#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ks0 n VAL 2 N 0.00 -6.53 -4.77 6.31 0.24 -1.26 -5.03 118.33 107.29 3ks0 n VAL 2 Ca 0.00 1.60 -0.33 0.00 -2.04 0.00 0.00 64.34 63.57 3ks0 n VAL 2 Cb 0.00 -3.36 -0.16 0.00 -1.47 0.00 0.00 33.84 28.85 3ks0 n VAL 2 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 3ks0 s GLN 3 N -0.27 3.09 -0.21 7.34 -1.52 0.45 -5.01 119.66 123.53 3ks0 s GLN 3 Ca 0.00 -0.83 -0.06 0.00 -1.95 0.00 0.00 55.36 52.52 3ks0 s GLN 3 Cb 0.00 -2.46 -0.03 0.00 -0.22 0.00 0.00 33.01 30.30 3ks0 s GLN 3 CO 0.00 0.05 0.03 -0.51 -0.25 0.00 0.00 175.29 174.61 3ks0 s LEU 4 N 0.68 3.42 -0.22 2.90 1.43 -1.26 -2.50 118.68 123.13 3ks0 s LEU 4 Ca -0.10 -0.14 0.00 0.00 -1.03 0.00 0.00 54.13 52.87 3ks0 s LEU 4 Cb -0.16 -1.88 0.06 0.00 0.03 0.00 0.00 46.19 44.24 3ks0 s LEU 4 CO 0.01 0.07 -0.04 -1.10 0.23 0.00 0.00 176.35 175.52 3ks0 s GLN 5 N 0.97 1.47 0.28 1.70 -1.52 -0.43 -3.82 119.66 118.31 3ks0 s GLN 5 Ca 0.02 -0.85 -0.24 0.00 -1.95 0.00 0.00 55.36 52.35 3ks0 s GLN 5 Cb -0.14 -2.45 -0.09 0.00 -0.22 0.00 0.00 33.01 30.11 3ks0 s GLN 5 CO 0.02 -0.58 0.86 -1.83 -0.25 0.00 0.00 175.29 173.51 3ks0 s GLU 6 N 1.49 4.48 0.08 2.91 1.03 -1.26 -1.21 118.70 126.22 3ks0 s GLU 6 Ca -0.04 1.17 0.06 0.00 0.03 0.00 0.00 54.97 56.18 3ks0 s GLU 6 Cb -0.18 -2.87 -0.03 0.00 -0.80 0.00 0.00 34.13 30.25 3ks0 s GLU 6 CO -0.07 0.34 -0.15 -1.12 -1.33 0.00 0.00 175.26 172.94 3ks0 s SER 7 N -1.59 1.80 0.00 0.83 0.01 0.20 -4.81 113.70 110.13 3ks0 s SER 7 Ca 0.47 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 57.07 3ks0 s SER 7 Cb -0.18 -0.06 0.00 0.00 0.21 0.00 0.00 66.02 65.99 3ks0 s SER 7 CO 0.23 -0.07 0.00 0.61 0.41 0.00 0.00 173.24 174.42 3ks0 n GLY 8 N 1.15 -1.78 3.69 3.44 0.00 -1.26 -1.31 105.19 109.12 3ks0 n GLY 8 Ca -0.20 -1.13 -0.33 0.00 0.00 0.00 0.00 46.02 44.35 3ks0 n GLY 8 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3ks0 s PRO 9 N -1.61 1.47 -0.12 1.61 0.02 -1.26 -4.97 135.00 130.14 3ks0 s PRO 9 Ca 0.00 1.73 0.18 0.00 0.02 0.00 0.00 61.00 62.93 3ks0 s PRO 9 Cb 0.00 -1.76 -0.27 0.00 0.02 0.00 0.00 34.50 32.49 3ks0 s PRO 9 CO 0.00 -2.33 0.23 0.45 -0.33 0.00 0.00 177.00 175.01 3ks0 n SER 10 N -3.51 0.36 -3.95 2.53 2.88 -1.26 -4.74 113.62 105.92 3ks0 n SER 10 Ca 0.13 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.48 3ks0 n SER 10 Cb 0.51 1.38 -0.15 0.00 -0.75 0.00 0.00 64.21 65.19 3ks0 n SER 10 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 3ks0 s LEU 11 N -4.97 1.71 -0.07 2.46 2.96 -1.26 -0.34 118.68 119.16 3ks0 s LEU 11 Ca -0.08 -0.14 -0.05 0.00 -0.22 0.00 0.00 54.13 53.63 3ks0 s LEU 11 Cb 0.09 -0.43 0.03 0.00 0.50 0.00 0.00 46.19 46.37 3ks0 s LEU 11 CO 0.80 0.03 0.18 -0.69 -1.32 0.00 0.00 176.35 175.35 3ks0 s VAL 12 N 0.32 -0.02 0.24 1.68 1.01 -0.42 -4.96 120.40 118.25 3ks0 s VAL 12 Ca -0.04 0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.71 3ks0 s VAL 12 Cb -0.08 -0.27 -0.09 0.00 0.00 0.00 0.00 36.38 35.93 3ks0 s VAL 12 CO 0.00 0.03 0.96 -0.54 0.00 0.00 0.00 175.10 175.55 3ks0 s LYS 13 N 0.59 4.84 0.61 2.72 1.02 -1.26 -2.86 119.74 125.41 3ks0 s LYS 13 Ca -0.04 1.52 -0.18 0.00 0.02 0.00 0.00 55.97 57.29 3ks0 s LYS 13 Cb -0.06 -3.27 -0.04 0.00 -0.52 0.00 0.00 37.83 33.94 3ks0 s LYS 13 CO -0.03 0.49 1.03 -0.35 -0.92 0.00 0.00 175.35 175.56 3ks0 n PRO 14 N 1.46 0.93 0.00 -1.68 -0.04 -1.26 -2.55 135.00 131.86 3ks0 n PRO 14 Ca -0.02 0.36 0.00 0.00 -0.04 0.00 0.00 63.50 63.80 3ks0 n PRO 14 Cb 0.47 -2.24 0.00 0.00 -0.04 0.00 0.00 33.50 31.69 3ks0 n PRO 14 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3ks0 n SER 15 N -1.00 0.00 -2.01 3.54 7.64 -0.32 -4.96 113.62 116.52 3ks0 n SER 15 Ca 0.14 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.02 3ks0 n SER 15 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 3ks0 n SER 15 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ks0 n GLN 16 N -1.51 0.43 -3.91 1.43 6.02 -1.06 -3.92 117.38 114.86 3ks0 n GLN 16 Ca 0.00 0.00 -0.30 0.00 -0.01 0.00 0.00 57.00 56.69 3ks0 n GLN 16 Cb 0.00 0.00 -0.15 0.00 1.02 0.00 0.00 30.24 31.11 3ks0 n GLN 16 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 3ks0 s THR 17 N -0.31 1.87 0.30 5.09 2.01 -1.26 -1.96 115.64 121.38 3ks0 s THR 17 Ca 0.00 -2.22 -0.29 0.00 0.31 0.00 0.00 61.69 59.49 3ks0 s THR 17 Cb 0.00 -2.37 -0.10 0.00 0.01 0.00 0.00 72.50 70.04 3ks0 s THR 17 CO 0.00 -0.67 1.41 -0.22 -0.69 0.00 0.00 174.62 174.45 3ks0 s LEU 18 N 0.91 4.39 -0.11 4.42 2.96 -0.79 -4.89 118.68 125.57 3ks0 s LEU 18 Ca 0.12 2.75 0.01 0.00 -0.22 0.00 0.00 54.13 56.80 3ks0 s LEU 18 Cb -0.20 -3.64 0.02 0.00 0.50 0.00 0.00 46.19 42.87 3ks0 s LEU 18 CO -0.11 -0.68 -0.14 -0.55 -1.32 0.00 0.00 176.35 173.54 3ks0 s SER 19 N -0.02 2.44 -0.02 3.68 0.15 -1.26 -1.89 113.70 116.77 3ks0 s SER 19 Ca 0.55 -0.42 0.06 0.00 0.70 0.00 0.00 55.95 56.83 3ks0 s SER 19 Cb -0.42 -1.08 -0.01 0.00 -1.71 0.00 0.00 66.02 62.80 3ks0 s SER 19 CO 0.50 -0.01 -0.20 -0.76 1.20 0.00 0.00 173.24 173.97 3ks0 s LEU 20 N 1.11 2.02 0.03 3.45 1.43 0.27 -4.34 118.68 122.65 3ks0 s LEU 20 Ca -0.04 -0.38 0.07 0.00 -1.03 0.00 0.00 54.13 52.75 3ks0 s LEU 20 Cb -0.14 -1.07 -0.03 0.00 0.03 0.00 0.00 46.19 44.98 3ks0 s LEU 20 CO -0.03 0.24 -0.18 -0.89 0.23 0.00 0.00 176.35 175.72 3ks0 s THR 21 N -0.39 2.79 -0.22 5.49 2.01 -0.43 -0.05 115.64 124.84 3ks0 s THR 21 Ca 0.06 -1.12 0.01 0.00 0.31 0.00 0.00 61.69 60.94 3ks0 s THR 21 Cb -0.09 -2.16 0.05 0.00 0.01 0.00 0.00 72.50 70.32 3ks0 s THR 21 CO -0.00 0.38 -0.09 0.00 -0.69 0.00 0.00 174.62 174.22 3ks0 s SER 23 N 1.37 7.00 -0.20 0.00 0.01 -0.35 -2.74 113.70 118.79 3ks0 s SER 23 Ca -0.03 1.19 -0.01 0.00 1.31 0.00 0.00 55.95 58.40 3ks0 s SER 23 Cb -0.17 -2.35 0.06 0.00 0.21 0.00 0.00 66.02 63.76 3ks0 s SER 23 CO -0.07 0.19 -0.00 -0.69 0.41 0.00 0.00 173.24 173.07 3ks0 s VAL 24 N -0.62 0.90 0.05 3.43 1.01 -1.18 -1.32 120.40 122.67 3ks0 s VAL 24 Ca 0.30 -0.76 0.07 0.00 0.00 0.00 0.00 61.98 61.59 3ks0 s VAL 24 Cb -0.19 -1.