#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vrs s GLN 10 N 0.00 4.00 -0.14 -1.46 -0.21 -1.26 -5.08 119.66 115.50 1vrs s GLN 10 Ca 0.00 -0.31 -0.06 0.00 0.02 0.00 0.00 55.36 55.01 1vrs s GLN 10 Cb 0.00 -3.47 -0.04 0.00 1.00 0.00 0.00 33.01 30.50 1vrs s GLN 10 CO 0.00 0.04 0.07 -0.06 -2.12 0.00 0.00 175.29 173.22 1vrs s PHE 11 N 1.07 3.32 0.72 0.91 0.08 -1.26 -5.10 117.98 117.72 1vrs s PHE 11 Ca 0.07 0.22 -0.11 0.00 0.12 0.00 0.00 56.93 57.22 1vrs s PHE 11 Cb -0.14 -1.98 0.02 0.00 -0.57 0.00 0.00 43.02 40.36 1vrs s PHE 11 CO 0.04 0.38 1.10 0.14 -0.10 0.00 0.00 175.22 176.78 1vrs s VAL 12 N -0.28 3.40 0.74 -0.44 -7.23 -1.26 -5.02 120.40 110.30 1vrs s VAL 12 Ca 0.08 0.45 -0.14 0.00 -1.81 0.00 0.00 61.98 60.56 1vrs s VAL 12 Cb -0.12 -3.42 0.04 0.00 0.56 0.00 0.00 36.38 33.44 1vrs s VAL 12 CO 0.01 -0.59 1.18 -2.84 -0.31 0.00 0.00 175.10 172.55 1vrs s PRO 13 N -5.35 2.15 0.22 4.82 0.02 -1.26 -4.74 135.00 130.87 1vrs s PRO 13 Ca 0.59 1.67 -0.09 0.00 0.02 0.00 0.00 61.00 63.18 1vrs s PRO 13 Cb -0.11 -1.84 0.35 0.00 0.02 0.00 0.00 34.50 32.91 1vrs s PRO 13 CO 0.52 -1.80 1.66 0.00 -0.33 0.00 0.00 177.00 177.05 1vrs h ALA 14 N -0.40 0.70 0.00 -1.55 0.00 -1.96 0.21 119.26 116.27 1vrs h ALA 14 Ca -0.47 0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1vrs h ALA 14 Cb 1.28 0.32 0.00 0.00 0.00 0.00 0.00 17.79 19.39 1vrs h ALA 14 CO 0.50 -0.38 0.00 -0.25 0.00 0.00 0.00 179.25 179.11 1vrs n ASP 15 N -5.26 0.17 -0.01 0.00 8.00 -1.26 -0.92 116.55 117.26 1vrs n ASP 15 Ca 0.11 0.55 -0.03 0.00 0.71 0.00 0.00 54.79 56.13 1vrs n ASP 15 Cb 0.39 -0.58 -0.12 0.00 -0.02 0.00 0.00 41.12 40.79 1vrs n ASP 15 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vrs n GLN 16 N -1.69 0.64 0.12 -1.24 6.02 0.67 -3.72 117.38 118.18 1vrs n GLN 16 Ca 0.03 0.15 -0.23 0.00 -0.01 0.00 0.00 57.00 56.93 1vrs n GLN 16 Cb 0.16 -1.72 -0.15 0.00 1.02 0.00 0.00 30.24 29.55 1vrs n GLN 16 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1vrs h ALA 17 N 1.31 -0.02 -2.99 -1.58 0.00 -0.40 -3.41 119.26 112.17 1vrs h ALA 17 Ca -0.25 -0.96 -0.61 0.00 0.00 0.00 0.00 54.91 53.09 1vrs h ALA 17 Cb 1.75 0.25 -0.40 0.00 0.00 0.00 0.00 17.79 19.39 1vrs h ALA 17 CO 0.04 0.84 -0.75 -0.06 0.00 0.00 0.00 179.25 179.33 1vrs s PHE 18 N -2.60 1.88 -0.55 0.00 0.08 -0.10 0.04 117.98 116.73 1vrs s PHE 18 Ca -0.10 -2.31 -0.28 0.00 0.12 0.00 0.00 56.93 54.36 1vrs s PHE 18 Cb 0.05 -1.82 0.01 0.00 -0.57 0.00 0.00 43.02 40.69 1vrs s PHE 18 CO 0.91 -0.80 1.44 0.00 -0.10 0.00 0.00 175.22 176.68 1vrs s ALA 19 N 0.54 2.79 0.37 5.36 0.00 0.29 -4.51 121.76 126.60 1vrs s ALA 19 Ca 0.17 -0.64 -0.08 0.00 0.00 0.00 0.00 51.96 51.41 1vrs s ALA 19 Cb -0.24 -4.11 -0.06 0.00 0.00 0.00 0.00 23.12 18.72 1vrs s ALA 19 CO -0.02 -2.95 0.69 0.12 0.00 0.00 0.00 175.76 173.59 1vrs s PHE 20 N 6.19 3.48 -0.08 0.00 5.36 -1.26 0.02 117.98 131.69 1vrs s PHE 20 Ca 0.54 0.87 -0.32 0.00 -0.96 0.00 0.00 56.93 57.06 1vrs s PHE 20 Cb -0.11 -2.30 0.12 0.00 -0.34 0.00 0.00 43.02 40.39 1vrs s PHE 20 CO 0.25 -0.01 1.17 0.34 -1.46 0.00 0.00 175.22 175.51 1vrs s ASP 21 N -3.24 -0.15 0.22 6.13 2.15 0.20 -4.98 116.67 117.01 1vrs s ASP 21 Ca 0.48 -0.08 -0.07 0.00 0.43 0.00 0.00 52.55 53.31 1vrs s ASP 21 Cb -0.10 0.21 -0.02 0.00 -0.30 0.00 0.00 42.92 42.71 1vrs s ASP 21 CO 0.32 -0.36 0.31 0.72 -0.17 0.00 0.00 175.17 175.99 1vrs s PHE 22 N -2.59 0.71 -0.17 -5.34 -0.71 -1.26 0.08 117.98 108.70 1vrs s PHE 22 Ca 0.10 -1.02 -0.09 0.00 -1.04 0.00 0.00 56.93 54.89 1vrs s PHE 22 Cb 0.01 -0.16 0.06 0.00 -1.21 0.00 0.00 43.02 41.72 1vrs s PHE 22 CO -0.04 -0.82 0.41 -0.65 -1.34 0.00 0.00 175.22 172.78 1vrs s GLN 23 N -4.08 0.38 0.10 1.99 -1.52 -0.87 -4.97 119.66 110.70 1vrs s GLN 23 Ca 0.29 0.82 0.09 0.00 -1.95 0.00 0.00 