.87 0.00 0.00 58.31 52.91 3cm6 n LYS 105 Cb 0.13 -1.51 -0.11 0.00 -1.84 0.00 0.00 35.03 31.70 3cm6 n LYS 105 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 3cm6 s PHE 106 N -1.54 0.86 0.02 2.13 -0.71 -1.26 -2.80 117.98 114.70 3cm6 s PHE 106 Ca 0.33 -0.55 -0.01 0.00 -1.04 0.00 0.00 56.93 55.66 3cm6 s PHE 106 Cb 0.21 -0.50 -0.02 0.00 -1.21 0.00 0.00 43.02 41.50 3cm6 s PHE 106 CO 0.17 -0.05 -0.02 0.00 -1.34 0.00 0.00 175.22 173.98 3cm6 s ALA 107 N -1.71 0.10 0.38 1.99 0.00 -1.17 -5.02 121.76 116.33 3cm6 s ALA 107 Ca -0.04 -0.58 -0.11 0.00 0.00 0.00 0.00 51.96 51.23 3cm6 s ALA 107 Cb -0.08 0.15 -0.07 0.00 0.00 0.00 0.00 23.12 23.13 3cm6 s ALA 107 CO 0.00 -0.17 0.75 -0.06 0.00 0.00 0.00 175.76 176.28 3cm6 s PHE 108 N -1.57 3.45 -0.04 0.00 0.08 -1.26 -0.63 117.98 118.01 3cm6 s PHE 108 Ca -0.15 1.06 0.01 0.00 0.12 0.00 0.00 56.93 57.97 3cm6 s PHE 108 Cb -0.09 -2.44 0.02 0.00 -0.57 0.00 0.00 43.02 39.94 3cm6 s PHE 108 CO -0.01 -0.04 -0.02 0.08 -0.10 0.00 0.00 175.22 175.12 3cm6 s VAL 109 N -2.26 0.40 0.13 -0.44 1.01 0.39 -0.66 120.40 118.96 3cm6 s VAL 109 Ca 0.51 -0.03 0.04 0.00 0.00 0.00 0.00 61.98 62.51 3cm6 s VAL 109 Cb -0.10 -0.46 -0.04 0.00 0.00 0.00 0.00 36.38 35.77 3cm6 s VAL 109 CO 0.28 0.20 -0.10 0.00 0.00 0.00 0.00 175.10 175.48 3cm6 n ASP 111 N 0.04 0.70 -1.82 0.00 5.75 -1.26 -0.95 116.55 119.01 3cm6 n ASP 111 Ca -0.12 0.60 -0.04 0.00 -0.01 0.00 0.00 54.79 55.21 3cm6 n ASP 111 Cb 0.60 -0.77 0.01 0.00 -1.03 0.00 0.00 41.12 39.92 3cm6 n ASP 111 CO 0.00 0.00 0.00 -1.54 -0.11 0.00 0.00 177.20 175.55 3cm6 n SER 112 N -2.19 -0.99 0.01 -1.12 3.41 -1.26 -3.85 113.62 107.63 3cm6 n SER 112 Ca 0.05 -1.74 0.14 0.00 -0.26 0.00 0.00 58.87 57.06 3cm6 n SER 112 Cb 0.36 1.66 0.57 0.00 -0.26 0.00 0.00 64.21 66.53 3cm6 n SER 112 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3cm6 n ARG 113 N -0.24 0.02 0.29 4.33 1.85 -1.26 -4.42 116.66 117.23 3cm6 n ARG 113 Ca -0.03 0.01 -0.17 0.00 -1.00 0.00 0.00 57.85 56.66 3cm6 n ARG 113 Cb 0.27 -1.52 -0.08 0.00 -1.05 0.00 0.00 32.46 30.07 3cm6 n ARG 113 CO 0.00 0.00 0.00 1.96 -0.01 0.00 0.00 177.63 179.58 3cm6 h GLN 114 N 0.00 -0.75 -0.83 2.89 1.08 -1.97 -1.64 115.11 113.88 3cm6 h GLN 114 Ca 0.00 0.05 0.18 0.00 -1.45 0.00 0.00 58.65 57.43 3cm6 h GLN 114 Cb 0.52 0.17 -0.11 0.00 -0.05 0.00 0.00 27.48 28.01 3cm6 h GLN 114 CO 0.00 -0.50 0.34 -0.44 -0.95 0.00 0.00 178.83 177.28 3cm6 h ASP 115 N -0.78 0.30 0.00 1.46 3.32 -1.96 -1.42 116.42 117.34 3cm6 h ASP 115 Ca -0.06 0.13 -0.29 0.00 0.02 0.00 0.00 57.03 56.83 3cm6 h ASP 115 Cb 0.64 0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.25 3cm6 h ASP 115 CO 0.06 0.06 -2.10 0.18 -1.72 0.00 0.00 179.24 175.72 3cm6 n LEU 116 N -5.02 2.41 -0.10 1.55 4.77 -1.23 -0.97 117.00 118.41 3cm6 n LEU 116 Ca 0.18 -0.09 -0.14 0.00 -0.03 0.00 0.00 56.01 55.94 3cm6 n LEU 116 Cb 0.53 -0.48 -0.03 0.00 -2.33 0.00 0.00 43.42 41.11 3cm6 n LEU 116 CO 0.15 0.74 0.49 -0.25 -1.33 0.00 0.00 177.39 177.20 3cm6 h TRP 117 N 0.00 1.10 0.00 -1.77 7.01 -1.31 -3.14 115.95 117.84 3cm6 h TRP 117 Ca -0.43 -0.36 0.00 0.00 2.11 0.00 0.00 58.89 60.21 3cm6 h TRP 117 Cb 1.73 -0.22 0.00 0.00 -2.10 0.00 0.00 29.16 28.57 3cm6 h TRP 117 CO 0.02 1.19 -0.55 -2.13 -2.79 0.00 0.00 178.44 174.17 3cm6 n ARG 118 N -4.03 0.29 0.27 2.65 0.63 -0.63 -4.43 116.66 111.41 3cm6 n ARG 118 Ca -0.03 0.12 -0.16 0.00 -0.92 0.00 0.00 57.85 56.86 3cm6 n ARG 118 Cb 0.59 -1.00 -0.08 0.00 0.45 0.00 0.00 32.46 32.41 3cm6 n ARG 118 CO 0.00 0.00 0.00 0.82 -2.51 0.00 0.00 177.63 175.94 3cm6 h ILE 119 N -0.55 0.48 -0.15 5.15 2.04 -1.34 -1.06 117.51 122.08 3cm6 h ILE 119 Ca 0.00 -0.20 -0.00 0.00 1.00 0.00 0.00 64.86 65.65 3cm6 h ILE 119 Cb 0.55 0.57 -0.01 0.00 -0.74 0.00 0.00 36.82 37.19 3cm6 h ILE 119 CO 0.00 0.03 0.08 0.00 0.00 0.00 0.00 178.15 178.27 3cm6 h ALA 120 N -0.37 0.19 -0.37 1.87 0.00 -1.20 -0.39 119.26 119.00 3cm6 h ALA 120 Ca -0.07 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.83 3cm6 h ALA 120 Cb 0.57 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.27 3cm6 h ALA 120 CO 0.11 -0.28 0.16 0.37 0.00 0.00 0.00 179.25 179.61 3cm6 h GLN 121 N 0.15 0.32 -0.07 0.00 4.15 -1.49 0.94 115.11 119.11 3cm6 h GLN 121 Ca 0.05 -0.02 -0.03 0.00 0.77 0.00 0.00 58.65 59.43 3cm6 h GLN 121 Cb 0.06 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 27.67 3cm6 h GLN 121 CO -0.01 0.21 -0.06 -0.92 -1.93 0.00 0.00 178.83 176.13 3cm6 h TYR 122 N 0.33 0.19 -0.95 3.99 3.20 -1.09 -2.35 116.97 120.29 3cm6 h TYR 122 Ca 0.16 -0.05 0.07 0.00 3.14 0.00 0.00 58.73 62.05 3cm6 h TYR 122 Cb 0.11 -0.04 -0.07 0.00 1.54 0.00 0.00 36.73 38.27 3cm6 h TYR 122 CO -0.12 0.58 0.61 0.37 -1.64 0.00 0.00 178.16 177.95 3cm6 h GLN 123 N -0.25 1.05 0.00 1.82 5.75 -0.90 -1.37 115.11 121.22 3cm6 h GLN 123 Ca 0.01 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.43 3cm6 h GLN 123 Cb 0.54 -0.24 -0.00 0.00 1.07 0.00 0.00 27.48 28.85 3cm6 h GLN 123 CO 0.01 0.70 -0.11 0.52 -2.65 0.00 0.00 178.83 177.30 3cm6 h MET 124 N 1.08 0.00 -0.24 1.69 2.86 -0.72 -0.93 114.93 118.67 3cm6 h MET 124 Ca 0.42 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.98 3cm6 h MET 124 Cb 0.21 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.86 3cm6 h MET 124 CO -0.18 0.11 -0.16 -0.22 1.06 0.00 0.00 176.91 177.51 3cm6 h LYS 125 N 0.00 0.53 -0.93 1.72 3.11 -0.73 -0.12 116.57 120.15 3cm6 h LYS 125 Ca -0.00 -0.25 0.02 0.00 -2.81 0.00 0.00 60.65 57.61 3cm6 h LYS 125 Cb 0.77 -0.00 -0.05 0.00 -1.00 0.00 0.00 32.23 31.94 3cm6 h LYS 125 CO 0.01 0.82 0.61 -0.07 -2.81 0.00 0.00 179.45 178.02 3cm6 h LEU 126 N 0.24 1.04 -0.50 5.20 3.38 -0.39 -2.56 115.31 121.72 3cm6 h LEU 126 Ca 0.05 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3cm6 h LEU 126 Cb 0.69 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.19 3cm6 h LEU 126 CO 0.04 0.74 -0.26 -1.20 0.09 0.00 0.00 178.44 177.85 3cm6 n SER 127 N -4.46 1.04 -3.59 -0.43 7.64 -0.44 -4.95 113.62 108.42 3cm6 n SER 127 Ca 0.11 -0.90 -0.23 0.00 1.01 0.00 0.00 58.87 58.86 3cm6 n SER 127 Cb 0.05 0.14 0.08 0.00 -1.01 0.00 0.00 64.21 63.46 3cm6 n SER 127 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 3cm6 n ASN 128 N -0.64 -5.55 -4.70 6.43 2.85 -0.64 -4.96 115.26 108.06 3cm6 n ASN 128 Ca 0.12 -0.57 -0.34 0.00 -0.11 0.00 0.00 54.58 53.68 3cm6 n ASN 128 Cb 0.35 -4.97 -0.09 0.00 1.24 0.00 0.00 39.78 36.31 3cm6 n ASN 128 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 3cm6 s ILE 129 N -3.33 4.35 0.11 -1.44 1.01 -0.15 -5.04 121.20 116.71 3cm6 s ILE 129 Ca 0.49 -0.39 -0.30 0.00 0.00 0.00 0.00 60.65 60.45 3cm6 s ILE 129 Cb -0.22 -2.90 -0.06 0.00 0.01 0.00 0.00 42.46 39.29 3cm6 s ILE 129 CO 0.74 0.48 1.07 -1.58 0.00 0.00 0.00 174.94 175.65 3cm6 s GLN 130 N -1.27 4.57 -0.08 2.79 0.74 -1.26 -4.54 119.66 120.62 3cm6 s GLN 130 Ca 0.17 1.62 -0.30 0.00 0.05 0.00 0.00 55.36 56.90 3cm6 s GLN 130 Cb -0.12 -3.34 -0.08 0.00 1.10 0.00 0.00 33.01 30.57 3cm6 s GLN 130 CO 0.07 0.01 2.05 -0.12 -0.55 0.00 0.00 175.29 176.75 3cm6 n MET 131 N 3.06 2.42 -2.50 1.67 0.00 -1.26 -4.94 117.12 115.57 3cm6 n MET 131 Ca 0.05 0.83 -0.39 0.00 -0.00 0.00 0.00 57.70 58.18 3cm6 n MET 131 Cb 0.48 -3.00 -0.04 0.00 0.00 0.00 0.00 33.22 30.65 3cm6 n MET 131 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 3cm6 s PRO 132 N 5.06 4.54 0.45 2.12 0.04 -1.26 -4.94 135.00 141.01 3cm6 s PRO 132 Ca 0.94 1.73 0.29 0.00 0.04 0.00 0.00 61.00 64.00 3cm6 s PRO 132 Cb -0.46 -3.05 1.38 0.00 0.04 0.00 0.00 34.50 32.41 3cm6 s PRO 132 CO 0.42 0.14 1.67 0.00 0.04 0.00 0.00 177.00 179.27 3cm6 h ALA 133 N 3.53 2.72 0.00 8.56 0.00 -1.92 0.25 119.26 132.40 3cm6 h ALA 133 Ca -0.47 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3cm6 h ALA 133 Cb 1.21 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3cm6 h ALA 133 CO 0.66 -1.27 0.00 1.97 0.00 0.00 0.00 179.25 180.61 3cm6 n PHE 134 N -4.58 0.00 0.71 0.00 -1.74 -1.26 -1.48 117.46 109.10 3cm6 n PHE 134 Ca 0.34 0.00 0.07 0.00 -0.56 0.00 0.00 57.45 57.30 3cm6 n PHE 134 Cb 1.32 -0.01 -0.05 0.00 1.52 0.00 0.00 39.48 42.26 3cm6 n PHE 134 CO 0.00 0.00 0.00 1.19 -0.56 0.00 0.00 176.76 177.39 3cm6 n PHE 135 N -1.01 0.00 1.08 2.97 3.01 0.86 -4.44 117.46 119.93 3cm6 n PHE 135 Ca 0.23 0.00 0.12 0.00 1.01 0.00 0.00 57.45 58.81 3cm6 n PHE 135 Cb 0.11 0.00 0.30 0.00 -0.01 0.00 0.00 39.48 39.88 3cm6 n PHE 135 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 3cm6 n ARG 136 N -0.85 2.06 -3.77 -1.08 1.74 -0.55 -4.77 116.66 109.44 3cm6 n ARG 136 Ca 0.04 -1.55 -0.14 0.00 -0.77 0.00 0.00 57.85 55.43 3cm6 n ARG 136 Cb 0.28 -1.46 -0.15 0.00 -1.02 0.00 0.00 32.46 30.10 3cm6 n ARG 136 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 3cm6 s GLN 137 N -1.88 0.03 0.26 5.56 -2.07 -1.21 -0.59 119.66 119.77 3cm6 s GLN 137 Ca 0.34 0.26 -0.17 0.00 -1.82 0.00 0.00 55.36 53.96 3cm6 s GLN 137 Cb 0.20 -0.19 0.01 0.00 -1.09 0.00 0.00 33.01 31.95 3cm6 s GLN 137 CO 0.31 -0.15 0.61 1.52 -1.32 0.00 0.00 175.29 176.26 3cm6 s TYR 138 N 1.00 0.05 -0.29 9.60 1.13 -1.03 -4.50 117.35 123.31 3cm6 s TYR 138 Ca -0.08 -0.46 -0.09 0.00 -1.41 0.00 0.00 57.07 55.02 3cm6 s TYR 138 Cb -0.11 0.48 -0.02 0.00 -1.10 0.00 0.00 41.96 41.21 3cm6 s TYR 138 CO -0.04 -1.13 0.14 0.42 -2.51 0.00 0.00 175.55 172.43 3cm6 s ILE 139 N -3.96 4.66 -0.68 -3.49 1.01 0.16 -2.83 121.20 116.08 3cm6 s ILE 139 Ca 0.16 -0.23 -0.22 0.00 0.00 0.00 0.00 60.65 60.36 3cm6 s ILE 139 Cb -0.04 -3.29 0.08 0.00 0.01 0.00 0.00 42.46 39.22 3cm6 s ILE 139 CO 0.08 0.18 0.96 0.21 0.00 0.00 0.00 174.94 176.37 3cm6 s ASN 140 N 1.64 6.21 0.37 3.58 3.84 -1.26 -1.57 114.94 127.76 3cm6 s ASN 140 Ca 0.06 -1.12 0.06 0.00 0.21 0.00 0.00 52.86 52.06 3cm6 s ASN 140 Cb -0.16 -2.41 0.76 0.00 -0.55 0.00 0.00 41.25 38.89 3cm6 s ASN 140 CO 0.06 -1.39 2.00 0.25 -2.79 0.00 0.00 177.10 175.24 3cm6 h LEU 141 N 11.17 0.62 -0.97 3.21 5.85 -1.30 -2.19 115.31 131.70 3cm6 h LEU 141 Ca -0.25 -0.01 -0.09 0.00 0.84 0.00 0.00 57.88 58.37 3cm6 h LEU 141 Cb 1.07 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.94 3cm6 h LEU 141 CO 1.17 0.43 -0.19 0.22 -0.34 0.00 0.00 178.44 179.73 3cm6 h TYR 142 N 0.72 0.58 -0.29 1.25 3.20 -1.76 -0.59 116.97 120.08 3cm6 h TYR 142 Ca 0.25 -0.11 -0.05 0.00 3.14 0.00 0.00 58.73 61.96 3cm6 h TYR 142 Cb 0.09 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.20 3cm6 h TYR 142 CO -0.00 0.69 -0.01 -0.22 -1.64 0.00 0.00 178.16 176.98 3cm6 h LYS 143 N 0.48 0.52 -0.39 1.82 3.64 -1.72 0.66 116.57 121.57 3cm6 h LYS 143 Ca 0.08 -0.17 0.04 0.00 -1.27 0.00 0.00 60.65 59.32 3cm6 h LYS 143 Cb 0.60 -0.05 -0.04 0.00 -0.41 0.00 0.00 32.23 32.34 3cm6 h LYS 143 CO 0.04 0.68 0.17 0.82 -2.27 0.00 0.00 179.45 178.89 3cm6 h ILE 144 N 0.31 0.94 -0.11 2.00 2.04 -1.42 -1.97 117.51 119.29 3cm6 h ILE 144 Ca 0.08 -0.12 0.04 0.00 1.00 0.00 0.00 64.86 65.87 3cm6 h ILE 144 Cb 0.44 0.55 -0.05 0.00 -0.74 0.00 0.00 36.82 37.02 3cm6 h ILE 144 CO 0.02 0.06 -0.23 0.15 0.00 0.00 0.00 178.15 178.16 3cm6 h PHE 145 N 0.35 -0.60 -0.79 1.37 3.57 -0.92 0.36 116.94 120.28 3cm6 h PHE 145 Ca 0.17 0.03 0.15 0.00 3.53 0.00 0.00 57.97 61.85 3cm6 h PHE 145 Cb 0.11 0.28 -0.15 0.00 2.79 0.00 0.00 35.95 38.99 3cm6 h PHE 145 CO -0.12 -0.31 -0.22 1.15 -2.23 0.00 0.00 178.31 176.58 3cm6 h THR 146 N -0.29 0.18 0.00 4.41 2.02 -0.53 0.23 112.91 118.93 3cm6 h THR 146 Ca 0.10 0.00 -0.06 0.00 0.77 0.00 0.00 66.41 67.21 3cm6 h THR 146 Cb 0.44 0.18 -0.01 0.00 -1.74 0.00 0.00 68.15 67.02 3cm6 h THR 146 CO -0.28 0.00 -0.30 0.78 0.37 0.00 0.00 175.52 176.09 3cm6 h ASN 147 N -0.02 0.00 1.27 4.18 2.35 -0.59 -2.50 115.58 120.27 3cm6 h ASN 147 Ca 0.37 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.12 3cm6 h ASN 147 Cb 0.58 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.95 3cm6 h ASN 147 CO -0.82 0.30 0.00 -0.33 -1.65 0.00 0.00 177.43 174.93 3cm6 h GLU 148 N 0.00 0.00 0.00 0.81 4.39 0.11 -2.92 114.58 116.97 3cm6 h GLU 148 Ca -0.00 0.00 -0.10 0.00 0.34 0.00 0.00 59.36 59.60 3cm6 h GLU 148 Cb 0.54 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.17 3cm6 h GLU 148 CO 0.04 0.00 -0.59 0.52 -1.16 0.00 0.00 179.01 177.82 3cm6 h MET 149 N 0.00 0.00 0.24 2.33 2.86 -0.88 -1.89 114.93 117.59 3cm6 h MET 149 Ca 0.00 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 3cm6 h MET 149 Cb 0.63 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.30 3cm6 h MET 149 CO 0.00 0.41 -0.11 -0.44 1.06 0.00 0.00 176.91 177.82 3cm6 h ASP 150 N 0.00 -0.27 0.01 1.22 3.32 -1.51 -1.96 116.42 117.22 3cm6 h ASP 150 Ca -0.02 -0.25 0.00 0.00 0.02 0.00 0.00 57.03 56.78 3cm6 h ASP 150 Cb 1.36 0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.97 3cm6 h ASP 150 CO 0.05 0.22 -0.09 0.03 -1.72 0.00 0.00 179.24 177.73 3cm6 h ARG 151 N -0.88 -0.12 0.00 3.56 3.08 -1.59 -3.19 114.38 115.23 3cm6 h ARG 151 Ca -0.03 0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.03 3cm6 h ARG 151 Cb 0.51 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.58 3cm6 h ARG 151 CO 0.05 -0.08 0.00 -1.33 -1.07 0.00 