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.87 3ks0 s VAL 24 CO 0.18 -0.12 -0.18 0.42 0.00 0.00 0.00 175.10 175.39 3ks0 s THR 25 N 1.69 2.79 0.00 3.92 -4.23 -1.04 -4.66 115.64 114.11 3ks0 s THR 25 Ca -0.02 -1.21 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 3ks0 s THR 25 Cb -0.17 -2.18 0.00 0.00 1.34 0.00 0.00 72.50 71.49 3ks0 s THR 25 CO -0.07 0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.94 3ks0 n GLY 26 N 1.49 2.85 3.14 3.99 0.00 -1.26 -0.41 105.19 114.99 3ks0 n GLY 26 Ca -0.16 -0.82 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 3ks0 n GLY 26 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3ks0 s ASP 27 N 0.01 0.07 0.12 1.61 2.15 -1.26 -4.79 116.67 114.59 3ks0 s ASP 27 Ca 0.00 -0.36 -0.30 0.00 0.43 0.00 0.00 52.55 52.32 3ks0 s ASP 27 Cb 0.00 0.24 -0.06 0.00 -0.30 0.00 0.00 42.92 42.80 3ks0 s ASP 27 CO 0.00 -0.48 1.10 -0.55 -0.17 0.00 0.00 175.17 175.07 3ks0 s SER 28 N -1.84 7.25 -0.00 -0.34 0.15 -1.26 -4.91 113.70 112.74 3ks0 s SER 28 Ca -0.09 2.00 0.01 0.00 0.70 0.00 0.00 55.95 58.58 3ks0 s SER 28 Cb -0.03 -2.59 0.05 0.00 -1.71 0.00 0.00 66.02 61.73 3ks0 s SER 28 CO -0.02 -0.27 0.93 2.30 1.20 0.00 0.00 173.24 177.38 3ks0 n ILE 29 N 2.96 0.10 -0.61 6.45 -5.35 -1.26 -3.21 119.36 118.43 3ks0 n ILE 29 Ca 0.05 -0.07 -0.15 0.00 -0.27 0.00 0.00 62.75 62.30 3ks0 n ILE 29 Cb 0.47 -0.09 0.15 0.00 -1.74 0.00 0.00 39.64 38.43 3ks0 n ILE 29 CO 0.00 0.00 0.00 0.35 -1.76 0.00 0.00 176.55 175.14 3ks0 n THR 30 N -0.26 2.56 0.00 7.28 -2.24 -1.26 -4.31 114.28 116.05 3ks0 n THR 30 Ca 0.02 -1.37 0.00 0.00 -2.27 0.00 0.00 64.05 60.43 3ks0 n THR 30 Cb 0.11 -0.58 0.00 0.00 -2.10 0.00 0.00 70.33 67.75 3ks0 n THR 30 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3ks0 n SER 31 N -0.59 1.49 0.00 3.42 7.64 -1.20 -4.86 113.62 119.53 3ks0 n SER 31 Ca 0.42 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.30 3ks0 n SER 31 Cb 1.32 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.52 3ks0 n SER 31 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ks0 n GLY 32 N 2.90 3.76 3.46 0.23 0.00 -1.26 -4.83 105.19 109.44 3ks0 n GLY 32 Ca 0.00 -1.95 -0.34 0.00 0.00 0.00 0.00 46.02 43.74 3ks0 n GLY 32 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ks0 s TYR 33 N 2.11 2.99 -0.17 1.61 1.51 -0.49 -1.67 117.35 123.24 3ks0 s TYR 33 Ca 0.00 -0.43 -0.04 0.00 -1.01 0.00 0.00 57.07 55.59 3ks0 s TYR 33 Cb 0.00 -1.97 -0.03 0.00 -0.11 0.00 0.00 41.96 39.85 3ks0 s TYR 33 CO 0.00 -0.13 -0.02 -1.58 -1.11 0.00 0.00 175.55 172.71 3ks0 s TRP 34 N 0.53 3.05 0.09 2.71 0.52 -0.69 -0.62 118.94 124.54 3ks0 s TRP 34 Ca -0.04 -0.30 -0.07 0.00 0.02 0.00 0.00 56.10 55.72 3ks0 s TRP 34 Cb -0.15 -1.99 -0.01 0.00 -1.15 0.00 0.00 33.47 30.17 3ks0 s TRP 34 CO 0.03 -0.06 0.15 0.54 0.02 0.00 0.00 176.95 177.63 3ks0 s ASN 35 N 0.48 0.20 -0.12 2.95 6.03 -0.84 -0.60 114.94 123.05 3ks0 s ASN 35 Ca -0.02 -0.77 -0.04 0.00 -1.03 0.00 0.00 52.86 51.00 3ks0 s ASN 35 Cb -0.14 0.32 -0.03 0.00 -3.03 0.00 0.00 41.25 38.36 3ks0 s ASN 35 CO 0.02 -0.72 0.02 0.26 -2.03 0.00 0.00 177.10 174.66 3ks0 s TRP 36 N -3.89 3.21 0.03 1.54 0.52 -0.66 -1.76 118.94 117.93 3ks0 s TRP 36 Ca 0.07 0.14 0.03 0.00 0.02 0.00 0.00 56.10 56.36 3ks0 s TRP 36 Cb 0.06 -1.88 -0.02 0.00 -1.15 0.00 0.00 33.47 30.48 3ks0 s TRP 36 CO -0.09 0.37 -0.08 0.42 0.02 0.00 0.00 176.95 177.59 3ks0 s ILE 37 N -0.49 0.62 0.10 2.03 -1.09 -0.17 -1.23 121.20 120.96 3ks0 s ILE 37 Ca 0.09 -0.78 0.09 0.00 -2.23 0.00 0.00 60.65 57.83 3ks0 s ILE 37 Cb -0.12 -0.61 -0.04 0.00 -1.58 0.00 0.00 42.46 40.11 3ks0 s ILE 37 CO 0.02 -0.13 -0.20 -0.13 -1.23 0.00 0.00 174.94 173.27 3ks0 s ARG 38 N -1.00 1.76 -0.18 2.79 0.52 -0.06 -0.03 118.95 122.75 3ks0 s ARG 38 Ca -0.04 -1.18 0.01 0.00 -0.52 0.00 0.00 55.73 54.01 3ks0 s ARG 38 Cb -0.07 -2.08 0.03 0.00 0.52 0.00 0.00 34.95 33.35 3ks0 s ARG 38 CO 0.00 0.49 -0.15 0.21 0.02 0.00 0.00 175.30 175.87 3ks0 s LYS 39 N -1.97 2.45 0.50 3.54 2.36 -0.41 -0.84 119.74 125.38 3ks0 s LYS 39 Ca 0.16 -0.75 -0.15 0.00 -2.55 0.00 0.00 55.97 52.68 3ks0 s LYS 39 Cb -0.10 -2.37 -0.07 0.00 -1.05 0.00 0.00 37.83 34.24 3ks0 s LYS 39 CO 0.08 -0.29 0.95 -0.06 1.55 0.00 0.00 175.35 177.58 3ks0 s PHE 40 N 1.38 3.47 0.13 4.03 0.40 -1.06 -1.34 117.98 124.99 3ks0 s PHE 40 Ca 0.03 1.36 -0.34 0.00 -0.60 0.00 0.00 56.93 57.39 3ks0 s PHE 40 Cb -0.14 -2.71 -0.13 0.00 0.51 0.00 0.00 43.02 40.54 3ks0 s PHE 40 CO -0.11 -0.34 1.64 -0.35 0.70 0.00 0.00 175.22 176.76 3ks0 n PRO 41 N -1.63 2.24 -1.40 0.24 -0.04 -1.26 -1.38 135.00 131.77 3ks0 n PRO 41 Ca 0.06 0.81 -0.03 0.00 -0.04 0.00 0.00 63.50 64.30 3ks0 n PRO 41 Cb 0.54 -2.60 -0.00 0.00 -0.04 0.00 0.00 33.50 31.39 3ks0 n PRO 41 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3ks0 n GLY 42 N 3.63 -0.15 0.03 0.55 0.00 -1.26 -4.74 105.19 103.24 3ks0 n GLY 42 Ca 0.18 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.22 3ks0 n GLY 42 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ks0 n ASN 43 N -0.43 1.92 -0.71 1.61 5.03 -0.48 -5.13 115.26 117.07 3ks0 n ASN 43 Ca 0.01 -2.19 0.10 0.00 0.87 0.00 0.00 54.58 53.36 3ks0 n ASN 43 Cb 0.16 -0.10 -0.03 0.00 -1.02 0.00 0.00 39.78 38.79 3ks0 n ASN 43 CO 0.00 0.00 0.00 2.29 -1.83 0.00 0.00 177.26 177.72 3ks0 n LYS 44 N -0.68 -1.45 -2.65 3.52 -0.00 -1.25 -4.63 118.16 111.02 3ks0 n LYS 44 Ca 0.04 0.98 -0.32 0.00 -0.00 0.00 0.00 58.31 59.01 3ks0 n LYS 44 Cb 0.36 -1.76 -0.05 0.00 -0.00 0.00 0.00 35.03 33.58 3ks0 n LYS 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 3ks0 s LEU 45 N -4.85 3.80 -0.06 -5.58 1.43 -1.26 -2.56 118.68 109.60 3ks0 s LEU 45 Ca 0.00 1.59 -0.00 0.00 -1.03 0.00 0.00 54.13 54.69 3ks0 s LEU 45 Cb 0.00 -4.48 0.03 0.00 0.03 0.00 0.00 46.19 41.77 3ks0 s LEU 45 CO 0.00 -0.45 -0.02 -0.70 0.23 0.00 0.00 176.35 175.41 3ks0 s GLU 46 N -3.59 0.73 -0.16 1.70 2.12 -0.02 -4.98 118.70 114.50 3ks0 s GLU 46 Ca 0.60 0.00 -0.29 0.00 0.36 0.00 0.00 54.97 55.64 3ks0 s GLU 46 Cb -0.10 -0.93 -0.04 0.00 0.26 0.00 0.00 34.13 33.33 3ks0 s GLU 46 CO 0.22 -0.20 1.65 -0.47 -0.54 0.00 0.00 175.26 175.91 3ks0 s TYR 47 N 1.49 2.03 -0.02 5.30 5.04 -1.26 -0.88 117.35 129.05 3ks0 s TYR 47 Ca -0.02 0.43 -0.05 0.00 -2.44 0.00 0.00 57.07 54.99 3ks0 s TYR 47 Cb -0.13 -3.95 -0.03 0.00 0.35 0.00 0.00 41.96 38.21 3ks0 s TYR 47 CO -0.03 -3.29 0.39 0.52 -1.34 0.00 0.00 175.55 171.80 3ks0 h MET 48 N 10.45 -0.17 0.00 4.97 2.86 -1.53 -3.42 114.93 128.09 3ks0 h MET 48 Ca -0.36 0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.29 3ks0 h MET 48 Cb 1.16 0.04 0.00 0.00 0.06 0.00 0.00 31.60 32.86 3ks0 h MET 48 CO 0.98 -0.11 0.00 0.41 1.06 0.00 0.00 176.91 179.25 3ks0 n GLY 49 N 0.91 -1.47 3.41 8.32 0.00 -1.20 -1.14 105.19 114.02 3ks0 n GLY 49 Ca -0.02 -1.08 -0.10 0.00 0.00 0.00 0.00 46.02 44.82 3ks0 n GLY 49 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ks0 s TYR 50 N -2.83 0.42 -0.02 1.61 -0.85 1.00 -1.65 117.35 115.01 3ks0 s TYR 50 Ca 0.00 -0.77 0.04 0.00 -0.52 0.00 0.00 57.07 55.82 3ks0 s TYR 50 Cb 0.00 0.00 -0.00 0.00 0.38 0.00 0.00 41.96 42.34 3ks0 s TYR 50 CO 0.00 -0.81 -0.13 -1.50 -1.52 0.00 0.00 175.55 171.59 3ks0 s ILE 51 N -3.99 1.09 0.88 -3.49 2.07 0.24 -1.12 121.20 116.87 3ks0 s ILE 51 Ca 0.20 -0.55 -0.12 0.00 -1.41 0.00 0.00 60.65 58.77 3ks0 s ILE 51 Cb 0.02 -0.93 0.12 0.00 0.13 0.00 0.00 42.46 41.80 3ks0 s ILE 51 CO 0.04 0.32 1.15 -0.94 -1.91 0.00 0.00 174.94 173.59 3ks0 s SER 52 N -0.06 3.83 0.00 4.50 1.04 0.20 -1.70 113.70 121.51 3ks0 s SER 52 Ca 0.00 0.93 0.05 0.00 0.48 0.00 0.00 