55.36 54.62 1vrs s GLN 23 Cb 0.03 0.02 -0.04 0.00 -0.22 0.00 0.00 33.01 32.81 1vrs s GLN 23 CO 0.10 -0.17 -0.22 -1.14 -0.25 0.00 0.00 175.29 173.61 1vrs s GLN 24 N 1.58 1.69 -0.42 2.91 0.74 -1.26 -0.41 119.66 124.50 1vrs s GLN 24 Ca -0.08 -1.20 0.06 0.00 0.05 0.00 0.00 55.36 54.19 1vrs s GLN 24 Cb -0.09 -2.04 0.17 0.00 1.10 0.00 0.00 33.01 32.16 1vrs s GLN 24 CO -0.13 0.48 0.57 1.21 -0.55 0.00 0.00 175.29 176.87 1vrs s ASN 25 N -1.93 -0.68 1.95 6.67 3.04 0.17 -4.99 114.94 119.16 1vrs s ASN 25 Ca 0.16 -1.23 0.00 0.00 0.04 0.00 0.00 52.86 51.82 1vrs s ASN 25 Cb -0.10 1.49 0.00 0.00 -1.54 0.00 0.00 41.25 41.09 1vrs s ASN 25 CO 0.07 -0.18 0.00 0.00 -3.04 0.00 0.00 177.10 173.96 1vrs n GLN 26 N 4.09 0.00 0.00 0.43 1.13 -1.26 -1.12 117.38 120.65 1vrs n GLN 26 Ca 0.13 0.00 0.11 0.00 -1.94 0.00 0.00 57.00 55.30 1vrs n GLN 26 Cb 0.53 0.00 0.62 0.00 0.11 0.00 0.00 30.24 31.50 1vrs n GLN 26 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1vrs n HIS 27 N 13.89 0.00 -3.56 1.08 8.25 -1.26 -4.70 115.22 128.92 1vrs n HIS 27 Ca 0.00 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 57.06 1vrs n HIS 27 Cb 0.00 -0.11 -0.11 0.00 1.12 0.00 0.00 29.99 30.89 1vrs n HIS 27 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1vrs s ASP 28 N -2.22 5.97 -0.06 0.41 1.01 -0.28 0.10 116.67 121.61 1vrs s ASP 28 Ca 0.29 -0.39 0.05 0.00 0.71 0.00 0.00 52.55 53.21 1vrs s ASP 28 Cb 0.15 -2.11 -0.00 0.00 1.01 0.00 0.00 42.92 41.96 1vrs s ASP 28 CO 0.29 -0.20 -0.20 -0.22 0.21 0.00 0.00 175.17 175.04 1vrs s LEU 29 N 1.71 1.97 -0.22 1.23 1.98 0.29 0.42 118.68 126.06 1vrs s LEU 29 Ca 0.06 -0.44 0.01 0.00 -2.89 0.00 0.00 54.13 50.88 1vrs s LEU 29 Cb -0.17 -1.16 0.05 0.00 0.66 0.00 0.00 46.19 45.56 1vrs s LEU 29 CO 0.10 0.17 -0.11 0.20 -1.89 0.00 0.00 176.35 174.81 1vrs s ASN 30 N 0.10 3.70 -0.02 3.68 0.02 0.46 0.10 114.94 122.98 1vrs s ASN 30 Ca -0.08 -1.02 -0.20 0.00 -1.02 0.00 0.00 52.86 50.54 1vrs s ASN 30 Cb -0.14 -1.35 -0.05 0.00 0.02 0.00 0.00 41.25 39.73 1vrs s ASN 30 CO 0.04 -0.15 0.58 -0.76 0.02 0.00 0.00 177.10 176.83 1vrs s LEU 31 N 1.30 4.40 -0.01 0.60 1.43 0.92 -2.05 118.68 125.27 1vrs s LEU 31 Ca -0.03 1.11 -0.02 0.00 -1.03 0.00 0.00 54.13 54.16 1vrs s LEU 31 Cb -0.17 -2.89 0.00 0.00 0.03 0.00 0.00 46.19 43.16 1vrs s LEU 31 CO -0.08 0.09 0.05 0.28 0.23 0.00 0.00 176.35 176.92 1vrs s THR 32 N -0.09 0.03 -0.10 5.49 -1.32 0.11 0.41 115.64 120.17 1vrs s THR 32 Ca 0.30 -0.22 0.01 0.00 -1.21 0.00 0.00 61.69 60.58 1vrs s THR 32 Cb -0.18 -0.15 0.02 0.00 -1.51 0.00 0.00 72.50 70.68 1vrs s THR 32 CO 0.16 -0.12 -0.12 0.26 -2.21 0.00 0.00 174.62 172.59 1vrs s TRP 33 N -0.35 1.73 -0.45 9.09 0.51 -0.37 -0.63 118.94 128.47 1vrs s TRP 33 Ca -0.04 -0.81 -0.17 0.00 -2.12 0.00 0.00 56.10 52.96 1vrs s TRP 33 Cb -0.03 -1.30 0.04 0.00 -0.81 0.00 0.00 33.47 31.37 1vrs s TRP 33 CO 0.00 -0.45 0.46 -1.14 -0.51 0.00 0.00 176.95 175.31 1vrs s GLN 34 N 1.14 3.07 -0.41 4.98 2.00 0.10 -1.73 119.66 128.81 1vrs s GLN 34 Ca -0.04 -0.93 -0.18 0.00 -2.00 0.00 0.00 55.36 52.21 1vrs s GLN 34 Cb -0.14 -4.03 0.02 0.00 0.80 0.00 0.00 33.01 29.65 1vrs s GLN 34 CO -0.03 -0.96 0.50 0.42 -0.50 0.00 0.00 175.29 174.71 1vrs s ILE 35 N 2.12 5.01 0.30 -2.34 1.01 0.14 -0.55 121.20 126.89 1vrs s ILE 35 Ca 0.11 -0.11 -0.29 0.00 0.00 0.00 0.00 60.65 60.35 1vrs s ILE 35 Cb -0.19 -4.06 -0.13 0.00 0.01 0.00 0.00 42.46 38.09 1vrs s ILE 35 CO 0.12 -0.42 1.33 1.17 0.00 0.00 0.00 174.94 177.13 1vrs n LYS 36 N 5.78 2.07 -1.69 2.79 4.81 0.11 -3.49 118.16 128.54 1vrs n LYS 36 Ca -0.06 0.73 -0.44 0.00 -0.87 0.00 0.00 58.31 57.67 1vrs n LYS 36 Cb 0.48 -2.34 -0.04 0.00 0.02 0.00 0.00 35.03 33.16 1vrs n LYS 36 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1vrs n ASP 37 N 1.39 3.54 0.00 3.14 