0.00 179.97 177.54 3cm6 n MET 152 N -3.00 0.10 0.00 0.04 2.81 -0.71 -5.01 117.12 111.35 3cm6 n MET 152 Ca -0.01 0.03 0.00 0.00 -1.81 0.00 0.00 57.70 55.90 3cm6 n MET 152 Cb 0.07 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.08 3cm6 n MET 152 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3cm6 n GLY 153 N 1.28 0.68 3.52 3.03 0.00 -0.76 -5.04 105.19 107.91 3cm6 n GLY 153 Ca 0.08 -1.49 -0.28 0.00 0.00 0.00 0.00 46.02 44.33 3cm6 n GLY 153 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3cm6 s PRO 154 N -5.00 -0.72 -0.03 1.61 0.02 -1.08 -4.80 135.00 125.00 3cm6 s PRO 154 Ca 0.00 0.84 -0.13 0.00 0.02 0.00 0.00 61.00 61.72 3cm6 s PRO 154 Cb 0.00 -1.58 0.02 0.00 0.02 0.00 0.00 34.50 32.96 3cm6 s PRO 154 CO 0.00 -3.59 0.29 0.15 -0.33 0.00 0.00 177.00 173.52 3cm6 s LYS 155 N -4.52 0.60 -0.21 5.54 1.02 -1.26 -5.13 119.74 115.78 3cm6 s LYS 155 Ca 0.68 -0.13 -0.29 0.00 0.02 0.00 0.00 55.97 56.25 3cm6 s LYS 155 Cb -0.24 0.27 0.00 0.00 -0.52 0.00 0.00 37.83 37.34 3cm6 s LYS 155 CO 0.64 -0.15 1.02 -2.00 -0.92 0.00 0.00 175.35 173.93 3cm6 s GLU 156 N -1.12 4.29 -0.10 1.68 -6.30 -1.26 -5.03 118.70 110.86 3cm6 s GLU 156 Ca -0.12 1.34 0.01 0.00 -2.50 0.00 0.00 54.97 53.71 3cm6 s GLU 156 Cb -0.05 -3.62 -0.02 0.00 0.00 0.00 0.00 34.13 30.44 3cm6 s GLU 156 CO 0.03 -0.56 -0.15 -0.51 0.02 0.00 0.00 175.26 174.09 3cm6 s LEU 157 N 2.95 2.63 0.00 2.70 1.43 -1.26 -5.00 118.68 122.13 3cm6 s LEU 157 Ca 0.44 -0.33 0.21 0.00 -1.03 0.00 0.00 54.13 53.43 3cm6 s LEU 157 Cb -0.16 -1.57 -0.21 0.00 0.03 0.00 0.00 46.19 44.29 3cm6 s LEU 157 CO 0.08 0.21 0.91 -1.54 0.23 0.00 0.00 176.35 176.25 3cm6 n SER 158 N 3.21 1.09 -4.70 2.29 3.41 -1.26 -4.99 113.62 112.67 3cm6 n SER 158 Ca -0.18 -1.05 -0.31 0.00 -0.26 0.00 0.00 58.87 57.08 3cm6 n SER 158 Cb 0.53 0.95 0.14 0.00 -0.26 0.00 0.00 64.21 65.57 3cm6 n SER 158 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3cm6 s ALA 159 N -2.95 1.66 -0.08 7.33 0.00 -1.26 -5.00 121.76 121.46 3cm6 s ALA 159 Ca 0.09 0.40 0.08 0.00 0.00 0.00 0.00 51.96 52.53 3cm6 s ALA 159 Cb 0.16 -3.36 -0.12 0.00 0.00 0.00 0.00 23.12 19.80 3cm6 s ALA 159 CO 0.84 -2.44 0.05 -2.37 0.00 0.00 0.00 175.76 171.84 3cm6 n THR 160 N -4.00 0.55 -4.32 0.00 5.66 -1.26 -4.71 114.28 106.20 3cm6 n THR 160 Ca 0.10 -0.37 -0.24 0.00 -3.05 0.00 0.00 64.05 60.49 3cm6 n THR 160 Cb 0.53 -0.64 -0.08 0.00 -1.55 0.00 0.00 70.33 68.59 3cm6 n THR 160 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 3cm6 s THR 161 N -2.28 2.86 0.17 1.09 -4.23 -1.26 -4.97 115.64 107.03 3cm6 s THR 161 Ca -0.04 -1.99 -0.19 0.00 -1.18 0.00 0.00 61.69 58.29 3cm6 s THR 161 Cb 0.03 -2.76 0.09 0.00 1.34 0.00 0.00 72.50 71.20 3cm6 s THR 161 CO 0.38 -0.27 1.65 0.78 -0.54 0.00 0.00 174.62 176.61 3cm6 h ASN 162 N 1.87 -0.56 -0.84 3.99 -0.26 -1.95 0.24 115.58 118.07 3cm6 h ASN 162 Ca -0.43 0.14 -0.03 0.00 -0.56 0.00 0.00 56.30 55.42 3cm6 h ASN 162 Cb 1.25 0.31 -0.04 0.00 -1.06 0.00 0.00 38.32 38.79 3cm6 h ASN 162 CO 0.64 -0.20 0.41 0.40 -1.06 0.00 0.00 177.43 177.62 3cm6 h ILE 163 N -0.09 1.26 0.42 2.81 2.04 -1.97 -2.38 117.51 119.61 3cm6 h ILE 163 Ca 0.19 -0.72 -0.01 0.00 1.00 0.00 0.00 64.86 65.31 3cm6 h ILE 163 Cb 0.38 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 36.63 3cm6 h ILE 163 CO -0.44 0.31 -0.28 1.23 0.00 0.00 0.00 178.15 178.98 3cm6 h GLY 164 N 1.20 -0.71 0.55 5.37 0.00 -1.59 -1.83 103.07 106.05 3cm6 h GLY 164 Ca 0.29 0.31 0.08 0.00 0.00 0.00 0.00 47.33 48.00 3cm6 h GLY 164 CO -0.04 -0.27 0.30 0.50 0.00 0.00 0.00 176.54 177.03 3cm6 h LYS 165 N -0.67 0.52 -0.38 4.80 1.57 -0.52 -0.75 116.57 121.14 3cm6 h LYS 165 Ca -0.04 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 58.67 3cm6 h LYS 165 Cb 0.56 -0.12 -0.02 0.00 0.08 0.00 0.00 32.23 32.74 3cm6 h LYS 165 CO 0.03 0.35 0.11 0.52 -0.57 0.00 0.00 179.45 179.89 3cm6 h MET 166 N 0.54 0.60 -0.85 3.15 2.86 -1.31 -0.49 114.93 119.42 3cm6 h MET 166 Ca 0.30 -0.13 0.03 0.00 -2.06 0.00 0.00 59.70 57.84 3cm6 h MET 166 Cb 0.28 -0.08 -0.05 0.00 0.06 0.00 0.00 31.60 31.81 3cm6 h MET 166 CO -0.24 0.61 0.55 -0.91 1.06 0.00 0.00 176.91 177.99 3cm6 h ASN 167 N 0.47 0.91 -0.52 1.22 2.35 -0.97 -1.43 115.58 117.62 3cm6 h ASN 167 Ca 0.12 -0.01 -0.03 0.00 -0.55 0.00 0.00 56.30 55.84 3cm6 h ASN 167 Cb 0.27 -0.21 -0.02 0.00 0.05 0.00 0.00 38.32 38.41 3cm6 h ASN 167 CO -0.00 0.63 0.21 -0.08 -1.65 0.00 0.00 177.43 176.53 3cm6 h GLU 168 N 1.07 0.78 0.40 0.81 4.81 -0.70 0.24 114.58 121.98 3cm6 h GLU 168 Ca 0.34 -0.14 -0.02 0.00 -0.13 0.00 0.00 59.36 59.41 3cm6 h GLU 168 Cb 0.00 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.26 3cm6 h GLU 168 CO -0.11 0.69 -0.19 -0.92 -0.73 0.00 0.00 179.01 177.74 3cm6 h TYR 169 N 0.70 -0.50 -0.03 0.92 3.20 -0.62 -2.67 116.97 117.98 3cm6 h TYR 169 Ca 0.17 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.03 3cm6 h TYR 169 Cb 0.20 0.16 0.00 0.00 1.54 0.00 0.00 36.73 38.63 3cm6 h TYR 169 CO 0.01 -0.21 0.00 0.66 -1.64 0.00 0.00 178.16 176.98 3cm6 n TYR 170 N -5.24 0.07 -3.99 -3.82 4.01 -0.58 -4.87 117.16 102.73 3cm6 n TYR 170 Ca -0.11 -0.03 -0.30 0.00 -0.16 0.00 0.00 57.90 57.31 3cm6 n TYR 170 Cb 0.27 -0.06 -0.02 0.00 -0.31 0.00 0.00 39.34 39.23 3cm6 n TYR 170 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3cm6 n ASP 171 N -0.20 -1.33 -4.62 7.72 2.03 -0.56 -4.95 116.55 114.64 3cm6 n ASP 171 Ca 0.01 -1.09 -0.33 0.00 0.52 0.00 0.00 54.79 53.90 3cm6 n ASP 171 Cb 0.15 -2.68 -0.10 0.00 -0.72 0.00 0.00 41.12 37.77 3cm6 n ASP 171 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 3cm6 s LEU 172 N -7.02 3.28 0.28 -2.67 1.43 0.72 -5.03 118.68 109.68 3cm6 s LEU 172 Ca 0.14 -0.04 -0.29 0.00 -1.03 0.00 0.00 54.13 52.90 3cm6 s LEU 172 Cb -0.06 -1.80 -0.10 0.00 0.03 0.00 0.00 46.19 44.26 3cm6 s LEU 172 CO 0.91 0.32 1.20 -2.16 0.23 0.00 0.00 176.35 176.86 3cm6 s PRO 173 N -1.15 4.51 0.10 1.29 0.04 -1.26 -4.57 135.00 133.95 3cm6 s PRO 173 Ca 0.15 1.98 -0.31 0.00 0.04 0.00 0.00 61.00 62.86 3cm6 s PRO 173 Cb -0.11 -3.15 -0.09 0.00 0.04 0.00 0.00 34.50 31.18 3cm6 s PRO 173 CO 0.05 0.00 1.74 0.99 0.04 0.00 0.00 177.00 179.82 3cm6 s THR 174 N -0.94 2.79 -0.12 1.26 2.01 -1.26 -4.99 115.64 114.39 3cm6 s THR 174 Ca 0.48 0.27 -0.18 0.00 0.31 0.00 0.00 61.69 62.57 3cm6 s THR 174 Cb -0.35 -3.18 -0.04 0.00 0.01 0.00 0.00 72.50 68.94 3cm6 s THR 174 CO 0.45 -0.00 0.48 -0.63 -0.69 0.00 0.00 174.62 174.22 3cm6 s ILE 175 N 2.67 5.19 0.00 1.82 1.01 -1.26 -4.98 121.20 125.64 3cm6 s ILE 175 Ca 0.77 0.96 0.00 0.00 