55.95 57.41 3ks0 s SER 52 Cb -0.08 -1.50 0.21 0.00 0.10 0.00 0.00 66.02 64.75 3ks0 s SER 52 CO 0.01 -2.35 1.14 0.00 0.98 0.00 0.00 173.24 173.02 3ks0 n TYR 53 N -3.63 0.00 -0.72 5.02 0.18 -0.67 -1.65 117.16 115.69 3ks0 n TYR 53 Ca 0.07 0.00 0.08 0.00 1.88 0.00 0.00 57.90 59.93 3ks0 n TYR 53 Cb 0.60 -0.48 0.25 0.00 -0.38 0.00 0.00 39.34 39.32 3ks0 n TYR 53 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3ks0 n GLY 54 N -0.99 3.50 3.18 -7.48 0.00 -1.26 -4.57 105.19 97.58 3ks0 n GLY 54 Ca 0.01 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.21 3ks0 n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ks0 n GLY 55 N -0.01 0.81 3.74 -0.02 0.00 -0.66 -5.01 105.19 104.04 3ks0 n GLY 55 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3ks0 n GLY 55 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ks0 s SER 56 N -2.81 6.59 0.21 1.61 0.01 -1.26 -4.57 113.70 113.48 3ks0 s SER 56 Ca 0.00 2.70 0.06 0.00 1.31 0.00 0.00 55.95 60.03 3ks0 s SER 56 Cb 0.00 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.57 3ks0 s SER 56 CO 0.00 -0.77 0.15 0.42 0.41 0.00 0.00 173.24 173.46 3ks0 s THR 57 N 0.27 4.38 -0.13 1.44 -4.23 -1.26 0.58 115.64 116.69 3ks0 s THR 57 Ca 0.63 -1.30 -0.07 0.00 -1.18 0.00 0.00 61.69 59.76 3ks0 s THR 57 Cb -0.43 -3.31 0.05 0.00 1.34 0.00 0.00 72.50 70.15 3ks0 s THR 57 CO 0.41 -0.25 0.32 -0.47 -0.54 0.00 0.00 174.62 174.09 3ks0 s TYR 58 N -1.97 -0.44 0.03 3.99 5.04 -0.28 -4.98 117.35 118.74 3ks0 s TYR 58 Ca 0.32 0.99 0.09 0.00 -2.44 0.00 0.00 57.07 56.03 3ks0 s TYR 58 Cb -0.09 0.14 -0.03 0.00 0.35 0.00 0.00 41.96 42.34 3ks0 s TYR 58 CO 0.24 -0.27 -0.26 0.71 -1.34 0.00 0.00 175.55 174.63 3ks0 s TYR 59 N 1.19 2.33 0.15 4.97 4.12 -1.26 -0.00 117.35 128.85 3ks0 s TYR 59 Ca -0.08 -0.41 -0.31 0.00 0.02 0.00 0.00 57.07 56.28 3ks0 s TYR 59 Cb -0.09 -1.42 -0.18 0.00 -1.52 0.00 0.00 41.96 38.76 3ks0 s TYR 59 CO -0.09 0.10 0.71 -1.71 0.02 0.00 0.00 175.55 174.58 3ks0 n ASN 60 N 1.91 -0.67 0.11 2.29 2.85 -0.30 -4.81 115.26 116.65 3ks0 n ASN 60 Ca -0.17 1.14 0.11 0.00 -0.11 0.00 0.00 54.58 55.55 3ks0 n ASN 60 Cb 0.52 -0.97 0.47 0.00 1.24 0.00 0.00 39.78 41.03 3ks0 n ASN 60 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3ks0 n PRO 61 N 1.15 0.16 -0.00 1.20 -0.04 -1.26 -1.59 135.00 134.62 3ks0 n PRO 61 Ca 0.18 0.42 0.15 0.00 -0.04 0.00 0.00 63.50 64.21 3ks0 n PRO 61 Cb 0.21 -1.82 0.80 0.00 -0.04 0.00 0.00 33.50 32.65 3ks0 n PRO 61 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 3ks0 n SER 62 N -2.13 0.45 0.00 3.54 7.64 -1.26 -4.19 113.62 117.66 3ks0 n SER 62 Ca 0.02 -1.17 0.00 0.00 1.01 0.00 0.00 58.87 58.73 3ks0 n SER 62 Cb 0.20 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.40 3ks0 n SER 62 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 3ks0 n LEU 63 N -0.64 0.00 -0.34 -3.43 4.77 -0.62 -4.86 117.00 111.87 3ks0 n LEU 63 Ca 0.22 -0.13 0.17 0.00 -0.03 0.00 0.00 56.01 56.24 3ks0 n LEU 63 Cb 0.18 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 41.60 3ks0 n LEU 63 CO 0.17 0.00 0.83 -0.33 -1.33 0.00 0.00 177.39 176.73 3ks0 h GLU 64 N 0.00 0.01 0.00 3.23 5.08 -1.64 0.29 114.58 121.55 3ks0 h GLU 64 Ca 0.00 -0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 3ks0 h GLU 64 Cb 0.00 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3ks0 h GLU 64 CO 0.00 0.00 -0.28 0.66 -1.00 0.00 0.00 179.01 178.40 3ks0 h SER 65 N 0.01 0.00 0.00 1.42 4.64 -1.89 -3.34 113.55 114.38 3ks0 h SER 65 Ca 0.63 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 61.63 3ks0 h SER 65 Cb 1.36 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.39 3ks0 h SER 65 CO -0.91 0.28 -2.15 0.54 -0.87 0.00 0.00 176.83 173.71 3ks0 n ARG 66 N -4.11 0.47 -2.58 4.77 1.74 0.73 -5.00 116.66 112.69 3ks0 n ARG 66 Ca -0.02 0.15 -0.34 0.00 -0.77 0.00 0.00 57.85 56.88 3ks0 n ARG 66 Cb 0.33 -1.33 -0.04 0.00 -1.02 0.00 0.00 32.46 30.40 3ks0 n ARG 66 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 3ks0 s ILE 67 N -2.39 3.94 -0.16 0.55 2.07 0.51 -3.42 121.20 122.30 3ks0 s ILE 67 Ca -0.28 1.18 -0.07 0.00 -1.41 0.00 0.00 60.65 60.08 3ks0 s ILE 67 Cb 0.09 -3.48 0.07 0.00 0.13 0.00 0.00 42.46 39.26 3ks0 s ILE 67 CO 0.42 -0.28 0.35 -0.55 -1.91 0.00 0.00 174.94 172.96 3ks0 s SER 68 N -2.09 -0.15 -0.24 4.50 0.15 -0.57 -4.86 113.70 110.45 3ks0 s SER 68 Ca 0.66 0.78 -0.02 0.00 0.70 0.00 0.00 55.95 58.07 3ks0 s SER 68 Cb -0.15 0.87 0.02 0.00 -1.71 0.00 0.00 66.02 65.06 3ks0 s SER 68 CO 0.19 -0.21 -0.06 -0.63 1.20 0.00 0.00 173.24 173.73 3ks0 s ILE 69 N 2.05 2.91 0.51 6.45 1.01 -1.26 -1.24 121.20 131.63 3ks0 s ILE 69 Ca -0.04 -0.94 0.03 0.00 0.00 0.00 0.00 60.65 59.70 3ks0 s ILE 69 Cb -0.11 -2.44 -0.01 0.00 0.01 0.00 0.00 42.46 39.91 3ks0 s ILE 69 CO -0.11 0.25 0.11 0.42 0.00 0.00 0.00 174.94 175.61 3ks0 s THR 70 N 1.35 1.40 0.19 2.92 -4.23 -1.09 -4.94 115.64 111.24 3ks0 s THR 70 Ca 0.01 -1.86 -0.18 0.00 -1.18 0.00 0.00 61.69 58.49 3ks0 s THR 70 Cb -0.16 -2.25 0.03 0.00 1.34 0.00 0.00 72.50 71.46 3ks0 s THR 70 CO -0.05 0.00 0.53 0.00 -0.54 0.00 0.00 174.62 174.56 3ks0 s ARG 71 N -3.97 1.37 -0.37 3.99 1.70 -1.26 0.17 118.95 120.59 3ks0 s ARG 71 Ca 0.16 -0.83 0.04 0.00 -0.47 0.00 0.00 55.73 54.64 3ks0 s ARG 71 Cb 0.01 0.53 0.16 0.00 -0.57 0.00 0.00 34.95 35.08 3ks0 s ARG 71 CO 0.09 -0.58 0.46 0.34 -1.08 0.00 0.00 175.30 174.53 3ks0 s ASP 72 N -2.86 0.19 0.41 -2.89 2.15 -0.64 -4.98 116.67 108.05 3ks0 s ASP 72 Ca 0.08 -1.11 0.19 0.00 0.43 0.00 0.00 52.55 52.14 3ks0 s ASP 72 Cb -0.01 1.09 1.11 0.00 -0.30 0.00 0.00 42.92 44.81 3ks0 s ASP 72 CO -0.04 -0.25 1.81 0.71 -0.17 0.00 0.00 175.17 177.23 3ks0 h THR 73 N 5.25 0.59 -0.70 1.71 1.35 -1.96 -1.65 112.91 117.50 3ks0 h THR 73 Ca 0.03 -0.13 0.15 0.00 -0.55 0.00 0.00 66.41 65.90 3ks0 h THR 73 Cb 1.11 0.17 -0.10 0.00 -1.73 0.00 0.00 68.15 67.59 3ks0 h THR 73 CO 0.18 0.07 0.16 0.28 -0.25 0.00 0.00 175.52 175.96 3ks0 h SER 74 N 0.39 0.01 0.15 5.36 0.02 -1.96 0.34 113.55 117.85 3ks0 h SER 74 Ca 0.54 0.14 0.00 0.00 -0.84 0.00 0.00 61.79 61.62 3ks0 h SER 74 Cb 1.38 0.19 0.00 0.00 0.14 0.00 0.00 62.40 64.11 3ks0 h SER 74 CO -0.23 -0.02 -0.25 0.29 -1.14 0.00 0.00 176.83 175.48 3ks0 n LYS 75 N -5.15 1.06 -3.60 3.45 5.02 -0.66 -4.97 118.16 113.31 3ks0 n LYS 75 Ca 0.13 -0.69 -0.28 0.00 -2.02 0.00 0.00 58.31 55.45 3ks0 n LYS 75 Cb 0.42 -1.49 0.05 0.00 -0.02 0.00 0.00 35.03 33.99 3ks0 n LYS 75 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 3ks0 n ASN 76 N -0.37 -5.41 -3.96 4.39 2.85 0.12 -4.85 115.26 108.03 3ks0 n ASN 76 Ca 0.13 -0.95 -0.09 0.00 -0.11 0.00 0.00 54.58 53.55 3ks0 n ASN 76 Cb 0.38 -3.76 -0.10 0.00 1.24 0.00 0.00 39.78 37.54 3ks0 n ASN 76 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 3ks0 s GLN 77 N -5.67 0.51 0.46 1.20 -2.07 -1.22 -3.12 119.66 109.74 3ks0 s GLN 77 Ca 0.45 -0.74 0.02 0.00 -1.82 0.00 0.00 55.36 53.27 3ks0 s GLN 77 Cb -0.14 0.19 0.02 0.00 -1.09 0.00 0.00 33.01 31.99 3ks0 s GLN 77 CO 0.84 -0.11 0.16 2.48 -1.32 0.00 0.00 175.29 177.34 3ks0 n TYR 78 N 0.97 0.24 -3.88 9.60 -0.00 -1.11 -1.63 117.16 121.35 3ks0 n TYR 78 Ca -0.20 -2.11 -0.10 0.00 -0.00 0.00 0.00 57.90 55.49 3ks0 n TYR 78 Cb 0.58 -0.34 -0.09 0.00 -0.00 0.00 0.00 39.34 39.48 3ks0 n TYR 78 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.86 177.57 3ks0 s TYR 79 N -2.49 0.09 -0.07 -3.48 1.51 0.13 -1.48 117.35 111.56 3ks0 s TYR 79 Ca 0.12 -0.28 0.04 0.00 -1.01 0.00 0.00 57.07 55.95 3ks0 s TYR 79 Cb -0.01 -0.07 -0.00 0.00 -0.11 0.00 0.00 41.96 41.77 3ks0 s TYR 79 CO 0.08 -0.34 -0.20 -1.17 -1.11 0.00 0.00 175.55 172.81 3ks0 s LEU 80 N -1.75 1.95 -0.03 -1.29 2.96 0.93 -2.66 118.68 118.79 3ks0 s LEU 80 Ca -0.10 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.42 3ks0 s LEU 80 Cb -0.04 -1.16 -0.01 0.00 0.50 0.00 0.00 46.19 45.47 3ks0 s LEU 80 CO -0.01 0.15 -0.18 -1.58 -1.32 0.00 0.00 176.35 173.41 3ks0 s GLN 81 N 0.20 1.68 -0.24 1.98 0.74 -0.37 0.95 119.66 124.60 3ks0 s GLN 81 Ca -0.10 -0.63 -0.03 0.00 0.05 0.00 0.00 55.36 54.65 3ks0 s GLN 81 Cb -0.15 -1.52 0.11 0.00 1.10 0.00 0.00 33.01 32.55 3ks0 s GLN 81 CO 0.05 0.30 0.22 -1.17 -0.55 0.00 0.00 175.29 174.14 3ks0 s LEU 82 N -0.14 -0.02 0.00 3.68 0.20 -0.79 -1.51 118.68 120.10 3ks0 s LEU 82 Ca 0.00 -0.60 0.01 0.00 0.69 0.00 0.00 54.13 54.24 3ks0 s LEU 82 Cb -0.10 0.27 0.09 0.00 -0.43 0.00 0.00 46.19 46.01 3ks0 s LEU 82 CO 0.01 -0.37 0.61 -0.46 -0.29 0.00 0.00 176.35 175.86 3ks0 n ASN 83 N 5.30 0.98 -4.04 3.68 6.94 -1.22 -1.88 115.26 125.02 3ks0 n ASN 83 Ca -0.05 -1.79 -0.34 0.00 -0.02 0.00 0.00 54.58 52.38 3ks0 n ASN 83 Cb 0.47 -0.38 -0.02 0.00 -2.36 0.00 0.00 39.78 37.49 3ks0 n ASN 83 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 3ks0 n SER 84 N -2.86 -1.99 -4.76 0.53 7.64 -0.83 -4.86 113.62 106.49 3ks0 n SER 84 Ca 0.11 -1.17 -0.40 0.00 1.01 0.00 0.00 58.87 58.41 3ks0 n SER 84 Cb 0.38 -2.33 -0.04 0.00 -1.01 0.00 0.00 64.21 61.22 3ks0 n SER 84 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3ks0 s VAL 85 N -3.86 3.29 0.20 0.44 1.01 -0.85 -4.80 120.40 115.84 3ks0 s VAL 85 Ca 0.23 1.29 0.07 0.00 0.00 0.00 0.00 61.98 63.57 3ks0 s VAL 85 Cb -0.11 -3.82 -0.05 0.00 0.00 0.00 0.00 36.38 32.40 3ks0 s VAL 85 CO 0.94 0.30 -0.13 0.28 0.00 0.00 0.00 175.10 176.49 3ks0 s THR 86 N -1.11 1.64 0.34 3.92 -1.32 -1.26 -1.17 115.64 116.68 3ks0 s THR 86 Ca 0.46 -2.18 0.26 0.00 -1.21 0.00 0.00 61.69 59.02 3ks0 s THR 86 Cb -0.34 -2.05 0.40 0.00 -1.51 0.00 0.00 72.50 69.00 3ks0 s THR 86 CO 0.44 -0.59 1.15 0.41 -2.21 0.00 0.00 174.62 173.82 3ks0 n THR 87 N -0.37 -0.15 0.67 5.08 -1.04 -1.26 0.13 114.28 117.33 3ks0 n THR 87 Ca -0.08 1.29 0.12 0.00 -2.04 0.00 0.00 64.05 63.34 3ks0 n THR 87 Cb 0.61 -2.12 0.47 0.00 -1.82 0.00 0.00 70.33 67.46 3ks0 n THR 87 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 3ks0 n GLU 88 N -4.03 0.11 0.00 -2.82 -0.58 -1.26 -2.45 120.64 109.60 3ks0 n GLU 88 Ca 0.30 0.20 0.14 0.00 -0.42 0.00 0.00 57.16 57.38 3ks0 n GLU 88 Cb 1.22 -1.65 0.58 0.00 -0.57 0.00 0.00 31.44 31.02 3ks0 n GLU 88 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 3ks0 n ASP 89 N -1.85 0.52 -4.64 1.62 8.00 0.34 -4.86 116.55 115.68 3ks0 n ASP 89 Ca 0.05 -0.59 -0.42 0.00 0.71 0.00 0.00 54.79 54.54 3ks0 n ASP 89 Cb 0.30 -0.06 -0.03 0.00 -0.02 0.00 0.00 41.12 41.32 3ks0 n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3ks0 s THR 90 N -2.49 3.13 0.01 -3.53 2.01 -1.03 -4.85 115.64 108.89 3ks0 s THR 90 Ca 0.28 0.15 -0.29 0.00 0.31 0.00 0.00 61.69 62.15 3ks0 s THR 90 Cb 0.20 -3.12 0.10 0.00 0.01 0.00 0.00 72.50 69.70 3ks0 s THR 90 CO 0.48 -0.04 1.25 0.00 -0.69 0.00 0.00 174.62 175.63 3ks0 s ALA 91 N 5.43 -2.25 -0.16 7.40 0.00 -0.74 -4.40 121.76 127.06 3ks0 s ALA 91 Ca 0.88 0.29 -0.06 0.00 0.00 0.00 0.00 51.96 53.08 3ks0 s ALA 91 Cb -0.38 0.63 -0.04 0.00 0.00 0.00 0.00 23.12 23.34 3ks0 s ALA 91 CO 0.38 -1.10 0.03 0.95 0.00 0.00 0.00 175.76 176.03 3ks0 s THR 92 N -2.25 4.54 -0.12 0.00 -4.23 -0.45 0.02 115.64 113.14 3ks0 s THR 92 Ca 0.21 -0.13 -0.04 0.00 -1.18 0.00 0.00 61.69 60.55 3ks0 s THR 92 Cb 0.02 -3.01 -0.03 0.00 1.34 0.00 0.00 72.50 70.81 3ks0 s THR 92 CO -0.01 0.50 0.02 -0.31 -0.54 0.00 0.00 174.62 174.28 3ks0 s TYR 93 N 0.07 3.20 0.08 3.99 1.51 0.07 -1.28 117.35 124.98 3ks0 s TYR 93 Ca 0.04 0.12 0.09 0.00 -1.01 0.00 0.00 57.07 56.30 3ks0 s TYR 93 Cb -0.13 -1.89 -0.03 0.00 -0.11 0.00 0.00 41.96 39.80 3ks0 s TYR 93 CO 0.01 0.34 -0.24 -0.06 -1.11 0.00 0.00 175.55 174.50 3ks0 s PHE 94 N -0.42 2.05 0.07 2.71 0.40 0.95 -1.25 117.98 122.49 3ks0 s PHE 94 Ca 0.08 -0.39 0.05 0.00 -0.60 0.00 0.00 56.93 56.06 3ks0 s PHE 94 Cb -0.12 -1.18 -0.04 0.00 0.51 0.00 0.00 43.02 42.19 3ks0 s PHE 94 CO 0.02 0.18 -0.02 0.00 0.70 0.00 0.00 175.22 176.09 3ks0 s ALA 96 N -1.23 -0.82 0.16 0.00 0.00 -0.72 -0.33 121.76 118.82 3ks0 s ALA 96 Ca 0.23 0.03 0.03 0.00 0.00 0.00 0.00 51.96 52.25 3ks0 s ALA 96 Cb -0.11 0.46 -0.03 0.00 0.00 0.00 0.00 23.12 23.43 3ks0 s ALA 96 CO 0.15 -0.51 0.28 0.50 0.00 0.00 0.00 175.76 176.18 3ks0 s ARG 97 N -3.05 3.38 -0.21 0.00 3.52 0.49 -1.98 118.95 121.09 3ks0 s ARG 97 Ca -0.02 -0.65 -0.02 0.00 -0.13 0.00 0.00 55.73 54.91 3ks0 s ARG 97 Cb 0.01 -2.92 0.07 0.00 -1.56 0.00 0.00 34.95 30.54 3ks0 s ARG 97 CO -0.06 0.51 0.03 -1.17 -0.81 0.00 0.00 175.30 173.79 3ks0 s LEU 98 N -3.32 1.47 -1.09 -0.88 2.96 0.21 -2.60 118.68 115.44 3ks0 s LEU 98 Ca 0.34 -0.97 -0.26 0.00 -0.22 0.00 0.00 54.13 53.01 3ks0 s LEU 98 Cb -0.11 -0.70 -0.22 0.00 0.50 0.00 0.00 46.19 45.66 3ks0 s LEU 98 CO 0.28 -0.31 2.09 0.33 -1.32 0.00 0.00 176.35 177.42 3ks0 n PHE 99 N 4.98 1.13 -0.26 5.38 7.35 -1.06 -1.40 117.46 133.59 3ks0 n PHE 99 Ca -0.08 -0.34 -0.10 0.00 -0.76 0.00 0.00 57.45 56.17 3ks0 n PHE 99 Cb 0.46 -2.60 -0.01 0.00 0.35 0.00 0.00 39.48 37.68 3ks0 n PHE 99 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3ks0 n GLY 100 N 6.08 -0.17 4.34 7.13 0.00 -1.26 -0.87 105.19 120.44 3ks0 n GLY 100 Ca 0.42 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.54 3ks0 n GLY 100 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3ks0 n SER 101 N 0.31 0.00 -0.32 1.61 7.64 -1.26 -4.91 113.62 116.69 3ks0 n SER 101 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.91 3ks0 n SER 101 Cb 0.03 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.23 3ks0 n SER 101 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3ks0 n TYR 102 N 0.00 0.00 -1.55 1.43 0.53 -0.04 -5.10 117.16 112.42 3ks0 n TYR 102 Ca 0.00 0.00 -0.30 0.00 -1.02 0.00 0.00 57.90 56.58 3ks0 n TYR 102 Cb 0.00 0.00 0.08 0.00 -1.03 0.00 0.00 39.34 38.39 3ks0 n TYR 102 CO 0.00 0.00 0.00 1.52 -1.02 0.00 0.00 176.86 177.36 3ks0 s TYR 103 N 3.05 2.87 -0.60 -0.72 -0.85 -1.26 -4.68 117.35 115.15 3ks0 s TYR 103 Ca 0.00 1.20 -0.24 0.00 -0.52 0.00 0.00 57.07 57.51 3ks0 s TYR 103 Cb 0.00 -3.08 0.05 0.00 0.38 0.00 0.00 41.96 39.31 3ks0 s TYR 103 CO 0.00 -1.69 0.99 -0.06 -1.52 0.00 0.00 175.55 173.27 3ks0 s PHE 104 N -3.13 2.69 -0.24 -3.49 0.40 -1.26 -2.57 117.98 110.38 3ks0 s PHE 104 Ca 0.60 -0.17 -0.13 0.00 -0.60 0.00 0.00 56.93 56.64 3ks0 s PHE 104 Cb -0.14 -4.22 -0.04 0.00 0.51 0.00 0.00 43.02 39.12 3ks0 s PHE 104 CO 0.54 -1.53 0.27 0.16 0.70 0.00 0.00 175.22 175.36 3ks0 s ASP 105 N 3.20 6.20 0.00 1.36 1.47 -1.07 -4.90 116.67 122.93 3ks0 s ASP 105 Ca 0.29 0.22 0.00 0.00 1.18 0.00 0.00 52.55 54.24 3ks0 s ASP 105 Cb -0.13 -2.16 0.00 0.00 -0.34 0.00 0.00 42.92 40.29 3ks0 s ASP 105 CO 0.16 -0.04 0.00 -1.22 0.68 0.00 0.00 175.17 174.75 3ks0 n TYR 106 N 4.69 0.00 -4.15 2.11 4.01 -1.26 -3.52 117.16 119.05 3ks0 n TYR 106 Ca -0.12 0.00 -0.16 0.00 -0.16 0.00 0.00 57.90 57.46 3ks0 n TYR 106 Cb 0.52 -1.34 -0.12 0.00 -0.31 0.00 0.00 39.34 38.09 3ks0 n TYR 106 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 3ks0 s TRP 107 N 0.00 0.99 1.01 -0.72 0.52 -1.26 -0.38 118.94 119.10 3ks0 s TRP 107 Ca 0.00 -0.45 -0.17 0.00 0.02 0.00 0.00 56.10 55.50 3ks0 s TRP 107 Cb 0.00 -0.57 0.23 0.00 -1.15 0.00 0.00 33.47 31.98 3ks0 s TRP 107 CO 0.00 0.00 1.32 0.20 0.02 0.00 0.00 176.95 178.49 3ks0 s GLY 108 N -1.57 1.79 0.45 0.98 0.00 0.55 -4.56 107.32 104.96 3ks0 s GLY 108 Ca -0.04 -1.26 0.25 0.00 0.00 0.00 0.00 44.72 43.66 3ks0 s GLY 108 CO 0.01 -0.44 1.79 1.46 0.00 0.00 0.00 173.10 175.93 3ks0 h GLN 109 N -1.84 0.00 0.00 2.90 1.08 -1.90 -3.46 115.11 111.89 3ks0 h GLN 109 Ca -0.44 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.76 3ks0 h GLN 109 Cb 1.23 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.66 3ks0 h GLN 109 CO 0.33 0.16 0.00 0.41 -0.95 0.00 0.00 178.83 178.78 3ks0 n GLY 110 N 0.38 -0.66 2.93 3.46 0.00 -1.26 -5.02 105.19 105.01 3ks0 n GLY 110 Ca 0.01 -1.59 -0.21 0.00 0.00 0.00 0.00 46.02 44.23 3ks0 n GLY 110 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ks0 s THR 111 N -3.05 0.68 0.26 2.61 2.01 -0.38 -4.81 115.64 112.96 3ks0 s THR 111 Ca 0.00 -0.21 -0.29 0.00 0.31 0.00 0.00 61.69 61.50 3ks0 s THR 111 Cb 0.00 -0.67 -0.09 0.00 0.01 0.00 0.00 72.50 71.75 3ks0 s THR 111 CO 0.00 0.25 1.24 -0.89 -0.69 0.00 0.00 174.62 174.53 3ks0 s THR 112 N 0.84 3.18 -0.03 -0.82 2.01 -1.26 -0.75 115.64 118.81 3ks0 s THR 112 Ca -0.12 1.10 0.07 0.00 0.31 0.00 0.00 61.69 63.04 3ks0 s THR 112 Cb -0.15 -3.70 -0.01 0.00 0.01 0.00 0.00 72.50 68.65 3ks0 s THR 112 CO 0.01 0.22 -0.23 -0.22 -0.69 0.00 0.00 174.62 173.72 3ks0 s LEU 113 N -1.00 2.03 -0.08 4.42 2.96 0.10 -4.54 118.68 122.57 3ks0 s LEU 113 Ca 0.50 -0.42 0.04 0.00 -0.22 0.00 0.00 54.13 54.03 3ks0 s LEU 113 Cb -0.36 -1.19 0.00 0.00 0.50 0.00 0.00 46.19 45.14 3ks0 s LEU 113 CO 0.43 0.26 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.62 3ks0 s THR 114 N -0.42 1.84 -0.30 3.68 2.01 0.53 -1.79 115.64 121.20 3ks0 s THR 114 Ca 0.05 -0.91 -0.06 0.00 0.31 0.00 0.00 61.69 61.09 3ks0 s THR 114 Cb -0.10 -1.60 0.02 0.00 0.01 0.00 0.00 72.50 70.83 3ks0 s THR 114 CO 0.00 0.51 0.07 -0.69 -0.69 0.00 0.00 174.62 173.83 3ks0 s VAL 115 N 0.31 3.83 -0.20 3.82 1.01 -1.26 -1.30 120.40 126.60 3ks0 s VAL 115 Ca -0.15 -0.84 -0.27 0.00 0.00 0.00 0.00 61.98 60.72 3ks0 s VAL 115 Cb -0.17 -3.02 0.07 0.00 0.00 0.00 0.00 36.38 33.26 3ks0 s VAL 115 CO 0.07 0.02 0.72 -0.55 0.00 0.00 0.00 175.10 175.36 3ks0 s SER 116 N 1.46 -0.71 0.00 3.32 0.15 -1.13 -4.60 113.70 112.18 3ks0 s SER 116 Ca 0.01 1.21 0.24 0.00 0.70 0.00 0.00 55.95 58.11 3ks0 s SER 116 Cb -0.18 1.17 0.23 0.00 -1.71 0.00 0.00 66.02 65.53 3ks0 s SER 116 CO 0.02 -0.35 1.25 -1.54 1.20 0.00 0.00 173.24 173.82 3ks0 n SER 117 N 2.13 2.13 -4.55 5.45 3.41 -1.26 -4.25 113.62 116.68 3ks0 n SER 117 Ca -0.15 -1.57 -0.42 0.00 -0.26 0.00 0.00 58.87 56.48 3ks0 n SER 117 Cb 0.56 0.26 0.01 0.00 -0.26 0.00 0.00 64.21 64.78 3ks0 n SER 117 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3ks0 n ALA 118 N 0.29 -0.53 -2.90 7.33 0.00 -1.26 -5.00 120.51 118.44 3ks0 n ALA 118 Ca 0.12 0.20 -0.34 0.00 0.00 0.00 0.00 53.44 53.42 3ks0 n ALA 118 Cb 0.48 -1.96 -0.05 0.00 0.00 0.00 0.00 19.45 17.93 3ks0 n ALA 118 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3ks0 s LYS 119 N -1.85 3.44 -0.45 0.00 1.02 -1.26 -5.02 119.74 115.62 3ks0 s LYS 119 Ca 0.64 -0.30 -0.42 0.00 0.02 0.00 0.00 55.97 55.91 3ks0 s LYS 119 Cb -0.58 -3.11 -0.17 0.00 -0.52 0.00 0.00 37.83 33.45 3ks0 s LYS 119 CO 0.57 0.68 2.05 2.41 -0.92 0.00 0.00 175.35 180.14 3ks0 n THR 120 N 1.03 0.07 -4.10 2.17 -1.04 -1.26 -4.75 114.28 106.39 3ks0 n THR 120 Ca -0.12 -0.06 -0.27 0.00 -2.04 0.00 0.00 64.05 61.56 3ks0 n THR 120 Cb 0.53 -0.81 -0.17 0.00 -1.82 0.00 0.00 70.33 68.06 3ks0 n THR 120 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 3ks0 s THR 121 N 5.70 1.23 0.57 12.58 2.01 0.16 -4.93 115.64 132.97 3ks0 s THR 121 Ca 1.14 -0.44 -0.18 0.00 0.31 0.00 0.00 61.69 62.52 3ks0 s THR 121 Cb -1.33 -1.19 -0.04 0.00 0.01 0.00 0.00 72.50 69.95 3ks0 s THR 121 CO 0.64 0.40 1.09 -2.16 -0.69 0.00 0.00 174.62 173.91 3ks0 s PRO 122 N 1.41 3.29 0.34 4.92 0.04 -1.26 -0.38 135.00 143.36 3ks0 s PRO 122 Ca 0.01 1.43 -0.26 0.00 0.04 0.00 0.00 61.00 62.22 3ks0 s PRO 122 Cb -0.13 -2.01 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 3ks0 s PRO 122 CO -0.06 -0.87 0.98 -1.25 0.04 0.00 0.00 177.00 175.84 3ks0 s PRO 123 N -3.63 4.47 -0.46 0.56 0.04 -1.26 -4.47 135.00 130.25 3ks0 s PRO 123 Ca 0.69 1.39 -0.22 0.00 0.04 0.00 0.00 61.00 62.89 3ks0 s PRO 123 Cb -0.20 -2.73 0.03 0.00 0.04 0.00 0.00 34.50 31.63 3ks0 s PRO 123 CO 0.31 0.16 0.74 -1.12 0.04 0.00 0.00 177.00 177.14 3ks0 s SER 124 N -1.59 6.35 -0.19 6.66 0.01 0.15 -4.89 113.70 120.21 3ks0 s SER 124 Ca 0.52 -0.30 -0.17 0.00 1.31 0.00 0.00 55.95 57.31 3ks0 s SER 124 Cb -0.20 -2.36 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 3ks0 s SER 124 CO 0.25 -0.90 0.45 -0.69 0.41 0.00 0.00 173.24 172.76 3ks0 s VAL 125 N 3.14 5.16 -0.05 3.43 1.01 -1.26 -1.70 120.40 130.14 3ks0 s VAL 125 Ca 0.26 0.83 0.02 0.00 0.00 0.00 0.00 61.98 63.09 3ks0 s VAL 125 Cb -0.13 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.48 3ks0 s VAL 125 CO 0.20 0.24 -0.09 -0.31 0.00 0.00 0.00 175.10 175.14 3ks0 s TYR 126 N 1.32 1.09 0.08 5.22 2.02 -0.53 -4.96 117.35 121.59 3ks0 s TYR 126 Ca 0.22 -0.35 -0.28 0.00 -0.37 0.00 0.00 57.07 56.29 3ks0 s TYR 126 Cb -0.15 -0.83 -0.06 0.00 -0.40 0.00 0.00 41.96 40.52 3ks0 s TYR 126 CO 0.09 -0.20 0.89 -1.25 -1.57 0.00 0.00 175.55 173.51 