2.03 -1.26 -1.09 116.55 124.30 1vrs n ASP 37 Ca 0.08 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.45 1vrs n ASP 37 Cb 0.34 -1.49 0.00 0.00 -0.72 0.00 0.00 41.12 39.25 1vrs n ASP 37 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1vrs n GLY 38 N 3.73 0.45 3.44 0.27 0.00 -1.26 -5.07 105.19 106.75 1vrs n GLY 38 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1vrs n GLY 38 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vrs s TYR 39 N -2.00 1.98 0.09 1.61 1.51 -0.25 -0.61 117.35 119.68 1vrs s TYR 39 Ca 0.00 -0.71 -0.26 0.00 -1.01 0.00 0.00 57.07 55.09 1vrs s TYR 39 Cb 0.00 -1.14 0.07 0.00 -0.11 0.00 0.00 41.96 40.78 1vrs s TYR 39 CO 0.00 0.28 0.63 1.52 -1.11 0.00 0.00 175.55 176.86 1vrs s TYR 40 N -3.01 -0.58 0.04 2.71 -0.85 -0.49 -4.61 117.35 110.56 1vrs s TYR 40 Ca 0.30 0.61 0.02 0.00 -0.52 0.00 0.00 57.07 57.48 1vrs s TYR 40 Cb 0.04 0.51 -0.04 0.00 0.38 0.00 0.00 41.96 42.85 1vrs s TYR 40 CO 0.12 -0.77 0.03 -0.51 -1.52 0.00 0.00 175.55 172.91 1vrs s LEU 41 N -2.21 3.62 -0.30 -3.49 1.43 -0.72 -1.40 118.68 115.61 1vrs s LEU 41 Ca -0.03 -0.02 -0.23 0.00 -1.03 0.00 0.00 54.13 52.81 1vrs s LEU 41 Cb -0.01 -2.20 -0.00 0.00 0.03 0.00 0.00 46.19 44.02 1vrs s LEU 41 CO -0.05 0.23 0.78 -0.31 0.23 0.00 0.00 176.35 177.23 1vrs s TYR 42 N -1.22 3.21 0.24 0.29 2.02 -0.45 -0.99 117.35 120.46 1vrs s TYR 42 Ca 0.24 0.83 -0.04 0.00 -0.37 0.00 0.00 57.07 57.72 1vrs s TYR 42 Cb -0.12 -3.19 0.41 0.00 -0.40 0.00 0.00 41.96 38.67 1vrs s TYR 42 CO 0.15 -0.54 1.80 -0.09 -1.57 0.00 0.00 175.55 175.30 1vrs h ARG 43 N 8.08 0.71 0.00 -0.62 2.43 -1.64 -1.35 114.38 121.99 1vrs h ARG 43 Ca -0.24 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1vrs h ARG 43 Cb 1.10 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 1vrs h ARG 43 CO 0.88 0.47 0.00 1.17 -1.51 0.00 0.00 179.97 180.98 1vrs n LYS 44 N -4.78 0.39 0.00 0.20 4.81 -1.26 -2.60 118.16 114.92 1vrs n LYS 44 Ca 0.14 0.05 0.09 0.00 -0.87 0.00 0.00 58.31 57.72 1vrs n LYS 44 Cb 0.30 -1.50 -0.02 0.00 0.02 0.00 0.00 35.03 33.84 1vrs n LYS 44 CO 0.00 0.00 0.00 1.04 1.17 0.00 0.00 177.40 179.61 1vrs n GLN 45 N -1.09 1.44 -2.47 1.64 1.13 -0.51 -4.97 117.38 112.55 1vrs n GLN 45 Ca 0.10 -0.76 -0.41 0.00 -1.94 0.00 0.00 57.00 53.99 1vrs n GLN 45 Cb 0.07 -1.35 -0.04 0.00 0.11 0.00 0.00 30.24 29.03 1vrs n GLN 45 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1vrs s ILE 46 N -2.21 3.78 -0.09 5.09 1.01 -1.07 -4.08 121.20 123.63 1vrs s ILE 46 Ca 0.14 1.52 -0.04 0.00 0.00 0.00 0.00 60.65 62.28 1vrs s ILE 46 Cb 0.15 -3.97 0.05 0.00 0.01 0.00 0.00 42.46 38.70 1vrs s ILE 46 CO 0.51 0.25 0.17 -0.60 0.00 0.00 0.00 174.94 175.28 1vrs s ARG 47 N -0.29 0.05 -0.29 2.79 3.52 0.28 -4.99 118.95 120.02 1vrs s ARG 47 Ca 0.51 0.57 -0.02 0.00 -0.13 0.00 0.00 55.73 56.66 1vrs s ARG 47 Cb -0.30 -0.28 0.04 0.00 -1.56 0.00 0.00 34.95 32.85 1vrs s ARG 47 CO 0.35 -0.32 -0.01 0.42 -0.81 0.00 0.00 175.30 174.94 1vrs s ILE 48 N 2.31 3.03 -0.08 4.11 1.01 -1.26 -0.93 121.20 129.38 1vrs s ILE 48 Ca 0.03 -1.29 0.03 0.00 0.00 0.00 0.00 60.65 59.42 1vrs s ILE 48 Cb -0.12 -2.70 0.01 0.00 0.01 0.00 0.00 42.46 39.66 1vrs s ILE 48 CO -0.06 -0.05 -0.17 0.28 0.00 0.00 0.00 174.94 174.94 1vrs s THR 49 N 1.28 1.54 0.34 2.92 -1.32 -0.21 -4.97 115.64 115.22 1vrs s THR 49 Ca -0.04 -0.71 -0.25 0.00 -1.21 0.00 0.00 61.69 59.47 1vrs s THR 49 Cb -0.19 -1.37 -0.10 0.00 -1.51 0.00 0.00 72.50 69.34 1vrs s THR 49 CO -0.01 0.44 0.96 -2.84 -2.21 0.00 0.00 174.62 170.96 1vrs s PRO 50 N 0.54 4.51 -0.32 7.08 0.02 -1.26 -0.24 135.00 145.33 1vrs s PRO 50 Ca -0.16 1.34 -0.00 0.00 0.02 0.00 0.00 61.00 62.20 1vrs s PRO 50 Cb -0.17 -2.73 0.10 0.00 0.02 0.00 0.00 34.50 31.73 1vrs s PRO 50 CO 0.06 0.20 0.11 -2.00 -0.33 0.00 0.00 