0.00 0.00 0.00 60.65 62.38 3cm6 s ILE 175 Cb -0.43 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.22 3cm6 s ILE 175 CO 0.34 0.33 0.00 0.61 0.00 0.00 0.00 174.94 176.22 3cm6 n GLY 176 N 3.25 1.24 3.48 6.18 0.00 -1.26 -4.67 105.19 113.41 3cm6 n GLY 176 Ca -0.07 -0.56 -0.33 0.00 0.00 0.00 0.00 46.02 45.06 3cm6 n GLY 176 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3cm6 s ARG 177 N 0.00 2.49 0.37 1.61 3.52 -1.26 -5.11 118.95 120.57 3cm6 s ARG 177 Ca 0.00 -0.70 -0.25 0.00 -0.13 0.00 0.00 55.73 54.65 3cm6 s ARG 177 Cb 0.00 -2.38 -0.13 0.00 -1.56 0.00 0.00 34.95 30.88 3cm6 s ARG 177 CO 0.00 0.62 0.72 0.00 -0.81 0.00 0.00 175.30 175.83 3cm6 n ALA 178 N 2.26 -1.10 -0.98 6.12 0.00 -1.26 -3.00 120.51 122.56 3cm6 n ALA 178 Ca -0.17 0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.52 3cm6 n ALA 178 Cb 0.52 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.11 3cm6 n ALA 178 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3cm6 n HIS 179 N -0.47 0.00 -2.88 0.00 8.25 -1.26 -4.89 115.22 113.97 3cm6 n HIS 179 Ca 0.11 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.16 3cm6 n HIS 179 Cb 0.36 -1.33 -0.04 0.00 1.12 0.00 0.00 29.99 30.10 3cm6 n HIS 179 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 3cm6 s ASP 180 N -2.02 6.89 0.28 0.41 -1.08 -1.16 -4.70 116.67 115.29 3cm6 s ASP 180 Ca 0.00 1.10 0.01 0.00 -0.52 0.00 0.00 52.55 53.14 3cm6 s ASP 180 Cb 0.00 -2.45 0.55 0.00 -1.46 0.00 0.00 42.92 39.56 3cm6 s ASP 180 CO 0.00 -0.47 1.82 0.00 0.52 0.00 0.00 175.17 177.03 3cm6 h ALA 181 N 7.53 1.46 -0.22 3.66 0.00 -1.91 0.23 119.26 130.00 3cm6 h ALA 181 Ca -0.25 0.04 -0.15 0.00 0.00 0.00 0.00 54.91 54.55 3cm6 h ALA 181 Cb 1.11 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.73 3cm6 h ALA 181 CO 0.86 0.15 -0.43 1.98 0.00 0.00 0.00 179.25 181.81 3cm6 h MET 182 N 0.91 0.69 -0.52 0.00 1.85 -1.92 -0.21 114.93 115.72 3cm6 h MET 182 Ca 0.49 -0.44 -0.00 0.00 -0.61 0.00 0.00 59.70 59.14 3cm6 h MET 182 Cb 0.53 0.05 -0.03 0.00 0.43 0.00 0.00 31.60 32.59 3cm6 h MET 182 CO -0.28 1.06 0.32 -0.44 -0.40 0.00 0.00 176.91 177.16 3cm6 h ASP 183 N 0.40 0.63 -0.12 1.39 3.32 -1.62 0.09 116.42 120.51 3cm6 h ASP 183 Ca 0.01 -0.06 0.02 0.00 0.02 0.00 0.00 57.03 57.03 3cm6 h ASP 183 Cb 1.03 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 40.40 3cm6 h ASP 183 CO 0.10 0.50 -0.03 0.44 -1.72 0.00 0.00 179.24 178.53 3cm6 h ASP 184 N 0.70 -0.11 -0.66 6.45 3.45 -0.49 -2.26 116.42 123.51 3cm6 h ASP 184 Ca 0.19 0.03 0.12 0.00 0.43 0.00 0.00 57.03 57.80 3cm6 h ASP 184 Cb -0.01 0.07 -0.08 0.00 -0.56 0.00 0.00 39.33 38.74 3cm6 h ASP 184 CO -0.04 -0.04 0.23 0.00 -1.57 0.00 0.00 179.24 177.83 3cm6 h LEU 186 N 0.39 0.03 -0.94 0.00 3.38 -0.76 -1.50 115.31 115.91 3cm6 h LEU 186 Ca 0.35 -0.28 0.17 0.00 0.09 0.00 0.00 57.88 58.20 3cm6 h LEU 186 Cb 0.49 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.13 3cm6 h LEU 186 CO -0.36 0.31 0.53 0.78 0.09 0.00 0.00 178.44 179.78 3cm6 h ASN 187 N -0.25 0.66 -0.49 -0.43 2.35 -1.20 0.39 115.58 116.60 3cm6 h ASN 187 Ca 0.00 0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 55.75 3cm6 h ASN 187 Cb 0.29 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.63 3cm6 h ASN 187 CO 0.00 0.25 -0.09 0.40 -1.65 0.00 0.00 177.43 176.34 3cm6 h ILE 188 N 0.70 1.27 -0.44 2.81 2.04 -0.93 0.09 117.51 123.05 3cm6 h ILE 188 Ca 0.53 -1.22 -0.06 0.00 1.00 0.00 0.00 64.86 65.11 3cm6 h ILE 188 Cb 0.79 1.05 -0.02 0.00 -0.74 0.00 0.00 36.82 37.90 3cm6 h ILE 188 CO -0.38 0.42 0.03 0.00 0.00 0.00 0.00 178.15 178.22 3cm6 h ALA 189 N 0.90 0.59 0.09 1.87 0.00 -0.55 0.26 119.26 122.42 3cm6 h ALA 189 Ca 0.13 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3cm6 h ALA 189 Cb 0.64 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3cm6 h ALA 189 CO 0.04 0.35 -0.04 1.15 0.00 0.00 0.00 179.25 180.75 3cm6 h THR 190 N 0.60 0.93 -0.37 0.00 2.02 -0.74 0.16 112.91 115.52 3cm6 h THR 190 Ca 0.13 -0.09 0.04 0.00 0.77 0.00 0.00 66.41 67.26 3cm6 h THR 190 Cb 0.45 0.99 -0.04 0.00 -1.74 0.00 0.00 68.15 67.81 3cm6 h THR 190 CO 0.02 0.02 0.14 0.40 0.37 0.00 0.00 175.52 176.47 3cm6 h ILE 191 N -0.17 0.92 -0.67 3.11 2.04 -0.87 -1.80 117.51 120.08 3cm6 h ILE 191 Ca -0.01 -0.11 0.11 0.00 1.00 0.00 0.00 64.86 65.85 3cm6 h ILE 191 Cb 0.13 0.58 -0.08 0.00 -0.74 0.00 0.00 36.82 36.72 3cm6 h ILE 191 CO 0.02 0.06 0.27 0.25 0.00 0.00 0.00 178.15 178.75 3cm6 h LEU 192 N 0.31 0.29 0.63 1.44 5.85 -0.08 -0.54 115.31 123.21 3cm6 h LEU 192 Ca 0.16 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.94 3cm6 h LEU 192 Cb 0.12 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.19 3cm6 h LEU 192 CO -0.15 0.15 -0.42 -0.61 -0.34 0.00 0.00 178.44 177.07 3cm6 h GLN 193 N 0.46 -0.97 -0.91 1.25 4.15 -0.18 -1.89 115.11 117.02 3cm6 h GLN 193 Ca 0.34 0.07 0.10 0.00 0.77 0.00 0.00 58.65 59.93 3cm6 h GLN 193 Cb 0.44 0.22 -0.08 0.00 0.21 0.00 0.00 27.48 28.27 3cm6 h GLN 193 CO -0.32 -0.65 0.55 0.00 -1.93 0.00 0.00 178.83 176.48 3cm6 h ARG 194 N -1.01 0.89 -0.18 1.69 3.08 -0.92 -1.89 114.38 116.04 3cm6 h ARG 194 Ca -0.08 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 59.95 3cm6 h ARG 194 Cb 0.83 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.65 3cm6 h ARG 194 CO 0.06 0.59 -0.01 0.52 -1.07 0.00 0.00 179.97 180.06 3cm6 h MET 195 N 0.92 0.05 -0.40 0.04 2.86 -0.81 -0.23 114.93 117.36 3cm6 h MET 195 Ca 0.44 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 58.09 3cm6 h MET 195 Cb 0.38 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 3cm6 h MET 195 CO -0.24 0.03 0.24 0.82 1.06 0.00 0.00 176.91 178.82 3cm6 h ILE 196 N 0.05 1.05 0.00 -1.22 2.04 -0.90 -2.21 117.51 116.33 3cm6 h ILE 196 Ca 0.08 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.76 3cm6 h ILE 196 Cb 0.11 0.52 -0.00 0.00 -0.74 0.00 0.00 36.82 36.71 3cm6 h ILE 196 CO -0.15 0.09 -0.10 0.78 0.00 0.00 0.00 178.15 178.77 3cm6 h ASN 197 N 0.49 0.00 -0.21 1.72 2.35 -0.66 -1.25 115.58 118.02 3cm6 h ASN 197 Ca 0.15 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.90 3cm6 h ASN 197 Cb -0.01 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.36 3cm6 h ASN 197 CO -0.06 0.10 0.00 0.23 -1.65 0.00 0.00 177.43 176.05 3cm6 n MET 198 N -3.55 1.89 0.00 0.81 2.81 -0.16 -4.95 117.12 113.96 3cm6 n MET 198 Ca -0.02 -1.34 0.00 0.00 -1.81 0.00 0.00 57.70 54.54 3cm6 n MET 198 Cb 0.24 -1.41 0.00 0.00 -0.71 0.00 0.00 33.22 31.33 3cm6 n MET 198 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3cm6 