3ks0 s PRO 127 N 0.61 4.62 -0.34 -1.71 0.04 -1.26 -0.89 135.00 136.08 3ks0 s PRO 127 Ca -0.11 1.31 -0.07 0.00 0.04 0.00 0.00 61.00 62.17 3ks0 s PRO 127 Cb -0.14 -3.38 0.03 0.00 0.04 0.00 0.00 34.50 31.06 3ks0 s PRO 127 CO 0.02 0.22 0.12 -0.51 0.04 0.00 0.00 177.00 176.89 3ks0 s LEU 128 N 0.03 4.30 0.02 -3.56 1.43 0.13 -4.91 118.68 116.12 3ks0 s LEU 128 Ca 0.44 -1.02 0.07 0.00 -1.03 0.00 0.00 54.13 52.59 3ks0 s LEU 128 Cb -0.22 -1.90 -0.02 0.00 0.03 0.00 0.00 46.19 44.07 3ks0 s LEU 128 CO 0.27 -0.31 -0.21 0.00 0.23 0.00 0.00 176.35 176.33 3ks0 s ALA 129 N 1.45 1.81 0.10 4.21 0.00 -1.26 -0.83 121.76 127.25 3ks0 s ALA 129 Ca -0.00 -1.03 -0.15 0.00 0.00 0.00 0.00 51.96 50.78 3ks0 s ALA 129 Cb -0.19 -0.40 -0.07 0.00 0.00 0.00 0.00 23.12 22.47 3ks0 s ALA 129 CO 0.03 0.42 1.47 -1.35 0.00 0.00 0.00 175.76 176.33 3ks0 h PRO 130 N 5.14 0.69 0.00 0.00 0.11 -1.92 -3.45 132.00 132.57 3ks0 h PRO 130 Ca -0.42 -0.31 0.00 0.00 0.11 0.00 0.00 66.00 65.38 3ks0 h PRO 130 Cb 1.15 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.24 3ks0 h PRO 130 CO 0.45 0.91 0.00 0.41 -0.21 0.00 0.00 178.00 179.56 3ks0 n GLY 131 N -0.01 -0.56 0.21 -0.55 0.00 -1.26 -4.89 105.19 98.12 3ks0 n GLY 131 Ca -0.03 0.35 -0.05 0.00 0.00 0.00 0.00 46.02 46.29 3ks0 n GLY 131 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ks0 n SER 138 N 0.00 -0.52 -4.42 1.61 2.88 -1.26 -3.11 113.62 108.79 3ks0 n SER 138 Ca 0.00 0.95 -0.32 0.00 -1.33 0.00 0.00 58.87 58.17 3ks0 n SER 138 Cb 0.00 -0.15 -0.14 0.00 -0.75 0.00 0.00 64.21 63.17 3ks0 n SER 138 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3ks0 s MET 139 N -4.98 2.39 -0.02 -1.46 1.00 -1.26 0.17 119.30 115.14 3ks0 s MET 139 Ca -0.06 -0.77 0.01 0.00 0.00 0.00 0.00 55.69 54.87 3ks0 s MET 139 Cb 0.05 -2.27 -0.03 0.00 0.00 0.00 0.00 34.83 32.58 3ks0 s MET 139 CO 0.31 0.60 -0.02 0.54 0.00 0.00 0.00 175.02 176.44 3ks0 s VAL 140 N -0.68 4.04 -0.26 -6.03 0.11 0.27 -4.73 120.40 113.13 3ks0 s VAL 140 Ca 0.11 -0.55 0.02 0.00 -2.93 0.00 0.00 61.98 58.63 3ks0 s VAL 140 Cb -0.11 -2.76 0.06 0.00 -1.53 0.00 0.00 36.38 32.05 3ks0 s VAL 140 CO 0.00 0.45 -0.08 -0.89 -3.33 0.00 0.00 175.10 171.24 3ks0 s THR 141 N -1.00 2.00 0.20 5.04 2.01 -1.26 -0.98 115.64 121.64 3ks0 s THR 141 Ca 0.17 -1.58 0.04 0.00 0.31 0.00 0.00 61.69 60.64 3ks0 s THR 141 Cb -0.11 -2.18 -0.03 0.00 0.01 0.00 0.00 72.50 70.19 3ks0 s THR 141 CO 0.07 -0.09 0.28 -0.76 -0.69 0.00 0.00 174.62 173.43 3ks0 s LEU 142 N 1.17 4.19 0.29 4.42 1.02 0.08 -4.55 118.68 125.29 3ks0 s LEU 142 Ca -0.07 0.03 -0.05 0.00 0.02 0.00 0.00 54.13 54.07 3ks0 s LEU 142 Cb -0.20 -2.75 -0.01 0.00 0.02 0.00 0.00 46.19 43.26 3ks0 s LEU 142 CO -0.06 -0.00 0.42 -0.83 0.02 0.00 0.00 176.35 175.90 3ks0 s GLY 143 N -3.57 1.21 -0.12 -3.19 0.00 -0.01 -1.43 107.32 100.22 3ks0 s GLY 143 Ca 0.34 -1.36 -0.05 0.00 0.00 0.00 0.00 44.72 43.65 3ks0 s GLY 143 CO 0.27 -0.96 0.25 0.00 0.00 0.00 0.00 173.10 172.66 3ks0 s LEU 145 N 1.90 5.37 -0.59 0.00 2.96 -0.07 -0.98 118.68 127.28 3ks0 s LEU 145 Ca -0.03 -1.20 -0.19 0.00 -0.22 0.00 0.00 54.13 52.49 3ks0 s LEU 145 Cb -0.11 -2.31 0.11 0.00 0.50 0.00 0.00 46.19 44.38 3ks0 s LEU 145 CO -0.08 -0.82 0.70 -0.69 -1.32 0.00 0.00 176.35 174.14 3ks0 s VAL 146 N 2.16 4.84 -0.13 1.68 1.01 0.34 -1.45 120.40 128.84 3ks0 s VAL 146 Ca 0.09 -1.03 0.01 0.00 0.00 0.00 0.00 61.98 61.06 3ks0 s VAL 146 Cb -0.23 -4.49 -0.01 0.00 0.00 0.00 0.00 36.38 31.66 3ks0 s VAL 146 CO 0.08 -1.12 -0.17 -0.75 0.00 0.00 0.00 175.10 173.15 3ks0 s LYS 147 N 2.63 3.24 0.00 2.72 2.20 -0.69 -0.26 119.74 129.58 3ks0 s LYS 147 Ca 0.11 -0.76 0.00 0.00 -0.36 0.00 0.00 55.97 54.96 3ks0 s LYS 147 Cb -0.24 -2.55 0.00 0.00 -1.51 0.00 0.00 37.83 33.53 3ks0 s LYS 147 CO 0.06 0.13 0.00 0.41 -0.36 0.00 0.00 175.35 175.59 3ks0 n GLY 148 N 3.73 0.70 3.40 5.54 0.00 0.28 0.34 105.19 119.18 3ks0 n GLY 148 Ca -0.19 -0.39 -0.24 0.00 0.00 0.00 0.00 46.02 45.20 3ks0 n GLY 148 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3ks0 s TYR 149 N -2.61 2.13 -0.26 1.61 1.13 -0.80 -4.19 117.35 114.35 3ks0 s TYR 149 Ca 0.00 -0.40 -0.23 0.00 -1.41 0.00 0.00 57.07 55.03 3ks0 s TYR 149 Cb 0.00 -1.03 0.07 0.00 -1.10 0.00 0.00 41.96 39.90 3ks0 s TYR 149 CO 0.00 0.48 0.69 0.12 -2.51 0.00 0.00 175.55 174.33 3ks0 s PHE 150 N -2.00 -0.78 0.00 -3.49 2.19 0.49 -1.60 117.98 112.80 3ks0 s PHE 150 Ca 0.21 1.86 0.00 0.00 0.33 0.00 0.00 56.93 59.33 3ks0 s PHE 150 Cb -0.06 0.29 0.00 0.00 -1.31 0.00 0.00 43.02 41.93 3ks0 s PHE 150 CO 0.10 -0.38 0.00 -0.35 1.83 0.00 0.00 175.22 176.42 3ks0 n PRO 151 N 2.84 0.58 -1.96 10.12 -0.04 -1.26 -0.67 135.00 144.61 3ks0 n PRO 151 Ca -0.14 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.01 3ks0 n PRO 151 Cb 0.55 0.00 0.02 0.00 -0.04 0.00 0.00 33.50 34.04 3ks0 n PRO 151 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 3ks0 s GLU 152 N -2.08 3.33 0.33 0.54 2.02 -1.26 -4.79 118.70 116.79 3ks0 s GLU 152 Ca 0.00 0.58 0.05 0.00 0.02 0.00 0.00 54.97 55.61 3ks0 s GLU 152 Cb 0.00 -2.09 0.05 0.00 0.10 0.00 0.00 34.13 32.18 3ks0 s GLU 152 CO 0.00 -0.70 0.39 -0.35 0.02 0.00 0.00 175.26 174.62 3ks0 n PRO 153 N -2.78 0.86 -4.45 0.39 -0.04 -1.26 -5.01 135.00 122.71 3ks0 n PRO 153 Ca 0.06 -1.90 -0.24 0.00 -0.04 0.00 0.00 63.50 61.37 3ks0 n PRO 153 Cb 0.55 -0.01 -0.11 0.00 -0.04 0.00 0.00 33.50 33.89 3ks0 n PRO 153 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 3ks0 s VAL 154 N -1.29 2.39 -0.18 0.52 -7.23 -1.26 -4.49 120.40 108.87 3ks0 s VAL 154 Ca 0.29 -2.28 0.01 0.00 -1.81 0.00 0.00 61.98 58.19 3ks0 s VAL 154 Cb -0.02 -2.23 0.02 0.00 0.56 0.00 0.00 36.38 34.71 3ks0 s VAL 154 CO 0.19 -0.33 -0.20 0.42 -0.31 0.00 0.00 175.10 174.87 3ks0 s THR 155 N -2.29 2.05 -0.12 5.32 -4.23 -0.01 -5.00 115.64 111.36 3ks0 s THR 155 Ca 0.27 -0.93 0.02 0.00 -1.18 0.00 0.00 61.69 59.86 3ks0 s THR 155 Cb -0.06 -1.85 -0.00 0.00 1.34 0.00 0.00 72.50 71.93 3ks0 s THR 155 CO 0.13 0.54 -0.19 -0.69 -0.54 0.00 0.00 174.62 173.87 3ks0 s VAL 156 N 1.27 2.44 0.07 2.29 1.01 -1.26 -1.08 120.40 125.14 3ks0 s VAL 156 Ca 0.04 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 61.11 3ks0 s VAL 156 Cb -0.13 -1.98 -0.03 0.00 0.00 0.00 0.00 36.38 34.24 3ks0 s VAL 156 CO -0.12 0.54 0.06 0.42 0.00 0.00 0.00 175.10 176.00 3ks0 s THR 157 N 0.47 0.18 -0.17 3.92 -4.23 -0.63 -5.00 115.64 110.18 3ks0 s THR 157 Ca -0.13 -1.59 -0.00 0.00 -1.18 0.00 0.00 61.69 58.79 3ks0 s THR 157 Cb -0.17 -1.52 0.00 0.00 1.34 0.00 0.00 72.50 72.16 3ks0 s THR 157 CO 0.05 -0.81 -0.15 0.26 -0.54 0.00 0.00 174.62 173.43 3ks0 s TRP 158 N -3.91 2.80 -1.36 3.99 0.52 -1.26 0.40 118.94 120.11 3ks0 s TRP 158 Ca 0.08 -1.19 -0.01 0.00 0.02 0.00 0.00 56.10 55.00 3ks0 s TRP 158 Cb 0.07 -1.92 0.01 0.00 -1.15 0.00 0.00 33.47 