177.00 175.05 1vrs s GLU 51 N -2.18 0.77 -0.22 5.54 2.56 0.29 -4.74 118.70 120.71 1vrs s GLU 51 Ca 0.52 -1.18 -0.00 0.00 0.00 0.00 0.00 54.97 54.30 1vrs s GLU 51 Cb -0.18 -2.02 0.00 0.00 2.00 0.00 0.00 34.13 33.93 1vrs s GLU 51 CO 0.24 -1.01 0.04 0.72 -0.56 0.00 0.00 175.26 174.69 1vrs n HIS 52 N 4.69 -0.20 -3.79 5.30 8.25 -1.26 -1.06 115.22 127.14 1vrs n HIS 52 Ca -0.00 0.04 -0.10 0.00 -0.26 0.00 0.00 57.72 57.40 1vrs n HIS 52 Cb 0.41 -1.43 -0.05 0.00 1.12 0.00 0.00 29.99 30.04 1vrs n HIS 52 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1vrs s ALA 53 N -2.40 -0.62 -0.15 -1.41 0.00 -1.26 -1.13 121.76 114.79 1vrs s ALA 53 Ca 0.02 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.58 1vrs s ALA 53 Cb -0.01 0.80 0.03 0.00 0.00 0.00 0.00 23.12 23.94 1vrs s ALA 53 CO 0.03 -0.71 -0.10 0.15 0.00 0.00 0.00 175.76 175.12 1vrs s LYS 54 N -3.89 1.92 0.05 0.00 1.02 0.17 -4.84 119.74 114.18 1vrs s LYS 54 Ca 0.10 -0.55 0.05 0.00 0.02 0.00 0.00 55.97 55.59 1vrs s LYS 54 Cb 0.01 -2.04 -0.04 0.00 -0.52 0.00 0.00 37.83 35.24 1vrs s LYS 54 CO -0.04 -0.32 -0.06 0.42 -0.92 0.00 0.00 175.35 174.43 1vrs s ILE 55 N 1.54 3.69 0.39 2.17 1.01 -1.26 -0.51 121.20 128.23 1vrs s ILE 55 Ca 0.03 -0.95 -0.24 0.00 0.00 0.00 0.00 60.65 59.49 1vrs s ILE 55 Cb -0.14 -2.68 -0.09 0.00 0.01 0.00 0.00 42.46 39.56 1vrs s ILE 55 CO -0.09 0.25 1.03 0.00 0.00 0.00 0.00 174.94 176.13 1vrs s ALA 56 N -1.13 3.10 0.21 9.38 0.00 -0.52 -4.93 121.76 127.87 1vrs s ALA 56 Ca 0.20 0.66 -0.32 0.00 0.00 0.00 0.00 51.96 52.51 1vrs s ALA 56 Cb -0.11 -3.25 -0.14 0.00 0.00 0.00 0.00 23.12 19.62 1vrs s ALA 56 CO 0.12 -0.14 1.47 -0.25 0.00 0.00 0.00 175.76 176.95 1vrs n ASP 57 N -0.00 2.86 -4.69 0.00 9.92 -1.26 -4.62 116.55 118.76 1vrs n ASP 57 Ca 0.05 1.12 -0.39 0.00 -0.53 0.00 0.00 54.79 55.03 1vrs n ASP 57 Cb 0.50 -1.42 -0.06 0.00 -0.64 0.00 0.00 41.12 39.50 1vrs n ASP 57 CO 0.00 0.00 0.00 -0.69 0.13 0.00 0.00 177.20 176.64 1vrs s VAL 58 N 0.29 5.08 -0.24 2.53 1.01 -1.26 -4.98 120.40 122.83 1vrs s VAL 58 Ca 0.72 1.17 -0.10 0.00 0.00 0.00 0.00 61.98 63.77 1vrs s VAL 58 Cb -0.67 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 31.74 1vrs s VAL 58 CO 0.45 0.21 0.15 0.00 0.00 0.00 0.00 175.10 175.92 1vrs s GLN 59 N 1.28 4.02 -0.03 2.72 1.03 -1.26 -5.06 119.66 122.36 1vrs s GLN 59 Ca 0.30 -0.29 -0.30 0.00 0.04 0.00 0.00 55.36 55.10 1vrs s GLN 59 Cb -0.16 -3.53 -0.03 0.00 0.03 0.00 0.00 33.01 29.32 1vrs s GLN 59 CO 0.12 0.02 1.05 -0.51 -2.54 0.00 0.00 175.29 173.43 1vrs s LEU 60 N 1.16 4.32 0.99 2.60 1.43 -1.26 -4.90 118.68 123.02 1vrs s LEU 60 Ca 0.07 1.69 -0.11 0.00 -1.03 0.00 0.00 54.13 54.75 1vrs s LEU 60 Cb -0.14 -3.57 0.18 0.00 0.03 0.00 0.00 46.19 42.70 1vrs s LEU 60 CO 0.05 -0.38 1.09 -2.84 0.23 0.00 0.00 176.35 174.50 1vrs s PRO 61 N 1.45 0.47 -0.21 1.29 0.02 -1.26 -4.95 135.00 131.80 1vrs s PRO 61 Ca 0.52 1.09 -0.29 0.00 0.02 0.00 0.00 61.00 62.34 1vrs s PRO 61 Cb -0.22 -1.70 0.00 0.00 0.02 0.00 0.00 34.50 32.61 1vrs s PRO 61 CO 0.25 -2.86 1.10 -0.65 -0.33 0.00 0.00 177.00 174.51 1vrs s GLN 62 N -4.68 4.25 0.00 5.54 -1.52 -1.26 -5.02 119.66 116.97 1vrs s GLN 62 Ca 0.66 1.45 0.00 0.00 -1.95 0.00 0.00 55.36 55.52 1vrs s GLN 62 Cb -0.22 -3.68 0.00 0.00 -0.22 0.00 0.00 33.01 28.90 1vrs s GLN 62 CO 0.60 -0.65 0.00 0.41 -0.25 0.00 0.00 175.29 175.40 1vrs n GLY 63 N 3.40 3.19 4.00 3.09 0.00 -1.26 -5.10 105.19 112.51 1vrs n GLY 63 Ca 0.13 -2.07 -0.18 0.00 0.00 0.00 0.00 46.02 43.90 1vrs n GLY 63 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vrs s VAL 64 N 1.41 3.47 -0.18 1.61 1.01 -0.09 -4.83 120.40 122.81 1vrs s VAL 64 Ca 0.00 -0.96 -0.08 0.00 0.00 0.00 0.00 61.98 60.93 1vrs s VAL 64 Cb 0.00 -3.19 -0.04 0.00 0.00 0.00 0.00 36.38 33.15 1vrs s VAL 64 CO 