n GLY 199 N 1.20 1.15 3.77 3.03 0.00 -0.47 -5.06 105.19 108.81 3cm6 n GLY 199 Ca 0.17 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 3cm6 n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3cm6 s ALA 200 N -2.00 3.28 -0.50 4.61 0.00 -0.87 -4.98 121.76 121.30 3cm6 s ALA 200 Ca 0.00 0.97 -0.29 0.00 0.00 0.00 0.00 51.96 52.65 3cm6 s ALA 200 Cb 0.00 -3.37 0.02 0.00 0.00 0.00 0.00 23.12 19.77 3cm6 s ALA 200 CO 0.00 -0.41 1.27 0.15 0.00 0.00 0.00 175.76 176.76 3cm6 s LYS 201 N -1.98 3.57 -0.30 0.00 1.02 -1.26 -4.74 119.74 116.05 3cm6 s LYS 201 Ca 0.52 0.57 -0.07 0.00 0.02 0.00 0.00 55.97 57.01 3cm6 s LYS 201 Cb -0.32 -4.00 0.01 0.00 -0.52 0.00 0.00 37.83 33.00 3cm6 s LYS 201 CO 0.41 -1.59 0.10 0.08 -0.92 0.00 0.00 175.35 173.42 3cm6 s VAL 202 N 5.09 4.05 0.36 3.17 1.01 -1.26 -5.00 120.40 127.82 3cm6 s VAL 202 Ca 0.51 -0.70 -0.14 0.00 0.00 0.00 0.00 61.98 61.65 3cm6 s VAL 202 Cb -0.09 -3.11 0.04 0.00 0.00 0.00 0.00 36.38 33.22 3cm6 s VAL 202 CO 0.30 0.05 0.72 -0.89 0.00 0.00 0.00 175.10 175.27 3cm6 s THR 203 N 1.51 0.00 0.04 3.92 2.01 -1.26 -4.31 115.64 117.54 3cm6 s THR 203 Ca 0.03 -1.11 -0.30 0.00 0.31 0.00 0.00 61.69 60.61 3cm6 s THR 203 Cb -0.17 -2.68 -0.09 0.00 0.01 0.00 0.00 72.50 69.57 3cm6 s THR 203 CO 0.03 0.00 1.93 -0.69 -0.69 0.00 0.00 174.62 175.20 3cm6 s VAL 204 N -2.75 3.01 0.00 3.82 1.01 -1.26 -4.63 120.40 119.60 3cm6 s VAL 204 Ca 0.17 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.23 3cm6 s VAL 204 Cb -0.04 -3.05 0.00 0.00 0.00 0.00 0.00 36.38 33.29 3cm6 s VAL 204 CO 0.12 -0.01 0.30 -0.46 0.00 0.00 0.00 175.10 175.06 3cm6 n ASN 205 N 7.33 0.60 -3.80 3.32 6.94 -1.13 -4.71 115.26 123.81 3cm6 n ASN 205 Ca 0.19 -0.81 -0.15 0.00 -0.02 0.00 0.00 54.58 53.80 3cm6 n ASN 205 Cb 0.41 0.36 -0.16 0.00 -2.36 0.00 0.00 39.78 38.03 3cm6 n ASN 205 CO 0.00 0.00 0.00 -1.61 -1.03 0.00 0.00 177.26 174.62 3cm6 s GLU 206 N -0.36 0.03 0.08 -3.83 2.02 -1.14 -2.05 118.70 113.45 3cm6 s GLU 206 Ca 0.00 0.13 0.09 0.00 0.02 0.00 0.00 54.97 55.21 3cm6 s GLU 206 Cb 0.00 -0.24 -0.03 0.00 0.10 0.00 0.00 34.13 33.96 3cm6 s GLU 206 CO 0.00 -0.13 -0.23 -0.51 0.02 0.00 0.00 175.26 174.41 3cm6 s LEU 207 N 0.84 2.24 -0.24 1.80 1.43 -0.02 -2.48 118.68 122.26 3cm6 s LEU 207 Ca -0.07 -0.63 -0.11 0.00 -1.03 0.00 0.00 54.13 52.29 3cm6 s LEU 207 Cb -0.10 -1.04 -0.05 0.00 0.03 0.00 0.00 46.19 45.03 3cm6 s LEU 207 CO -0.02 0.14 0.17 -0.76 0.23 0.00 0.00 176.35 176.11 3cm6 s LEU 208 N -1.61 4.11 0.04 1.79 1.43 0.25 -0.69 118.68 124.00 3cm6 s LEU 208 Ca 0.09 0.11 0.04 0.00 -1.03 0.00 0.00 54.13 53.35 3cm6 s LEU 208 Cb -0.10 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 3cm6 s LEU 208 CO 0.04 0.06 -0.12 -0.89 0.23 0.00 0.00 176.35 175.66 3cm6 s THR 209 N 1.09 0.96 0.01 5.49 2.01 0.29 -4.77 115.64 120.74 3cm6 s THR 209 Ca 0.08 -1.02 0.32 0.00 0.31 0.00 0.00 61.69 61.38 3cm6 s THR 209 Cb -0.14 -0.90 0.37 0.00 0.01 0.00 0.00 72.50 71.84 3cm6 s THR 209 CO 0.05 -0.11 1.95 0.00 -0.69 0.00 0.00 174.62 175.82 3cm6 s ALA 212 N 0.65 -0.88 -0.71 0.00 0.00 -1.26 -4.83 121.76 114.72 3cm6 s ALA 212 Ca -0.03 1.12 0.17 0.00 0.00 0.00 0.00 51.96 53.22 3cm6 s ALA 212 Cb -0.05 -0.66 0.74 0.00 0.00 0.00 0.00 23.12 23.14 3cm6 s ALA 212 CO -0.04 -0.19 1.52 -1.13 0.00 0.00 0.00 175.76 175.91 3cm6 n SER 213 N 3.35 0.31 -0.03 0.00 3.41 -1.26 -2.27 113.62 117.13 3cm6 n SER 213 Ca -0.17 0.59 0.12 0.00 -0.26 0.00 0.00 58.87 59.16 3cm6 n SER 213 Cb 0.56 -0.65 0.70 0.00 -0.26 0.00 0.00 64.21 64.56 3cm6 n SER 213 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 3cm6 n TRP 214 N -1.86 0.01 0.02 7.33 4.27 -1.26 -2.22 117.44 123.73 3cm6 n TRP 214 Ca 0.02 -0.00 0.09 0.00 -3.89 0.00 0.00 57.50 53.71 3cm6 n TRP 214 Cb 0.15 0.00 0.19 0.00 -1.36 0.00 0.00 31.31 30.29 3cm6 n TRP 214 CO 0.00 0.00 0.00 0.54 -2.29 0.00 0.00 177.69 175.94 3cm6 n ARG 215 N -0.81 2.38 -0.06 -2.67 1.74 -0.96 -4.51 116.66 111.76 3cm6 n ARG 215 Ca 0.18 -2.10 -0.11 0.00 -0.77 0.00 0.00 57.85 55.05 3cm6 n ARG 215 Cb 0.10 -1.39 0.03 0.00 -1.02 0.00 0.00 32.46 30.18 3cm6 n ARG 215 CO 0.00 0.00 0.00 0.07 -1.52 0.00 0.00 177.63 176.18 3cm6 h ARG 216 N 3.19 0.76 -5.60 5.56 0.11 -1.62 -3.42 114.38 113.35 3cm6 h ARG 216 Ca 0.00 -0.41 -0.60 0.00 0.10 0.00 0.00 59.98 59.07 3cm6 h ARG 216 Cb 0.81 0.02 -0.09 0.00 1.11 0.00 0.00 29.97 31.82 3cm6 h ARG 216 CO 0.00 1.04 -0.30 -1.14 0.10 0.00 0.00 179.97 179.66 3cm6 s GLN 217 N -4.28 4.14 0.78 0.08 0.74 -1.26 -5.08 119.66 114.78 3cm6 s GLN 217 Ca -0.09 0.15 -0.16 0.00 0.05 0.00 0.00 55.36 55.31 3cm6 s GLN 217 Cb 0.12 -3.38 -0.04 0.00 1.10 0.00 0.00 33.01 30.81 3cm6 s GLN 217 CO 0.86 0.35 0.36 -2.30 -0.55 0.00 0.00 175.29 174.00 3cm6 n PRO 218 N 3.18 0.14 -2.85 1.67 -0.02 -1.26 -4.95 135.00 130.92 3cm6 n PRO 218 Ca -0.12 0.09 -0.37 0.00 -2.02 0.00 0.00 63.50 61.07 3cm6 n PRO 218 Cb 0.52 -1.72 -0.06 0.00 -0.02 0.00 0.00 33.50 32.22 3cm6 n PRO 218 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3cm6 s LEU 219 N 0.59 4.38 -0.67 2.45 2.96 -1.26 -4.97 118.68 122.16 3cm6 s LEU 219 Ca 0.61 1.76 -0.27 0.00 -0.22 0.00 0.00 54.13 56.01 3cm6 s LEU 219 Cb -0.32 -3.86 -0.00 0.00 0.50 0.00 0.00 46.19 42.50 3cm6 s LEU 219 CO 0.62 -0.02 1.67 -0.69 -1.32 0.00 0.00 176.35 176.62 3cm6 s VAL 220 N -1.54 3.48 0.21 1.68 1.01 -1.26 -4.94 120.40 119.04 3cm6 s VAL 220 Ca 0.47 0.23 -0.31 0.00 0.00 0.00 0.00 61.98 62.38 3cm6 s VAL 220 Cb -0.19 -4.27 -0.10 0.00 0.00 0.00 0.00 36.38 31.82 3cm6 s VAL 220 CO 0.24 -1.23 1.53 -0.47 0.00 0.00 0.00 175.10 175.17 3cm6 s TYR 221 N 7.99 3.00 -0.35 5.22 5.04 -1.26 -5.01 117.35 131.98 3cm6 s TYR 221 Ca 0.57 0.77 0.00 0.00 -2.44 0.00 0.00 57.07 55.97 3cm6 s TYR 221 Cb -0.11 -3.92 0.09 0.00 0.35 0.00 0.00 41.96 38.38 3cm6 s TYR 221 CO 0.18 -3.22 0.08 1.21 -1.34 0.00 0.00 175.55 172.46 3cm6 s ASN 222 N 0.79 4.95 0.53 4.32 2.47 -1.26 -5.01 114.94 121.73 3cm6 s ASN 222 Ca 0.66 -1.87 0.36 0.00 0.42 0.00 0.00 52.86 52.43 3cm6 s ASN 222 Cb -0.44 -1.71 1.53 0.00 -1.45 0.00 0.00 41.25 39.18 3cm6 s ASN 222 CO 0.37 -0.40 1.78 0.11 -3.72 0.00 0.00 177.10 175.24 3cm6 h LYS 223 N 7.86 0.03 -0.96 0.43 6.56 -2.04 -0.89 116.57 127.56 3cm6 h LYS 223 Ca -0.12 -0.00 -0.43 0.00 -1.06 0.00 0.00 60.65 59.04 3cm6 h LYS 223 Cb 1.04 -0.01 -0.25 0.00 -0.57 0.00 0.00 32.23 32.44 3cm6 h LYS 223 CO 0.58 0.02 0.54 0.39 -2.06 0.00 0.00 179.45 178.93 3cm6 n GLU 224 N -4.21 2.36 0.11 3.15 -0.58 -1.26 -4.64 120.64 115.58 3cm6 n GLU 224 Ca 0.28 -2.75 0.00 0.00 -0.42 0.00 0.00 