30.47 3ks0 s TRP 158 CO -0.09 -0.57 0.63 0.09 0.02 0.00 0.00 176.95 177.02 3ks0 n ASN 159 N 4.31 -1.17 -1.91 2.95 3.02 -0.03 -2.18 115.26 120.24 3ks0 n ASN 159 Ca -0.19 -0.88 -0.14 0.00 -0.03 0.00 0.00 54.58 53.34 3ks0 n ASN 159 Cb 0.51 -3.69 -0.03 0.00 -0.61 0.00 0.00 39.78 35.96 3ks0 n ASN 159 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 3ks0 n SER 160 N -3.01 -3.92 0.00 6.41 7.64 -1.26 0.15 113.62 119.62 3ks0 n SER 160 Ca -0.27 0.25 0.00 0.00 1.01 0.00 0.00 58.87 59.86 3ks0 n SER 160 Cb 0.67 -3.47 0.00 0.00 -1.01 0.00 0.00 64.21 60.39 3ks0 n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3ks0 n GLY 161 N -0.54 3.35 0.44 0.23 0.00 -0.93 -4.87 105.19 102.86 3ks0 n GLY 161 Ca -0.15 0.00 0.28 0.00 0.00 0.00 0.00 46.02 46.15 3ks0 n GLY 161 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3ks0 h SER 162 N 0.00 0.33 -3.57 1.61 4.64 -0.39 -3.14 113.55 113.03 3ks0 h SER 162 Ca 0.00 0.08 -0.72 0.00 -0.47 0.00 0.00 61.79 60.68 3ks0 h SER 162 Cb 0.00 0.03 -0.34 0.00 -0.31 0.00 0.00 62.40 61.78 3ks0 h SER 162 CO 0.00 0.02 -0.07 -0.22 -0.87 0.00 0.00 176.83 175.69 3ks0 s LEU 163 N -9.38 5.67 0.00 5.97 2.96 -1.05 -4.87 118.68 117.99 3ks0 s LEU 163 Ca -0.08 -3.47 0.20 0.00 -0.22 0.00 0.00 54.13 50.57 3ks0 s LEU 163 Cb 0.26 -1.96 0.08 0.00 0.50 0.00 0.00 46.19 45.07 3ks0 s LEU 163 CO 0.80 -0.26 1.06 -1.54 -1.32 0.00 0.00 176.35 175.10 3ks0 n SER 164 N 2.72 2.28 -4.75 3.68 3.41 -1.19 -4.45 113.62 115.33 3ks0 n SER 164 Ca 0.19 -1.64 -0.34 0.00 -0.26 0.00 0.00 58.87 56.81 3ks0 n SER 164 Cb 0.38 0.23 -0.08 0.00 -0.26 0.00 0.00 64.21 64.48 3ks0 n SER 164 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3ks0 s SER 165 N -1.95 5.54 -0.90 4.04 0.01 -1.26 -4.55 113.70 114.63 3ks0 s SER 165 Ca 0.20 0.18 -0.04 0.00 1.31 0.00 0.00 55.95 57.60 3ks0 s SER 165 Cb 0.16 -1.60 0.00 0.00 0.21 0.00 0.00 66.02 64.80 3ks0 s SER 165 CO 0.37 0.34 0.78 0.61 0.41 0.00 0.00 173.24 175.74 3ks0 n GLY 166 N 1.71 -0.09 3.14 3.44 0.00 -1.26 -4.56 105.19 107.57 3ks0 n GLY 166 Ca -0.17 -0.05 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 3ks0 n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ks0 s VAL 167 N -3.23 1.50 -0.16 1.61 1.01 -1.26 -1.54 120.40 118.34 3ks0 s VAL 167 Ca 0.26 -0.74 -0.02 0.00 0.00 0.00 0.00 61.98 61.48 3ks0 s VAL 167 Cb -0.11 -1.30 0.05 0.00 0.00 0.00 0.00 36.38 35.02 3ks0 s VAL 167 CO 0.50 0.43 0.01 -1.00 0.00 0.00 0.00 175.10 175.05 3ks0 s HIS 168 N 0.11 1.06 -0.22 5.22 3.76 0.22 -4.95 115.29 120.49 3ks0 s HIS 168 Ca -0.06 -0.74 -0.08 0.00 -0.15 0.00 0.00 55.06 54.03 3ks0 s HIS 168 Cb -0.13 -1.02 -0.04 0.00 1.11 0.00 0.00 32.58 32.50 3ks0 s HIS 168 CO 0.03 -0.54 0.08 0.99 -0.85 0.00 0.00 174.74 174.45 3ks0 s THR 169 N 1.84 4.67 0.05 1.30 2.01 -1.26 -0.49 115.64 123.76 3ks0 s THR 169 Ca 0.01 -0.06 -0.00 0.00 0.31 0.00 0.00 61.69 61.95 3ks0 s THR 169 Cb -0.16 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.16 3ks0 s THR 169 CO -0.07 0.38 0.18 -0.36 -0.69 0.00 0.00 174.62 174.06 3ks0 s PHE 170 N 1.08 3.47 0.31 4.92 0.08 -0.71 -5.01 117.98 122.13 3ks0 s PHE 170 Ca 0.05 0.24 -0.29 0.00 0.12 0.00 0.00 56.93 57.05 3ks0 s PHE 170 Cb -0.14 -1.75 -0.12 0.00 -0.57 0.00 0.00 43.02 40.43 3ks0 s PHE 170 CO 0.03 0.59 1.37 -0.35 -0.10 0.00 0.00 175.22 176.76 3ks0 n PRO 171 N 0.45 2.21 -1.32 0.24 -0.04 -1.26 -4.45 135.00 130.83 3ks0 n PRO 171 Ca -0.07 0.78 -0.33 0.00 -0.04 0.00 0.00 63.50 63.84 3ks0 n PRO 171 Cb 0.51 -2.41 0.10 0.00 -0.04 0.00 0.00 33.50 31.66 3ks0 n PRO 171 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3ks0 s ALA 172 N -0.69 2.05 0.36 0.55 0.00 -1.26 -4.89 121.76 117.88 3ks0 s ALA 172 Ca 0.60 0.75 0.05 0.00 0.00 0.00 0.00 51.96 53.36 3ks0 s ALA 172 Cb -0.58 -3.44 -0.07 0.00 0.00 0.00 0.00 23.12 19.04 3ks0 s ALA 172 CO 0.57 -1.97 0.03 0.14 0.00 0.00 0.00 175.76 174.54 3ks0 s VAL 173 N -2.21 1.56 -0.49 0.00 -7.23 0.17 -4.93 120.40 107.27 3ks0 s VAL 173 Ca 0.71 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.81 3ks0 s VAL 173 Cb -0.26 -2.88 0.13 0.00 0.56 0.00 0.00 36.38 33.93 3ks0 s VAL 173 CO 0.48 -0.01 0.33 -0.22 -0.31 0.00 0.00 175.10 175.37 3ks0 s LEU 174 N -3.59 5.53 -0.34 1.32 2.96 -1.26 -0.87 118.68 122.44 3ks0 s LEU 174 Ca 0.36 -2.13 -0.11 0.00 -0.22 0.00 0.00 54.13 52.03 3ks0 s LEU 174 Cb 0.09 -1.94 0.00 0.00 0.50 0.00 0.00 46.19 44.85 3ks0 s LEU 174 CO 0.17 -0.59 0.19 -1.10 -1.32 0.00 0.00 176.35 173.69 3ks0 s GLN 175 N 1.02 3.19 -0.95 1.98 -0.21 -0.04 -4.74 119.66 119.91 3ks0 s GLN 175 Ca 0.09 -0.83 -0.04 0.00 0.02 0.00 0.00 55.36 54.60 3ks0 s GLN 175 Cb -0.23 -3.67 -0.05 0.00 1.00 0.00 0.00 33.01 30.05 3ks0 s GLN 175 CO -0.03 -0.52 0.83 0.43 -2.12 0.00 0.00 175.29 173.88 3ks0 n SER 176 N 5.01 -5.45 0.00 5.90 7.64 -1.26 -2.57 113.62 122.89 3ks0 n SER 176 Ca -0.13 -0.62 0.00 0.00 1.01 0.00 0.00 58.87 59.13 3ks0 n SER 176 Cb 0.48 -4.68 0.00 0.00 -1.01 0.00 0.00 64.21 59.00 3ks0 n SER 176 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3ks0 n ASP 177 N -3.01 -2.65 -4.41 6.43 8.00 -1.26 -4.92 116.55 114.73 3ks0 n ASP 177 Ca -0.09 0.00 -0.23 0.00 0.71 0.00 0.00 54.79 55.17 3ks0 n ASP 177 Cb 0.61 -2.46 -0.11 0.00 -0.02 0.00 0.00 41.12 39.15 3ks0 n ASP 177 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ks0 s LEU 178 N 0.00 2.51 0.26 0.64 1.43 -1.06 -4.77 118.68 117.69 3ks0 s LEU 178 Ca 0.00 -0.95 -0.18 0.00 -1.03 0.00 0.00 54.13 51.97 3ks0 s LEU 178 Cb 0.00 -1.00 -0.08 0.00 0.03 0.00 0.00 46.19 45.14 3ks0 s LEU 178 CO 0.00 0.01 0.73 -0.31 0.23 0.00 0.00 176.35 177.01 3ks0 s TYR 179 N -2.27 3.56 0.04 0.29 1.51 -0.63 -0.86 117.35 118.99 3ks0 s TYR 179 Ca 0.24 1.33 0.02 0.00 -1.01 0.00 0.00 57.07 57.64 3ks0 s TYR 179 Cb -0.05 -2.59 -0.02 0.00 -0.11 0.00 0.00 41.96 39.18 3ks0 s TYR 179 CO 0.11 0.26 -0.07 0.99 -1.11 0.00 0.00 175.55 175.73 3ks0 s THR 180 N -1.68 0.45 0.03 -0.71 2.01 -0.05 -0.55 115.64 115.14 3ks0 s THR 180 Ca 0.47 -1.03 -0.27 0.00 0.31 0.00 0.00 61.69 61.16 3ks0 s THR 180 Cb -0.15 -0.53 0.09 0.00 0.01 0.00 0.00 72.50 71.92 3ks0 s THR 180 CO 0.20 -0.40 0.78 -0.22 -0.69 0.00 0.00 174.62 174.29 3ks0 s LEU 181 N -1.53 -0.47 0.05 4.42 0.20 0.64 0.41 118.68 122.40 3ks0 s LEU 181 Ca -0.11 0.12 -0.08 0.00 0.69 0.00 0.00 54.13 54.75 3ks0 s LEU 181 Cb -0.10 2.26 -0.00 0.00 -0.43 0.00 0.00 46.19 47.92 3ks0 s LEU 181 CO 0.00 -0.71 0.17 -0.94 -0.29 0.00 0.00 176.35 174.58 3ks0 s SER 182 N -2.28 0.10 0.04 3.68 1.04 -1.26 0.13 113.70 115.14 3ks0 s SER 182 Ca 0.01 -0.50 -0.04 0.00 0.48 0.00 0.00 55.95 55.90 3ks0 s SER 182 Cb -0.01 0.29 -0.02 0.00 0.10 0.00 0.00 66.02 66.39 3ks0 s SER 182 CO -0.07 -0.60 0.07 -0.55 0.98 0.00 0.00 173.24 173.06 3ks0 s SER 183 N -2.36 0.22 0.07 7.02 0.15 -0.15 -1.73 113.70 116.92 3ks0 s