0.00 -0.08 0.10 0.26 0.00 0.00 0.00 175.10 175.38 1vrs s TRP 65 N -2.30 3.37 -0.08 5.22 0.52 -1.26 0.51 118.94 124.91 1vrs s TRP 65 Ca 0.51 0.26 0.02 0.00 0.02 0.00 0.00 56.10 56.90 1vrs s TRP 65 Cb -0.10 -2.08 -0.02 0.00 -1.15 0.00 0.00 33.47 30.12 1vrs s TRP 65 CO 0.33 0.32 -0.12 -1.58 0.02 0.00 0.00 176.95 175.92 1vrs s HIS 66 N 0.09 2.80 -0.09 -1.98 5.65 0.66 -4.94 115.29 117.49 1vrs s HIS 66 Ca 0.08 -0.23 0.01 0.00 0.25 0.00 0.00 55.06 55.17 1vrs s HIS 66 Cb -0.12 -1.72 -0.02 0.00 -1.18 0.00 0.00 32.58 29.54 1vrs s HIS 66 CO -0.00 0.12 -0.11 -1.21 -0.65 0.00 0.00 174.74 172.89 1vrs s GLU 67 N -0.44 2.94 -0.04 2.88 2.02 -1.26 -0.62 118.70 124.18 1vrs s GLU 67 Ca 0.06 -0.64 -0.13 0.00 0.02 0.00 0.00 54.97 54.28 1vrs s GLU 67 Cb -0.12 -2.56 0.02 0.00 0.10 0.00 0.00 34.13 31.57 1vrs s GLU 67 CO 0.02 0.47 0.28 0.16 0.02 0.00 0.00 175.26 176.22 1vrs s ASP 68 N -0.32 -0.19 0.03 -0.19 -4.77 -0.47 -5.00 116.67 105.75 1vrs s ASP 68 Ca 0.03 0.17 0.06 0.00 -3.30 0.00 0.00 52.55 49.51 1vrs s ASP 68 Cb -0.13 0.37 0.27 0.00 -1.09 0.00 0.00 42.92 42.35 1vrs s ASP 68 CO 0.02 -0.36 1.19 -1.84 0.70 0.00 0.00 175.17 174.89 1vrs n GLU 69 N 1.69 0.01 -0.12 2.11 0.28 -1.26 -1.27 120.64 122.08 1vrs n GLU 69 Ca -0.20 0.44 -0.23 0.00 -0.16 0.00 0.00 57.16 57.02 1vrs n GLU 69 Cb 0.56 -1.54 -0.11 0.00 1.43 0.00 0.00 31.44 31.78 1vrs n GLU 69 CO 0.00 0.00 0.00 1.19 -0.16 0.00 0.00 177.13 178.16 1vrs n PHE 70 N -1.57 0.18 0.21 -1.84 3.01 -1.26 -4.52 117.46 111.67 1vrs n PHE 70 Ca 0.01 0.05 0.09 0.00 1.01 0.00 0.00 57.45 58.61 1vrs n PHE 70 Cb 0.05 -1.02 0.16 0.00 -0.01 0.00 0.00 39.48 38.66 1vrs n PHE 70 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1vrs n TYR 71 N -3.71 0.37 0.00 1.38 4.02 -1.23 -5.04 117.16 112.94 1vrs n TYR 71 Ca -0.47 -0.26 0.00 0.00 -0.01 0.00 0.00 57.90 57.16 1vrs n TYR 71 Cb 0.94 -0.01 0.00 0.00 -0.02 0.00 0.00 39.34 40.25 1vrs n TYR 71 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1vrs n GLY 72 N 1.01 2.54 3.95 2.72 0.00 -0.40 -4.68 105.19 110.34 1vrs n GLY 72 Ca 0.14 -0.29 -0.23 0.00 0.00 0.00 0.00 46.02 45.64 1vrs n GLY 72 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1vrs s LYS 73 N 0.00 3.39 -0.06 1.61 -2.85 -1.26 -1.37 119.74 119.19 1vrs s LYS 73 Ca 0.00 -0.44 -0.10 0.00 -1.00 0.00 0.00 55.97 54.43 1vrs s LYS 73 Cb 0.00 -2.67 0.02 0.00 -2.06 0.00 0.00 37.83 33.12 1vrs s LYS 73 CO 0.00 0.10 0.25 -1.12 0.10 0.00 0.00 175.35 174.68 1vrs s SER 74 N -4.07 -0.20 -0.03 0.03 0.01 0.21 -4.96 113.70 104.69 1vrs s SER 74 Ca 0.41 0.31 -0.26 0.00 1.31 0.00 0.00 55.95 57.72 1vrs s SER 74 Cb -0.10 0.43 -0.04 0.00 0.21 0.00 0.00 66.02 66.53 1vrs s SER 74 CO 0.35 -0.20 0.82 -0.70 0.41 0.00 0.00 173.24 173.92 1vrs s GLU 75 N -0.40 4.50 0.26 12.44 2.12 -1.26 -0.25 118.70 136.11 1vrs s GLU 75 Ca -0.05 1.12 0.03 0.00 0.36 0.00 0.00 54.97 56.43 1vrs s GLU 75 Cb -0.03 -3.44 -0.05 0.00 0.26 0.00 0.00 34.13 30.86 1vrs s GLU 75 CO 0.01 0.04 0.04 0.96 -0.54 0.00 0.00 175.26 175.77 1vrs s ILE 76 N 0.80 0.94 -0.02 -3.70 -4.36 0.18 -1.65 121.20 113.39 1vrs s ILE 76 Ca 0.43 -2.02 0.08 0.00 -0.26 0.00 0.00 60.65 58.89 1vrs s ILE 76 Cb -0.19 -2.51 -0.02 0.00 1.25 0.00 0.00 42.46 40.98 1vrs s ILE 76 CO 0.23 -0.17 -0.26 -0.31 0.24 0.00 0.00 174.94 174.67 1vrs s TYR 77 N -3.48 2.30 0.19 1.37 2.02 -0.16 -0.91 117.35 118.68 1vrs s TYR 77 Ca 0.32 -0.45 0.06 0.00 -0.37 0.00 0.00 57.07 56.64 1vrs s TYR 77 Cb 0.07 -1.48 -0.05 0.00 -0.40 0.00 0.00 41.96 40.10 1vrs s TYR 77 CO 0.11 -0.05 -0.11 1.03 -1.57 0.00 0.00 175.55 174.97 1vrs s ARG 78 N -0.58 1.25 0.00 -0.62 0.52 -1.26 -1.75 118.95 116.50 1vrs s ARG 78 Ca 0.09 -1.56 0.00 0.00 -0.52 0.00 0.00 55.73 53.74 1vrs s ARG 78 Cb -0.10 -0.88 0.00 0.00 0.52 0.00 0.00 34.95 34.49 1vrs s