57.16 54.27 3cm6 n GLU 224 Cb 1.30 -2.08 0.30 0.00 -0.57 0.00 0.00 31.44 30.38 3cm6 n GLU 224 CO 0.00 0.00 0.00 0.11 -0.48 0.00 0.00 177.13 176.76 3cm6 h TRP 225 N 1.16 0.23 0.00 -0.32 5.08 -1.53 -3.14 115.95 117.44 3cm6 h TRP 225 Ca 0.53 -0.05 0.00 0.00 1.08 0.00 0.00 58.89 60.45 3cm6 h TRP 225 Cb 2.63 -0.06 0.00 0.00 -3.00 0.00 0.00 29.16 28.73 3cm6 h TRP 225 CO 1.41 0.49 0.00 0.54 -1.28 0.00 0.00 178.44 179.60 3cm6 n ARG 226 N -4.13 0.05 -0.16 0.12 1.74 -1.26 -0.86 116.66 112.15 3cm6 n ARG 226 Ca -0.01 0.51 0.09 0.00 -0.77 0.00 0.00 57.85 57.66 3cm6 n ARG 226 Cb 0.39 -1.64 0.17 0.00 -1.02 0.00 0.00 32.46 30.36 3cm6 n ARG 226 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3cm6 n SER 227 N -1.74 3.03 -4.00 0.55 3.41 -1.19 -0.76 113.62 112.93 3cm6 n SER 227 Ca 0.00 -1.89 -0.26 0.00 -0.26 0.00 0.00 58.87 56.47 3cm6 n SER 227 Cb 0.04 -0.22 -0.17 0.00 -0.26 0.00 0.00 64.21 63.60 3cm6 n SER 227 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 3cm6 s SER 228 N -1.17 1.98 0.12 4.04 0.15 -0.04 -4.99 113.70 113.78 3cm6 s SER 228 Ca 0.29 -0.32 -0.19 0.00 0.70 0.00 0.00 55.95 56.44 3cm6 s SER 228 Cb 0.17 -0.87 -0.06 0.00 -1.71 0.00 0.00 66.02 63.55 3cm6 s SER 228 CO 0.23 -0.01 1.72 0.15 1.20 0.00 0.00 173.24 176.53 3cm6 h PHE 229 N 7.36 0.35 0.14 3.44 3.04 -1.93 -1.71 116.94 127.64 3cm6 h PHE 229 Ca -0.31 -0.01 0.01 0.00 3.98 0.00 0.00 57.97 61.64 3cm6 h PHE 229 Cb 1.17 -0.11 -0.02 0.00 2.56 0.00 0.00 35.95 39.55 3cm6 h PHE 229 CO 0.48 0.30 -0.18 0.52 -2.02 0.00 0.00 178.31 177.41 3cm6 h MET 230 N 0.30 -0.36 -0.16 1.11 0.00 -1.96 -0.95 114.93 112.91 3cm6 h MET 230 Ca 0.09 0.02 -0.09 0.00 0.00 0.00 0.00 59.70 59.72 3cm6 h MET 230 Cb 0.06 0.08 -0.01 0.00 0.00 0.00 0.00 31.60 31.73 3cm6 h MET 230 CO -0.01 -0.24 -0.31 -0.44 0.00 0.00 0.00 176.91 175.90 3cm6 h ASP 231 N -0.37 0.31 -0.21 1.22 3.32 -1.85 -2.44 116.42 116.40 3cm6 h ASP 231 Ca 0.01 -0.11 -0.12 0.00 0.02 0.00 0.00 57.03 56.83 3cm6 h ASP 231 Cb 0.37 -0.08 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3cm6 h ASP 231 CO -0.07 0.62 -0.28 0.00 -1.72 0.00 0.00 179.24 177.78 3cm6 h ALA 232 N 1.41 0.88 -0.82 3.45 0.00 -1.17 -2.44 119.26 120.56 3cm6 h ALA 232 Ca 0.04 -0.39 0.17 0.00 0.00 0.00 0.00 54.91 54.73 3cm6 h ALA 232 Cb 0.69 -0.14 -0.15 0.00 0.00 0.00 0.00 17.79 18.19 3cm6 h ALA 232 CO 0.05 0.63 -0.16 0.78 0.00 0.00 0.00 179.25 180.55 3cm6 h GLY 233 N 0.98 0.67 0.99 0.00 0.00 -0.68 0.19 103.07 105.22 3cm6 h GLY 233 Ca 0.07 0.24 0.02 0.00 0.00 0.00 0.00 47.33 47.67 3cm6 h GLY 233 CO 0.06 -0.32 0.64 0.50 0.00 0.00 0.00 176.54 177.42 3cm6 h LYS 234 N 0.01 1.25 0.11 4.80 1.79 -1.27 0.43 116.57 123.70 3cm6 h LYS 234 Ca 0.41 -0.07 -0.27 0.00 -2.18 0.00 0.00 60.65 58.53 3cm6 h LYS 234 Cb 0.66 -0.28 0.01 0.00 -1.58 0.00 0.00 32.23 31.04 3cm6 h LYS 234 CO -0.83 0.82 -1.20 -0.84 -1.08 0.00 0.00 179.45 176.33 3cm6 h ILE 235 N 1.28 1.43 -0.51 1.86 3.07 -1.30 -2.85 117.51 120.49 3cm6 h ILE 235 Ca 0.37 -2.83 0.08 0.00 1.55 0.00 0.00 64.86 64.03 3cm6 h ILE 235 Cb -0.08 2.81 -0.06 0.00 -0.27 0.00 0.00 36.82 39.22 3cm6 h ILE 235 CO -0.10 0.83 0.17 -0.26 -1.05 0.00 0.00 178.15 177.74 3cm6 h PHE 236 N 0.14 0.29 -0.98 0.16 0.04 -0.52 -0.05 116.94 116.01 3cm6 h PHE 236 Ca -0.14 0.03 0.19 0.00 2.80 0.00 0.00 57.97 60.85 3cm6 h PHE 236 Cb 1.90 -0.05 -0.11 0.00 2.20 0.00 0.00 35.95 39.89 3cm6 h PHE 236 CO 0.08 0.07 0.57 0.93 -0.60 0.00 0.00 178.31 179.36 3cm6 h GLU 237 N 0.33 0.67 0.11 1.51 5.08 -0.86 -0.76 114.58 120.66 3cm6 h GLU 237 Ca 0.25 -0.04 -0.28 0.00 -1.00 0.00 0.00 59.36 58.29 3cm6 h GLU 237 Cb 0.29 -0.15 0.02 0.00 0.50 0.00 0.00 28.75 29.41 3cm6 h GLU 237 CO -0.27 0.45 -1.21 0.00 -1.00 0.00 0.00 179.01 176.98 3cm6 h ARG 238 N 0.69 0.51 -0.15 2.33 2.47 -1.10 -3.37 114.38 115.77 3cm6 h ARG 238 Ca 0.57 -0.70 -0.03 0.00 -1.26 0.00 0.00 59.98 58.57 3cm6 h ARG 238 Cb 0.93 0.23 -0.00 0.00 -1.65 0.00 0.00 29.97 29.47 3cm6 h ARG 238 CO -0.40 1.30 -0.03 0.28 0.56 0.00 0.00 179.97 181.68 3cm6 h VAL 239 N 0.22 1.28 -3.50 2.04 2.07 -0.47 -3.40 116.25 114.48 3cm6 h VAL 239 Ca -0.16 -0.95 -0.52 0.00 0.82 0.00 0.00 66.70 65.89 3cm6 h VAL 239 Cb 1.88 1.61 0.02 0.00 -1.52 0.00 0.00 31.29 33.28 3cm6 h VAL 239 CO 0.22 0.28 0.57 -0.76 0.02 0.00 0.00 177.57 177.90 3cm6 s LEU 240 N -9.42 4.45 0.22 2.57 1.43 -0.34 -4.95 118.68 112.64 3cm6 s LEU 240 Ca -0.14 2.28 -0.07 0.00 -1.03 0.00 0.00 54.13 55.17 3cm6 s LEU 240 Cb 0.05 -3.61 0.19 0.00 0.03 0.00 0.00 46.19 42.85 3cm6 s LEU 240 CO 0.72 -0.39 1.83 1.55 0.23 0.00 0.00 176.35 180.30 3cm6 h PRO 241 N 5.10 1.22 -6.01 1.29 0.13 -1.90 -3.43 132.00 128.40 3cm6 h PRO 241 Ca -0.45 -0.16 -0.61 0.00 -0.87 0.00 0.00 66.00 63.91 3cm6 h PRO 241 Cb 1.21 -0.23 -0.05 0.00 0.13 0.00 0.00 31.00 32.06 3cm6 h PRO 241 CO 0.74 0.92 -0.20 -0.51 -0.23 0.00 0.00 178.00 178.72 3cm6 s LEU 242 N -9.87 4.47 0.17 1.56 1.43 -1.26 -4.60 118.68 110.59 3cm6 s LEU 242 Ca -0.13 0.96 0.11 0.00 -1.03 0.00 0.00 54.13 54.04 3cm6 s LEU 242 Cb 0.16 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 3cm6 s LEU 242 CO 0.83 0.32 -0.23 0.54 0.23 0.00 0.00 176.35 178.03 3cm6 s VAL 243 N -1.03 2.20 -0.20 -1.59 0.11 0.19 -4.82 120.40 115.26 3cm6 s VAL 243 Ca 0.24 -1.94 -0.27 0.00 -2.93 0.00 0.00 61.98 57.08 3cm6 s VAL 243 Cb -0.17 -2.02 -0.00 0.00 -1.53 0.00 0.00 36.38 32.66 3cm6 s VAL 243 CO 0.13 -0.12 0.93 -0.69 -3.33 0.00 0.00 175.10 172.02 3cm6 s VAL 244 N -1.61 4.79 0.01 2.04 1.01 -1.26 -0.54 120.40 124.83 3cm6 s VAL 244 Ca 0.18 1.81 0.04 0.00 0.00 0.00 0.00 61.98 64.00 3cm6 s VAL 244 Cb -0.08 -4.22 -0.03 0.00 0.00 0.00 0.00 36.38 32.05 3cm6 s VAL 244 CO 0.08 -0.07 -0.08 0.28 0.00 0.00 0.00 175.10 175.31 3cm6 s THR 245 N 2.68 3.53 0.07 3.92 -1.32 0.14 -4.97 115.64 119.69 3cm6 s THR 245 Ca 0.41 -0.82 -0.11 0.00 -1.21 0.00 0.00 61.69 59.96 3cm6 s THR 245 Cb -0.16 -2.53 -0.06 0.00 -1.51 0.00 0.00 72.50 68.25 3cm6 s THR 245 CO 0.10 0.39 0.41 -0.89 -2.21 0.00 0.00 174.62 172.42 3cm6 s THR 246 N -0.98 5.07 -0.06 5.08 2.01 -1.26 -0.84 115.64 124.67 3cm6 s THR 246 Ca 0.17 0.54 0.02 0.00 0.31 0.00 0.00 61.69 62.73 3cm6 s THR 246 Cb -0.11 -3.66 0.01 0.00 0.01 0.00 0.00 72.50 68.75 3cm6 s THR 246 CO 0.07 0.34 -0.12 -0.51 -0.69 0.00 0.00 174.62 173.71 3cm6 s ILE 247 N -1.34 1.09 0.71 1.82 2.07 -0.87 -4.94 121.20 119.74 3cm6 s ILE 247 Ca 0.31 -0.47 -0.16 0.00 -1.41 0.00 0.00 60.65 58.93 3cm6 s ILE 247 Cb -0.14 -0.99 0.03 0.00 0.13 0.00 0.00 42.46 41.49 3cm6 s ILE 247 CO 0.17 0.34 1.24 -0.13 -1.91 0.00 0.00 174.94 174.65 3cm6 s ARG 248 N 0.56 2.20 0.16 3.50 0.52 -1.26 -4.60 118.95 120.02 3cm6 s ARG 248 Ca -0.12 1.86 -0.29 0.00 -0.52 0.00 0.00 55.73 56.66 3cm6 s ARG 248 Cb -0.14 -1.83 -0.03 0.00 0.52 0.00 0.00 34.95 33.47 3cm6 s ARG 248 CO 0.03 -1.82 1.55 0.00 0.02 0.00 0.00 175.30 175.08 3cm6 h ALA 249 N -0.10 -0.52 0.00 2.13 0.00 -1.96 -1.76 119.26 117.04 3cm6 h ALA 249 Ca -0.49 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.51 3cm6 h ALA 249 Cb 1.31 1.13 0.00 0.00 0.00 0.00 0.00 17.79 20.23 3cm6 h ALA 249 CO 0.50 -0.93 0.00 0.78 0.00 0.00 0.00 179.25 179.60 3cm6 h GLY 250 N -0.22 0.00 1.78 0.00 0.00 -1.97 -3.36 103.07 99.30 3cm6 h GLY 250 Ca 0.15 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.42 3cm6 h GLY 250 CO -0.74 0.00 -0.45 -0.55 0.00 0.00 0.00 176.54 174.80 3cm6 h ASP 251 N 0.00 0.00 -3.99 0.19 5.19 -1.68 -3.46 116.42 112.68 3cm6 h ASP 251 Ca 0.00 0.00 -0.53 0.00 -0.62 0.00 0.00 57.03 55.88 3cm6 h ASP 251 Cb 0.45 0.00 0.09 0.00 0.18 0.00 0.00 39.33 40.05 3cm6 h ASP 251 CO 0.00 0.24 0.57 0.12 -3.12 0.00 0.00 179.24 177.05 3cm6 s PHE 252 N -3.11 2.71 -0.03 4.55 5.36 -1.25 -5.03 117.98 121.18 3cm6 s PHE 252 Ca 0.04 1.44 0.01 0.00 -0.96 0.00 0.00 56.93 57.46 3cm6 s PHE 252 Cb 0.07 -3.60 0.02 0.00 -0.34 0.00 0.00 43.02 39.17 3cm6 s PHE 252 CO 0.73 -2.08 -0.02 1.03 -1.46 0.00 0.00 175.22 173.42 3cm6 s ARG 253 N -2.55 0.51 0.32 10.12 1.81 -1.26 -5.05 118.95 122.85 3cm6 s ARG 253 Ca 0.62 -0.01 0.17 0.00 -1.72 0.00 0.00 55.73 54.80 3cm6 s ARG 253 Cb -0.35 -0.61 1.16 0.00 -0.45 0.00 0.00 34.95 34.70 3cm6 s ARG 253 CO 0.44 -0.10 1.41 1.28 -0.68 0.00 0.00 175.30 177.65 3cm6 n LEU 254 N 4.03 0.27 -0.43 2.53 4.32 -1.26 -0.50 117.00 125.97 3cm6 n LEU 254 Ca -0.26 1.48 0.01 0.00 -0.02 0.00 0.00 56.01 57.23 3cm6 n LEU 254 Cb 0.51 -0.71 0.05 0.00 -1.62 0.00 0.00 43.42 41.65 3cm6 n LEU 254 CO 0.23 -1.65 0.44 -1.84 -1.22 0.00 0.00 177.39 173.36 3cm6 n GLU 255 N -5.04 1.39 0.16 3.23 0.00 -1.26 -2.92 120.64 116.19 3cm6 n GLU 255 Ca 0.33 -0.41 0.13 0.00 0.00 0.00 0.00 57.16 57.21 3cm6 n GLU 255 Cb 1.11 -1.33 0.33 0.00 0.00 0.00 0.00 31.44 31.55 3cm6 n GLU 255 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 3cm6 h MET 256 N 0.58 0.00 -6.62 3.44 2.86 -1.17 -3.45 114.93 110.57 3cm6 h MET 256 Ca 0.00 0.00 -0.53 0.00 -2.06 0.00 0.00 59.70 57.11 3cm6 h MET 256 Cb 0.41 0.00 0.04 0.00 0.06 0.00 0.00 31.60 32.11 3cm6 h MET 256 CO 0.03 0.00 0.85 -0.47 1.06 0.00 0.00 176.91 178.38 3cm6 s TYR 257 N -3.18 3.08 -0.66 -0.22 5.04 -1.15 0.29 117.35 120.55 3cm6 s TYR 257 Ca 0.08 0.72 -0.05 0.00 -2.44 0.00 0.00 57.07 55.38 3cm6 s TYR 257 Cb 0.09 -3.89 0.17 0.00 0.35 0.00 0.00 41.96 38.69 3cm6 s TYR 257 CO 0.61 -3.21 0.50 0.20 -1.34 0.00 0.00 175.55 172.32 3cm6 s GLY 258 N 1.04 2.53 -0.09 8.97 0.00 -1.26 -5.08 107.32 113.43 3cm6 s GLY 258 Ca 0.68 -3.26 0.00 0.00 0.00 0.00 0.00 44.72 42.14 3cm6 s GLY 258 CO 0.33 1.13 -0.08 -1.34 0.00 0.00 0.00 173.10 173.14 3cm6 s VAL 259 N -0.01 3.60 0.12 1.40 -7.23 0.15 -2.52 120.40 115.91 3cm6 s VAL 259 Ca 0.17 -0.50 -0.31 0.00 -1.81 0.00 0.00 61.98 59.53 3cm6 s VAL 259 Cb -0.18 -2.49 -0.07 0.00 0.56 0.00 0.00 36.38 34.20 3cm6 s VAL 259 CO -0.04 0.57 1.29 0.00 -0.31 0.00 0.00 175.10 176.60 3cm6 h ARG 261 N 6.31 0.62 0.68 0.00 2.47 -1.91 -0.60 114.38 121.95 3cm6 h ARG 261 Ca -0.43 -0.04 -0.03 0.00 -1.26 0.00 0.00 59.98 58.22 3cm6 h ARG 261 Cb 1.21 -0.14 0.01 0.00 -1.65 0.00 0.00 29.97 29.40 3cm6 h ARG 261 CO 0.81 0.41 -0.33 -0.92 0.56 0.00 0.00 179.97 180.51 3cm6 h TYR 262 N 0.64 -0.85 -0.01 3.04 3.20 -1.92 -3.37 116.97 117.71 3cm6 h TYR 262 Ca 0.25 -0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.10 3cm6 h TYR 262 Cb 0.10 0.28 0.00 0.00 1.54 0.00 0.00 36.73 38.65 3cm6 h TYR 262 CO -0.08 -0.53 -0.72 0.00 -1.64 0.00 0.00 178.16 175.20 3cm6 n ARG 264 N -1.00 -0.83 -2.55 0.00 5.12 -0.23 -5.00 116.66 112.17 3cm6 n ARG 264 Ca 0.06 0.21 -0.24 0.00 -1.93 0.00 0.00 57.85 55.95 3cm6 n ARG 264 Cb 0.37 -3.95 0.04 0.00 -1.16 0.00 0.00 32.46 27.76 3cm6 n ARG 264 CO 0.00 0.00 0.00 0.15 -1.93 0.00 0.00 177.63 175.85 3cm6 s LYS 265 N -0.95 2.68 0.63 5.56 1.02 -1.26 -4.71 119.74 122.72 3cm6 s LYS 265 Ca 0.00 -0.39 -0.17 0.00 0.02 0.00 0.00 55.97 55.43 3cm6 s LYS 265 Cb 0.00 -2.37 -0.01 0.00 -0.52 0.00 0.00 37.83 34.93 3cm6 s LYS 265 CO 0.00 -0.73 1.18 0.20 -0.92 0.00 0.00 175.35 175.08 3cm6 s GLY 266 N -4.37 2.53 -0.11 -3.33 0.00 -1.26 -1.30 107.32 99.48 3cm6 s GLY 266 Ca 0.55 0.88 0.09 0.00 0.00 0.00 0.00 44.72 46.24 3cm6 s GLY 266 CO 0.42 1.27 1.22 1.03 0.00 0.00 0.00 173.10 177.03 3cm6 n MET 267 N -1.99 3.03 -0.09 2.90 2.81 -1.05 -2.31 117.12 120.42 3cm6 n MET 267 Ca 0.13 -1.74 -0.18 0.00 -1.81 0.00 0.00 57.70 54.10 3cm6 n MET 267 Cb 0.50 -1.85 -0.13 0.00 -0.71 0.00 0.00 33.22 31.04 3cm6 n MET 267 CO 0.00 0.00 0.00 -0.40 1.51 0.00 0.00 175.97 177.08 3cm6 n ASP 268 N 0.41 1.83 0.00 7.83 3.85 -1.26 -4.76 116.55 124.46 3cm6 n ASP 268 Ca 0.15 -0.03 0.00 0.00 -0.71 0.00 0.00 54.79 54.20 3cm6 n ASP 268 Cb 0.72 -0.40 0.00 0.00 -1.35 0.00 0.00 41.12 40.10 3cm6 n ASP 268 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.20 176.71 3cm6 n VAL 269 N -3.27 0.00 -1.63 2.12 0.31 -1.06 -4.49 118.33 110.32 3cm6 n VAL 269 Ca -0.41 0.65 -0.48 0.00 -0.01 0.00 0.00 64.34 64.09 3cm6 n VAL 269 Cb 1.02 -1.46 -0.05 0.00 -0.91 0.00 0.00 33.84 32.44 3cm6 n VAL 269 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 3cm6 n GLY 271 N 2.67 2.26 0.34 0.00 0.00 -1.26 -4.44 105.19 104.76 3cm6 n GLY 271 Ca 0.16 -0.61 -0.17 0.00 0.00 0.00 0.00 46.02 45.41 3cm6 n GLY 271 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3cm6 h THR 272 N 0.00 0.34 -2.13 2.61 1.35 -1.76 -3.45 112.91 109.87 3cm6 h THR 272 Ca 0.00 -0.17 -0.45 0.00 -0.55 0.00 0.00 66.41 65.23 3cm6 h THR 272 Cb 0.00 0.40 -0.00 0.00 -1.73 0.00 0.00 68.15 66.82 3cm6 h THR 272 CO 0.00 0.02 -0.37 -0.44 -0.25 0.00 0.00 175.52 174.48 3cm6 s SER 273 N -4.53 6.18 -0.36 5.36 0.01 -1.26 -5.07 113.70 114.03 3cm6 s SER 273 Ca -0.16 0.02 -0.28 0.00 1.31 0.00 0.00 55.95 56.85 3cm6 s SER 273 Cb 0.03 -1.65 0.02 0.00 0.21 0.00 0.00 66.02 64.62 3cm6 s SER 273 CO 0.57 -0.23 1.02 -2.28 0.41 0.00 0.00 173.24 172.72 3cm6 s HIS 274 N -2.09 3.07 -1.58 2.43 2.46 -1.26 -4.94 115.29 113.38 3cm6 s HIS 274 Ca 0.39 0.95 0.27 0.00 0.47 0.00 0.00 55.06 57.14 3cm6 s HIS 274 Cb -0.09 -3.77 1.45 0.00 -0.13 0.00 0.00 32.58 30.04 3cm6 s HIS 274 CO 0.31 -0.86 1.95 1.04 -2.47 0.00 0.00 174.74 174.71 3cm6 n GLN 275 N 6.95 0.51 -2.75 2.88 1.13 -1.26 -3.82 117.38 121.03 3cm6 n GLN 275 Ca 0.10 0.02 -0.04 0.00 -1.94 0.00 0.00 57.00 55.14 3cm6 n GLN 275 Cb 0.48 -1.50 0.05 0.00 0.11 0.00 0.00 30.24 29.38 3cm6 n GLN 275 CO 0.00 0.00 0.00 1.04 -1.44 0.00 0.00 177.06 176.66 3cm6 n GLN 276 N -1.21 1.45 -1.61 -1.09 6.02 -1.26 -5.06 117.38 114.61 3cm6 n GLN 276 Ca 0.15 -3.12 -0.55 0.00 -0.01 0.00 0.00 57.00 53.47 3cm6 n GLN 276 Cb 0.19 -1.21 -0.07 0.00 1.02 0.00 0.00 30.24 30.17 3cm6 n GLN 276 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 3cm6 n THR 277 N -0.48 0.29 -1.43 5.09 -1.04 -1.25 -4.78 114.28 110.68 3cm6 n THR 277 Ca 0.05 -0.11 -0.40 0.00 -2.04 0.00 0.00 64.05 61.55 3cm6 n THR 277 Cb 0.82 -1.37 -0.02 0.00 -1.82 0.00 0.00 70.33 67.94 3cm6 n THR 277 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3cm6 n PRO 278 N 6.40 2.51 -0.31 -2.82 -0.04 -1.26 -4.72 135.00 134.76 3cm6 n PRO 278 Ca 0.32 -2.24 0.22 0.00 -0.04 0.00 0.00 63.50 61.76 3cm6 n PRO 278 Cb 0.16 -3.05 0.51 0.00 -0.04 0.00 0.00 33.50 31.08 3cm6 n PRO 278 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3cm6 h HIS 279 N 6.44 0.62 0.00 0.54 3.86 -1.98 -0.25 115.15 124.38 3cm6 h HIS 279 Ca 0.56 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.79 3cm6 h HIS 279 Cb 0.56 -0.18 0.00 0.00 1.06 0.00 0.00 27.41 28.85 3cm6 h HIS 279 CO 1.49 0.08 0.00 0.38 0.86 0.00 0.00 177.93 180.74 3cm6 h ASP 280 N 0.39 0.00 0.70 2.45 3.04 -2.00 -2.12 116.42 118.88 3cm6 h ASP 280 Ca 0.57 0.00 -0.00 0.00 -3.24 0.00 0.00 57.03 54.36 3cm6 h ASP 280 Cb 1.46 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.75 3cm6 h ASP 280 CO -0.26 0.00 -1.30 0.18 -2.04 0.00 0.00 179.24 175.81 3cm6 n LEU 281 N -2.96 0.60 -1.92 0.15 4.77 -0.11 -4.33 117.00 113.20 3cm6 n LEU 281 Ca -0.02 0.23 -0.05 0.00 -0.03 0.00 0.00 56.01 56.14 3cm6 n LEU 281 Cb 0.13 -0.04 0.29 0.00 -2.33 0.00 0.00 43.42 41.46 3cm6 n LEU 281 CO 0.21 -0.13 0.99 -1.22 -1.33 0.00 0.00 177.39 175.90 3cm6 n TYR 282 N -2.55 2.28 -0.03 -1.77 4.01 -0.80 -4.40 117.16 113.90 3cm6 n TYR 282 Ca -0.01 -1.10 0.02 0.00 -0.16 0.00 0.00 57.90 56.64 3cm6 n TYR 282 Cb 0.56 -0.65 -0.10 0.00 -0.31 0.00 0.00 39.34 38.84 3cm6 n TYR 282 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 3cm6 n LYS 283 N -0.08 1.00 -3.21 -0.72 5.02 -1.25 -4.78 118.16 114.15 3cm6 n LYS 283 Ca 0.37 -0.08 -0.45 0.00 -2.02 0.00 0.00 58.31 56.14 3cm6 n LYS 283 Cb 1.31 -1.32 0.00 0.00 -0.02 0.00 0.00 35.03 35.00 3cm6 n LYS 283 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3cm6 n ASN 284 N -2.16 5.44 -0.45 4.39 5.15 -1.26 -4.88 115.26 121.49 3cm6 n ASN 284 Ca -0.09 -3.03 0.00 0.00 -0.60 0.00 0.00 54.58 50.86 3cm6 n ASN 284 Cb 0.57 -1.44 0.00 0.00 -0.53 0.00 0.00 39.78 38.38 3cm6 n ASN 284 CO 0.00 0.00 0.00 -1.84 1.40 0.00 0.00 177.26 176.82 3cm6 n GLU 285 N 3.58 0.56 -0.00 1.20 0.28 -1.26 -0.16 120.64 124.84 3cm6 n GLU 285 Ca 0.28 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 57.34 3cm6 n GLU 285 Cb 0.40 -1.25 -0.07 0.00 1.43 0.00 0.00 31.44 31.95 3cm6 n GLU 285 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 3cm6 n GLU 286 N 0.14 2.70 -3.14 3.44 4.07 -1.26 -4.64 120.64 121.95 3cm6 n GLU 286 Ca 0.00 -0.00 -0.20 0.00 -0.06 0.00 0.00 57.16 56.90 3cm6 n GLU 286 Cb 0.12 -1.11 -0.03 0.00 -0.06 0.00 0.00 31.44 30.36 3cm6 n GLU 286 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 3cm6 n ASP 287 N -1.33 1.54 -4.84 4.31 4.64 0.77 -5.14 116.55 116.50 3cm6 n ASP 287 Ca 0.02 -3.14 -0.30 0.00 -1.38 0.00 0.00 54.79 49.99 3cm6 n ASP 287 Cb 0.20 -0.61 0.06 0.00 -1.04 0.00 0.00 41.12 39.73 3cm6 n ASP 287 CO 0.00 0.00 0.00 -2.16 -0.82 0.00 0.00 177.20 174.22 3cm6 s PRO 288 N -2.59 2.67 -0.48 -0.67 0.05 -1.21 -4.88 135.00 127.88 3cm6 s PRO 288 Ca 0.42 0.63 -0.18 0.00 0.05 0.00 0.00 61.00 61.92 3cm6 s PRO 288 Cb 0.33 -1.98 0.06 0.00 0.05 0.00 0.00 34.50 32.95 3cm6 s PRO 288 CO -0.09 -1.21 0.52 0.42 0.05 0.00 0.00 177.00 176.69 3cm6 s ILE 289 N -3.22 5.02 0.14 0.56 -1.09 -1.26 -4.96 121.20 116.39 3cm6 s ILE 289 Ca 0.59 -0.63 -0.17 0.00 -2.23 0.00 0.00 60.65 58.21 3cm6 s ILE 289 Cb -0.13 -4.20 -0.01 0.00 -1.58 0.00 0.00 42.46 36.54 3cm6 s ILE 289 CO 0.53 -0.67 1.78 -0.74 -1.23 0.00 0.00 174.94 174.61 3cm6 h HIS 290 N 8.87 0.31 -0.50 3.97 -0.00 -1.94 -1.57 115.15 124.29 3cm6 h HIS 290 Ca -0.28 0.01 -0.04 0.00 -0.00 0.00 0.00 60.37 60.07 3cm6 h HIS 290 Cb 1.10 -0.09 -0.02 0.00 -0.00 0.00 0.00 27.41 28.39 3cm6 h HIS 290 CO 0.69 0.18 0.16 0.27 -0.00 0.00 0.00 177.93 179.23 3cm6 h PHE 291 N 0.34 0.75 -0.39 5.26 -0.00 -1.89 -1.10 116.94 119.92 3cm6 h PHE 291 Ca 0.13 -0.05 -0.08 0.00 -0.00 0.00 0.00 57.97 57.97 3cm6 h PHE 291 Cb 0.02 -0.23 -0.01 0.00 -0.00 0.00 0.00 35.95 35.73 3cm6 h PHE 291 CO -0.09 0.61 -0.07 0.00 -0.00 0.00 0.00 178.31 178.76 3cm6 h ALA 292 N 1.45 0.53 0.30 12.09 0.00 -1.92 -3.07 119.26 128.65 3cm6 h ALA 292 Ca 0.17 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3cm6 h ALA 292 Cb 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3cm6 h ALA 292 CO -0.01 0.38 -0.15 0.87 0.00 0.00 0.00 179.25 180.34 3cm6 h LYS 293 N 0.55 -0.39 0.00 0.00 1.57 -0.42 -1.28 116.57 116.59 3cm6 h LYS 293 Ca 0.10 0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.90 3cm6 h LYS 293 Cb 0.58 0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.98 3cm6 h LYS 293 CO 0.03 -0.20 -0.03 -0.84 -0.57 0.00 0.00 179.45 177.84 3cm6 h ILE 294 N -0.49 0.63 0.00 1.86 3.07 -1.32 -1.72 117.51 119.53 3cm6 h ILE 294 Ca -0.04 -0.13 0.00 0.00 1.55 0.00 0.00 64.86 66.24 3cm6 h ILE 294 Cb 0.37 1.08 0.00 0.00 -0.27 0.00 0.00 36.82 38.00 3cm6 h ILE 294 CO 0.07 0.03 -0.36 0.00 -1.05 0.00 0.00 178.15 176.84 3cm6 n ALA 295 N -2.35 2.99 -1.63 0.16 0.00 -1.16 -4.94 120.51 113.57 3cm6 n ALA 295 Ca -0.03 -0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.18 3cm6 n ALA 295 Cb 0.12 -1.25 0.00 0.00 0.00 0.00 0.00 19.45 18.32 3cm6 n ALA 295 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3cm6 n GLY 296 N 1.45 0.44 0.15 0.00 0.00 -0.65 -4.79 105.19 101.79 3cm6 n GLY 296 Ca 0.05 -0.90 0.01 0.00 0.00 0.00 0.00 46.02 45.18 3cm6 n GLY 296 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 3cm6 h TYR 297 N 0.00 0.00 0.00 1.61 -1.99 -1.47 -3.50 116.97 111.62 3cm6 h TYR 297 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 3cm6 h TYR 297 Cb 0.68 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.41 3cm6 h TYR 297 CO 0.00 0.53 0.00 2.48 -0.00 0.00 0.00 178.16 181.17