ARG 78 CO -0.01 0.10 0.00 -0.25 0.02 0.00 0.00 175.30 175.16 1vrs n ASP 79 N -0.33 0.00 -3.76 0.23 8.00 -1.23 -4.65 116.55 114.81 1vrs n ASP 79 Ca -0.08 0.00 -0.11 0.00 0.71 0.00 0.00 54.79 55.31 1vrs n ASP 79 Cb 0.61 0.00 -0.07 0.00 -0.02 0.00 0.00 41.12 41.64 1vrs n ASP 79 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1vrs s ARG 80 N 0.00 0.84 -0.06 -1.24 1.70 -1.26 0.28 118.95 119.22 1vrs s ARG 80 Ca 0.00 -0.60 -0.01 0.00 -0.47 0.00 0.00 55.73 54.65 1vrs s ARG 80 Cb 0.00 0.36 0.03 0.00 -0.57 0.00 0.00 34.95 34.77 1vrs s ARG 80 CO 0.00 -0.28 0.02 -1.17 -1.08 0.00 0.00 175.30 172.80 1vrs s LEU 81 N -2.26 0.47 -0.16 -1.89 0.20 -0.71 -4.94 118.68 109.38 1vrs s LEU 81 Ca -0.03 -0.02 -0.01 0.00 0.69 0.00 0.00 54.13 54.76 1vrs s LEU 81 Cb 0.00 -0.31 -0.01 0.00 -0.43 0.00 0.00 46.19 45.44 1vrs s LEU 81 CO -0.05 -0.21 -0.12 -0.89 -0.29 0.00 0.00 176.35 174.79 1vrs s THR 82 N 1.97 2.98 -0.28 3.68 2.01 -1.26 -1.24 115.64 123.50 1vrs s THR 82 Ca 0.04 -0.66 0.02 0.00 0.31 0.00 0.00 61.69 61.39 1vrs s THR 82 Cb -0.12 -2.28 0.08 0.00 0.01 0.00 0.00 72.50 70.18 1vrs s THR 82 CO -0.04 0.50 -0.01 -0.22 -0.69 0.00 0.00 174.62 174.16 1vrs s LEU 83 N 0.81 3.27 0.01 4.42 2.96 0.17 -4.88 118.68 125.43 1vrs s LEU 83 Ca -0.04 -1.55 -0.30 0.00 -0.22 0.00 0.00 54.13 52.01 1vrs s LEU 83 Cb -0.15 -1.32 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 1vrs s LEU 83 CO 0.01 -0.29 1.13 -2.84 -1.32 0.00 0.00 176.35 173.04 1vrs s PRO 84 N 1.24 4.44 -0.04 0.98 0.02 -1.26 -0.05 135.00 140.33 1vrs s PRO 84 Ca 0.01 1.64 0.05 0.00 0.02 0.00 0.00 61.00 62.72 1vrs s PRO 84 Cb -0.19 -3.44 -0.01 0.00 0.02 0.00 0.00 34.50 30.88 1vrs s PRO 84 CO -0.09 -0.26 -0.20 0.08 -0.33 0.00 0.00 177.00 176.20 1vrs s VAL 85 N 1.41 1.64 -0.27 3.83 1.01 0.29 -4.79 120.40 123.52 1vrs s VAL 85 Ca 0.56 -0.85 -0.08 0.00 0.00 0.00 0.00 61.98 61.61 1vrs s VAL 85 Cb -0.25 -1.39 -0.03 0.00 0.00 0.00 0.00 36.38 34.71 1vrs s VAL 85 CO 0.26 0.46 0.10 -0.89 0.00 0.00 0.00 175.10 175.03 1vrs s THR 86 N -0.14 4.45 -0.48 3.92 2.01 -1.26 -0.55 115.64 123.59 1vrs s THR 86 Ca -0.01 -0.21 -0.16 0.00 0.31 0.00 0.00 61.69 61.62 1vrs s THR 86 Cb -0.11 -3.13 0.07 0.00 0.01 0.00 0.00 72.50 69.34 1vrs s THR 86 CO 0.02 0.27 0.43 -0.63 -0.69 0.00 0.00 174.62 174.02 1vrs s ILE 87 N 1.62 5.18 -0.07 1.82 1.01 0.12 -1.44 121.20 129.44 1vrs s ILE 87 Ca 0.06 -0.99 -0.27 0.00 0.00 0.00 0.00 60.65 59.45 1vrs s ILE 87 Cb -0.16 -4.16 -0.22 0.00 0.01 0.00 0.00 42.46 37.93 1vrs s ILE 87 CO 0.05 -0.62 1.03 0.78 0.00 0.00 0.00 174.94 176.18 1vrs h ASN 88 N 8.79 -0.01 -4.87 3.58 2.35 -1.08 -3.38 115.58 120.96 1vrs h ASN 88 Ca -0.28 -0.70 -0.22 0.00 -0.55 0.00 0.00 56.30 54.54 1vrs h ASN 88 Cb 1.11 0.00 -0.21 0.00 0.05 0.00 0.00 38.32 39.27 1vrs h ASN 88 CO 0.89 0.70 -0.72 -1.58 -1.65 0.00 0.00 177.43 175.08 1vrs s GLN 89 N -3.32 0.42 -0.30 0.81 -0.44 -1.02 -4.96 119.66 110.85 1vrs s GLN 89 Ca -0.17 -0.69 -0.06 0.00 -2.50 0.00 0.00 55.36 51.94 1vrs s GLN 89 Cb -0.00 -0.10 0.15 0.00 -1.64 0.00 0.00 33.01 31.42 1vrs s GLN 89 CO 0.67 0.00 0.63 0.00 0.50 0.00 0.00 175.29 177.09 1vrs s ALA 90 N -1.42 -2.12 0.95 1.58 0.00 -1.26 0.46 121.76 119.94 1vrs s ALA 90 Ca -0.13 2.14 -0.13 0.00 0.00 0.00 0.00 51.96 53.84 1vrs s ALA 90 Cb -0.10 -1.93 0.16 0.00 0.00 0.00 0.00 23.12 21.25 1vrs s ALA 90 CO -0.00 -1.09 1.13 -1.12 0.00 0.00 0.00 175.76 174.67 1vrs s SER 91 N 2.88 3.13 -0.03 0.00 0.01 -0.29 -4.70 113.70 114.71 1vrs s SER 91 Ca 0.05 0.98 -0.30 0.00 1.31 0.00 0.00 55.95 57.99 1vrs s SER 91 Cb -0.13 -1.55 -0.05 0.00 0.21 0.00 0.00 66.02 64.49 1vrs s SER 91 CO -0.20 -2.79 1.41 0.00 0.41 0.00 0.00 173.24 172.08 1vrs s ALA 92 N -3.20 3.59 0.00 1.44 0.00 -1.26 -1.36 121.76 120.97 1vrs s ALA 92 Ca 0.65 0.83 0.00 0.00 0.00 0.00 0.00 51.96 53.44 1vrs s ALA 92 Cb -0.15 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.35 1vrs s ALA 92 CO 0.55 -1.01 0.00 0.41 0.00 0.00 0.00 175.76 175.71 1vrs n GLY 93 N 3.70 0.79 3.75 0.00 0.00 -1.26 -5.05 105.19 107.11 1vrs n GLY 93 Ca 0.14 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.79 1vrs n GLY 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vrs s ALA 94 N -2.18 2.64 0.05 4.61 0.00 -0.47 -4.88 121.76 121.54 1vrs s ALA 94 Ca 0.00 1.15 -0.06 0.00 0.00 0.00 0.00 51.96 53.06 1vrs s ALA 94 Cb 0.00 -3.51 -0.01 0.00 0.00 0.00 0.00 23.12 19.60 1vrs s ALA 94 CO 0.00 -1.27 0.10 0.95 0.00 0.00 0.00 175.76 175.53 1vrs s THR 95 N -1.45 0.15 -0.15 0.00 -4.23 -0.23 -0.99 115.64 108.75 1vrs s THR 95 Ca 0.75 -1.25 -0.01 0.00 -1.18 0.00 0.00 61.69 60.00 1vrs s THR 95 Cb -0.35 -1.13 -0.01 0.00 1.34 0.00 0.00 72.50 72.35 1vrs s THR 95 CO 0.39 -0.69 -0.12 -0.22 -0.54 0.00 0.00 174.62 173.45 1vrs s LEU 96 N -2.46 2.72 -0.37 4.79 2.96 0.13 -0.55 118.68 125.89 1vrs s LEU 96 Ca -0.00 -0.36 -0.14 0.00 -0.22 0.00 0.00 54.13 53.41 1vrs s LEU 96 Cb 0.02 -1.63 0.00 0.00 0.50 0.00 0.00 46.19 45.08 1vrs s LEU 96 CO -0.07 0.12 0.28 -0.89 -1.32 0.00 0.00 176.35 174.47 1vrs s THR 97 N 0.64 5.26 -0.21 3.68 2.01 0.67 0.67 115.64 128.35 1vrs s THR 97 Ca -0.06 -0.40 -0.03 0.00 0.31 0.00 0.00 61.69 61.51 1vrs s THR 97 Cb -0.15 -3.83 -0.00 0.00 0.01 0.00 0.00 72.50 68.53 1vrs s THR 97 CO 0.03 -0.16 -0.07 -0.69 -0.69 0.00 0.00 174.62 173.04 1vrs s VAL 98 N 1.74 3.16 -0.02 3.82 1.01 0.61 -1.05 120.40 129.66 1vrs s VAL 98 Ca 0.06 -0.57 0.07 0.00 0.00 0.00 0.00 61.98 61.55 1vrs s VAL 98 Cb -0.18 -2.42 -0.02 0.00 0.00 0.00 0.00 36.38 33.76 1vrs s VAL 98 CO 0.10 0.44 -0.23 -0.89 0.00 0.00 0.00 175.10 174.53 1vrs s THR 99 N 1.43 2.30 0.25 3.92 2.01 -0.11 0.50 115.64 125.94 1vrs s THR 99 Ca 0.05 -1.03 -0.14 0.00 0.31 0.00 0.00 61.69 60.88 1vrs s THR 99 Cb -0.14 -1.83 -0.00 0.00 0.01 0.00 0.00 72.50 70.54 1vrs s THR 99 CO -0.05 0.57 0.51 -0.72 -0.69 0.00 0.00 174.62 174.24 1vrs s TYR 100 N -0.65 0.31 -0.16 4.92 1.13 -0.19 -0.56 117.35 122.15 1vrs s TYR 100 Ca 0.10 -0.68 -0.13 0.00 -1.41 0.00 0.00 57.07 54.95 1vrs s TYR 100 Cb -0.10 0.25 0.05 0.00 -1.10 0.00 0.00 41.96 41.06 1vrs s TYR 100 CO -0.00 -1.03 0.42 -1.14 -2.51 0.00 0.00 175.55 171.29 1vrs s GLN 101 N -3.98 0.47 0.31 -3.49 0.74 -1.26 -0.25 119.66 112.21 1vrs s GLN 101 Ca 0.21 0.65 0.04 0.00 0.05 0.00 0.00 55.36 56.31 1vrs s GLN 101 Cb -0.01 0.17 -0.03 0.00 1.10 0.00 0.00 33.01 34.23 1vrs s GLN 101 CO 0.09 -0.09 0.18 0.20 -0.55 0.00 0.00 175.29 175.13 1vrs s GLY 102 N 0.55 2.13 0.23 2.59 0.00 -1.26 -1.34 107.32 110.22 1vrs s GLY 102 Ca -0.03 -1.78 -0.09 0.00 0.00 0.00 0.00 44.72 42.83 1vrs s GLY 102 CO -0.03 -1.57 0.36 -0.56 0.00 0.00 0.00 173.10 171.31 1vrs s SER 103 N -3.38 0.02 -0.06 1.64 0.01 -0.49 -1.32 113.70 110.13 1vrs s SER 103 Ca 0.36 -1.10 0.02 0.00 1.31 0.00 0.00 55.95 56.54 1vrs s SER 103 Cb 0.04 0.52 -0.03 0.00 0.21 0.00 0.00 66.02 66.77 1vrs s SER 103 CO 0.19 -1.05 -0.11 0.00 0.41 0.00 0.00 173.24 172.69 1vrs s ALA 104 N -4.03 2.82 0.29 1.44 0.00 0.14 -1.39 121.76 121.02 1vrs s ALA 104 Ca 0.28 -0.93 0.03 0.00 0.00 0.00 0.00 51.96 51.34 1vrs s ALA 104 Cb 0.02 -1.10 0.67 0.00 0.00 0.00 0.00 23.12 22.71 1vrs s ALA 104 CO 0.10 0.56 1.74 -0.44 0.00 0.00 0.00 175.76 177.72 1vrs h ASP 105 N 5.34 0.55 0.00 0.00 3.32 -1.17 0.16 116.42 124.60 1vrs h ASP 105 Ca -0.47 0.11 0.00 0.00 0.02 0.00 0.00 57.03 56.69 1vrs h ASP 105 Cb 1.16 0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.75 1vrs h ASP 105 CO 0.51 0.16 0.00 0.00 -1.72 0.00 0.00 179.24 178.20 1vrs n ALA 106 N -2.41 1.89 -0.31 3.45 0.00 -1.26 -4.80 120.51 117.07 1vrs n ALA 106 Ca 0.21 -0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.59 1vrs n ALA 106 Cb 0.56 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.87 1vrs n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vrs n GLY 107 N -0.28 0.88 3.08 0.00 0.00 0.03 -4.95 105.19 103.94 1vrs n GLY 107 Ca 0.06 -0.71 -0.12 0.00 0.00 0.00 0.00 46.02 45.26 1vrs n GLY 107 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1vrs s PHE 108 N -2.21 -0.37 -0.20 1.61 5.36 -1.11 -4.98 117.98 116.08 1vrs s PHE 108 Ca 0.00 0.86 -0.05 0.00 -0.96 0.00 0.00 56.93 56.78 1vrs s PHE 108 Cb 0.00 0.07 -0.02 0.00 -0.34 0.00 0.00 43.02 42.72 1vrs s PHE 108 CO 0.00 -0.26 -0.01 0.00 -1.46 0.00 0.00 175.22 173.49 1vrs s TYR 110 N 1.01 3.40 0.99 0.00 1.51 -0.43 -5.01 117.35 118.82 1vrs s TYR 110 Ca 0.01 1.03 -0.15 0.00 -1.01 0.00 0.00 57.07 56.95 1vrs s TYR 110 Cb -0.14 -2.38 0.19 0.00 -0.11 0.00 0.00 41.96 39.51 1vrs s TYR 110 CO 0.01 0.18 1.19 -1.25 -1.11 0.00 0.00 175.55 174.57 1vrs s PRO 111 N -2.94 0.46 0.54 -1.71 0.04 -1.26 -4.38 135.00 125.76 1vrs s PRO 111 Ca 0.50 -0.03 -0.21 0.00 0.04 0.00 0.00 61.00 61.30 1vrs s PRO 111 Cb -0.11 -1.79 -0.05 0.00 0.04 0.00 0.00 34.50 32.60 1vrs s PRO 111 CO 0.20 -2.60 1.29 -2.14 0.04 0.00 0.00 177.00 173.79 1vrs s PRO 112 N -5.52 3.19 0.02 0.56 0.02 -1.26 -4.63 135.00 127.37 1vrs s PRO 112 Ca 0.69 2.06 0.07 0.00 0.02 0.00 0.00 61.00 63.83 1vrs s PRO 112 Cb -0.10 -2.20 -0.02 0.00 0.02 0.00 0.00 34.50 32.20 1vrs s PRO 112 CO 0.54 -1.10 -0.21 -1.21 -0.33 0.00 0.00 177.00 174.69 1vrs s GLU 113 N -2.97 1.51 -0.10 5.54 0.41 0.66 -4.97 118.70 118.77 1vrs s GLU 113 Ca 0.72 -0.84 -0.00 0.00 -0.41 0.00 0.00 54.97 54.43 1vrs s GLU 113 Cb -0.36 -1.55 0.02 0.00 -1.78 0.00 0.00 34.13 30.46 1vrs s GLU 113 CO 0.42 0.41 -0.07 0.99 -0.49 0.00 0.00 175.26 176.52 1vrs s THR 114 N -0.65 0.92 -0.06 3.63 2.01 -1.26 -1.02 115.64 119.21 1vrs s THR 114 Ca 0.08 -0.24 0.01 0.00 0.31 0.00 0.00 61.69 61.85 1vrs s THR 114 Cb -0.08 -0.94 -0.03 0.00 0.01 0.00 0.00 72.50 71.45 1vrs s THR 114 CO 0.01 0.34 -0.06 -0.54 -0.69 0.00 0.00 174.62 173.68 1vrs s LYS 115 N 1.59 2.75 -0.34 4.92 -0.14 0.18 -4.94 119.74 123.77 1vrs s LYS 115 Ca 0.02 -0.55 -0.10 0.00 -1.36 0.00 0.00 55.97 53.98 1vrs s LYS 115 Cb -0.13 -2.61 0.02 0.00 -1.68 0.00 0.00 37.83 33.43 1vrs s LYS 115 CO -0.06 0.66 0.16 0.99 -0.76 0.00 0.00 175.35 176.34 1vrs s THR 116 N -0.85 4.42 -0.29 2.17 2.01 -1.26 -0.28 115.64 121.55 1vrs s THR 116 Ca 0.13 -0.73 -0.20 0.00 0.31 0.00 0.00 61.69 61.20 1vrs s THR 116 Cb -0.11 -3.38 -0.01 0.00 0.01 0.00 0.00 72.50 69.01 1vrs s THR 116 CO 0.03 -0.10 0.60 -0.69 -0.69 0.00 0.00 174.62 173.77 1vrs s VAL 117 N 1.55 4.98 -0.09 3.82 1.01 0.21 -4.89 120.40 126.99 1vrs s VAL 117 Ca 0.02 0.90 -0.30 0.00 0.00 0.00 0.00 61.98 62.61 1vrs s VAL 117 Cb -0.18 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 1vrs s VAL 117 CO 0.06 -0.06 1.10 -2.16 0.00 0.00 0.00 175.10 174.04 1vrs s PRO 118 N 2.52 4.38 0.16 2.72 0.04 -1.26 0.17 135.00 143.73 1vrs s PRO 118 Ca 0.24 1.53 -0.06 0.00 0.04 0.00 0.00 61.00 62.75 1vrs s PRO 118 Cb -0.15 -3.55 -0.06 0.00 0.04 0.00 0.00 34.50 30.77 1vrs s PRO 118 CO 0.11 -0.39 0.42 -0.51 0.04 0.00 0.00 177.00 176.66 1vrs s LEU 119 N 2.16 4.25 0.00 -3.56 1.43 -0.16 -4.93 118.68 117.87 1vrs s LEU 119 Ca 0.52 0.69 0.00 0.00 -1.03 0.00 0.00 54.13 54.31 1vrs s LEU 119 Cb -0.21 -3.37 0.00 0.00 0.03 0.00 0.00 46.19 42.64 1vrs s LEU 119 CO 0.19 0.03 0.00 -1.20 0.23 0.00 0.00 176.35 175.61 1vrs n SER 120 N 0.12 0.00 0.00 2.29 7.64 -1.26 -4.31 113.62 118.10 1vrs n SER 120 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 1vrs n SER 120 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 1vrs n SER 120 CO 0.00 0.00 0.00 1.21 -3.01 0.00 0.00 175.04 173.24