SER 183 Ca -0.02 -0.58 0.02 0.00 0.70 0.00 0.00 55.95 56.07 3ks0 s SER 183 Cb 0.01 0.21 -0.03 0.00 -1.71 0.00 0.00 66.02 64.50 3ks0 s SER 183 CO -0.06 -0.49 -0.07 -0.94 1.20 0.00 0.00 173.24 172.87 3ks0 s SER 184 N -2.14 0.99 0.05 5.45 1.04 0.35 0.96 113.70 120.40 3ks0 s SER 184 Ca -0.05 -0.75 0.06 0.00 0.48 0.00 0.00 55.95 55.69 3ks0 s SER 184 Cb -0.01 0.06 -0.02 0.00 0.10 0.00 0.00 66.02 66.15 3ks0 s SER 184 CO -0.05 -0.32 -0.17 0.54 0.98 0.00 0.00 173.24 174.22 3ks0 s VAL 185 N -2.38 1.39 -0.17 5.02 0.11 -0.51 0.73 120.40 124.58 3ks0 s VAL 185 Ca -0.00 -1.13 -0.01 0.00 -2.93 0.00 0.00 61.98 57.92 3ks0 s VAL 185 Cb -0.03 -1.23 0.04 0.00 -1.53 0.00 0.00 36.38 33.63 3ks0 s VAL 185 CO -0.02 0.08 -0.05 -0.89 -3.33 0.00 0.00 175.10 170.89 3ks0 s THR 186 N -0.86 1.11 0.25 5.04 2.01 -0.59 -0.75 115.64 121.86 3ks0 s THR 186 Ca 0.04 -0.67 0.08 0.00 0.31 0.00 0.00 61.69 61.45 3ks0 s THR 186 Cb -0.08 -1.31 -0.05 0.00 0.01 0.00 0.00 72.50 71.06 3ks0 s THR 186 CO 0.02 0.09 -0.12 0.68 -0.69 0.00 0.00 174.62 174.60 3ks0 s VAL 187 N 1.63 1.82 0.60 3.82 -7.23 -0.15 -4.77 120.40 116.11 3ks0 s VAL 187 Ca 0.00 -2.21 -0.18 0.00 -1.81 0.00 0.00 61.98 57.78 3ks0 s VAL 187 Cb -0.16 -2.25 -0.03 0.00 0.56 0.00 0.00 36.38 34.50 3ks0 s VAL 187 CO -0.08 -0.44 1.17 -2.84 -0.31 0.00 0.00 175.10 172.60 3ks0 s PRO 188 N -3.66 3.00 0.62 4.82 0.02 -1.26 0.94 135.00 139.48 3ks0 s PRO 188 Ca 0.26 1.70 0.32 0.00 0.02 0.00 0.00 61.00 63.30 3ks0 s PRO 188 Cb 0.00 -1.95 1.79 0.00 0.02 0.00 0.00 34.50 34.37 3ks0 s PRO 188 CO 0.10 -1.15 2.12 0.77 -0.33 0.00 0.00 177.00 178.50 3ks0 h SER 189 N 0.78 0.00 0.45 2.53 0.02 -0.56 -1.28 113.55 115.48 3ks0 h SER 189 Ca -0.50 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.42 3ks0 h SER 189 Cb 1.28 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.82 3ks0 h SER 189 CO 0.55 0.00 -0.14 0.77 -1.14 0.00 0.00 176.83 176.87 3ks0 h SER 190 N 0.00 0.00 0.00 3.07 4.64 -1.90 -3.22 113.55 116.13 3ks0 h SER 190 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 3ks0 h SER 190 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 3ks0 h SER 190 CO -0.00 0.14 -0.76 1.07 -0.87 0.00 0.00 176.83 176.41 3ks0 n THR 191 N -3.61 0.00 -4.01 2.95 5.66 -0.49 -4.78 114.28 110.00 3ks0 n THR 191 Ca -0.02 -0.15 -0.16 0.00 -3.05 0.00 0.00 64.05 60.67 3ks0 n THR 191 Cb 0.27 0.96 -0.15 0.00 -1.55 0.00 0.00 70.33 69.86 3ks0 n THR 191 CO 0.00 0.00 0.00 0.86 -3.05 0.00 0.00 175.07 172.88 3ks0 s TRP 192 N -2.45 0.33 -0.83 1.09 -0.00 -1.18 0.96 118.94 116.85 3ks0 s TRP 192 Ca 0.05 -0.04 0.24 0.00 -0.00 0.00 0.00 56.10 56.35 3ks0 s TRP 192 Cb 0.11 -0.32 0.94 0.00 -0.00 0.00 0.00 33.47 34.21 3ks0 s TRP 192 CO 0.62 -0.07 1.75 -2.30 -0.00 0.00 0.00 176.95 176.95 3ks0 n PRO 193 N 3.56 0.11 -0.01 5.86 -0.02 -1.26 -4.72 135.00 138.51 3ks0 n PRO 193 Ca -0.20 0.19 -0.00 0.00 -2.02 0.00 0.00 63.50 61.47 3ks0 n PRO 193 Cb 0.55 -1.65 -0.00 0.00 -0.02 0.00 0.00 33.50 32.37 3ks0 n PRO 193 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 3ks0 n SER 194 N -1.85 -0.03 -4.90 2.55 2.88 -1.25 -4.41 113.62 106.62 3ks0 n SER 194 Ca 0.05 0.21 -0.31 0.00 -1.33 0.00 0.00 58.87 57.49 3ks0 n SER 194 Cb 0.31 -0.09 -0.05 0.00 -0.75 0.00 0.00 64.21 63.64 3ks0 n SER 194 CO 0.00 0.00 0.00 -0.70 -1.23 0.00 0.00 175.04 173.11 3ks0 s GLU 195 N -3.31 3.63 -0.13 -1.46 2.56 0.27 -5.06 118.70 115.21 3ks0 s GLU 195 Ca -0.00 -0.06 -0.29 0.00 0.00 0.00 0.00 54.97 54.62 3ks0 s GLU 195 Cb 0.00 -2.80 -0.01 0.00 2.00 0.00 0.00 34.13 33.32 3ks0 s GLU 195 CO 0.02 0.42 1.10 0.99 -0.56 0.00 0.00 175.26 177.23 3ks0 s THR 196 N -1.74 4.54 -0.27 -1.70 2.01 -1.26 -4.66 115.64 112.57 3ks0 s THR 196 Ca 0.42 1.84 -0.01 0.00 0.31 0.00 0.00 61.69 64.25 3ks0 s THR 196 Cb -0.12 -4.19 0.04 0.00 0.01 0.00 0.00 72.50 68.25 3ks0 s THR 196 CO 0.25 -0.06 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.38 3ks0 s VAL 197 N 2.53 2.76 0.03 3.82 1.01 -1.26 -4.95 120.40 124.34 3ks0 s VAL 197 Ca 0.50 -1.27 0.04 0.00 0.00 0.00 0.00 61.98 61.25 3ks0 s VAL 197 Cb -0.20 -2.50 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 3ks0 s VAL 197 CO 0.16 0.05 -0.07 0.42 0.00 0.00 0.00 175.10 175.67 3ks0 s THR 198 N 1.26 3.63 -0.13 3.92 -4.23 -1.26 -1.78 115.64 117.05 3ks0 s THR 198 Ca -0.03 -0.89 -0.04 0.00 -1.18 0.00 0.00 61.69 59.55 3ks0 s THR 198 Cb -0.18 -2.62 -0.03 0.00 1.34 0.00 0.00 72.50 71.01 3ks0 s THR 198 CO -0.04 0.32 0.01 0.00 -0.54 0.00 0.00 174.62 174.37 3ks0 s ASN 200 N -0.28 3.90 -0.18 0.00 0.02 0.16 -0.90 114.94 117.65 3ks0 s ASN 200 Ca 0.06 -1.09 -0.01 0.00 -1.02 0.00 0.00 52.86 50.80 3ks0 s ASN 200 Cb -0.12 -1.52 0.00 0.00 0.02 0.00 0.00 41.25 39.63 3ks0 s ASN 200 CO 0.02 -0.11 -0.12 -0.69 0.02 0.00 0.00 177.10 176.22 3ks0 s VAL 201 N 1.18 2.83 -0.22 1.60 1.01 0.32 -1.61 120.40 125.51 3ks0 s VAL 201 Ca -0.03 -0.69 0.00 0.00 0.00 0.00 0.00 61.98 61.26 3ks0 s VAL 201 Cb -0.17 -2.23 0.03 0.00 0.00 0.00 0.00 36.38 34.00 3ks0 s VAL 201 CO -0.08 0.49 -0.13 0.00 0.00 0.00 0.00 175.10 175.37 3ks0 s ALA 202 N 1.15 2.52 -0.67 5.51 0.00 -0.24 -0.30 121.76 129.73 3ks0 s ALA 202 Ca 0.01 -1.40 -0.10 0.00 0.00 0.00 0.00 51.96 50.47 3ks0 s ALA 202 Cb -0.14 -1.45 0.18 0.00 0.00 0.00 0.00 23.12 21.70 3ks0 s ALA 202 CO -0.04 -0.66 0.57 -1.58 0.00 0.00 0.00 175.76 174.05 3ks0 s HIS 203 N 1.28 3.55 0.19 0.00 2.46 -1.02 -0.83 115.29 120.92 3ks0 s HIS 203 Ca 0.01 -2.09 -0.12 0.00 0.47 0.00 0.00 55.06 53.32 3ks0 s HIS 203 Cb -0.16 -3.59 0.21 0.00 -0.13 0.00 0.00 32.58 28.92 3ks0 s HIS 203 CO -0.08 -0.95 1.70 -1.35 -2.47 0.00 0.00 174.74 171.58 3ks0 h PRO 204 N 7.82 0.18 -0.68 2.88 0.11 -1.81 -1.28 132.00 139.22 3ks0 h PRO 204 Ca -0.03 -0.01 0.15 0.00 0.11 0.00 0.00 66.00 66.22 3ks0 h PRO 204 Cb 1.03 -0.04 -0.11 0.00 0.11 0.00 0.00 31.00 31.99 3ks0 h PRO 204 CO 0.79 0.12 0.04 0.00 -0.21 0.00 0.00 178.00 178.74 3ks0 h ALA 205 N 1.43 0.73 -0.00 -0.75 0.00 -1.93 0.14 119.26 118.88 3ks0 h ALA 205 Ca 0.27 0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.37 3ks0 h ALA 205 Cb 0.39 0.33 0.00 0.00 0.00 0.00 0.00 17.79 18.50 3ks0 h ALA 205 CO -0.38 -0.39 -0.26 -1.13 0.00 0.00 0.00 179.25 177.09 3ks0 n SER 206 N -5.27 0.39 -1.38 0.00 3.41 -1.08 -4.92 113.62 104.77 3ks0 n SER 206 Ca 0.11 -0.14 -0.15 0.00 -0.26 0.00 0.00 58.87 58.43 3ks0 n SER 206 Cb 0.41 -0.04 -0.04 0.00 -0.26 0.00 0.00 64.21 64.27 3ks0 n SER 206 CO 0.00 0.00 0.00 -0.24 -0.16 0.00 0.00 175.04 174.64 3ks0 n SER 207 N -1.33 -4.69 -4.97 4.04 2.88 0.48 -4.98 113.62 105.05 3ks0 n SER 207 Ca 0.08 0.21 -0.20 0.00 -1.33 0.00 0.00 58.87 57.64 3ks0 n SER 207 Cb 0.33 -3.64 0.03 0.00 -0.75 0.00 0.00 64.21 60.18 3ks0 n SER 207 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 3ks0 s THR 208 N -2.63 2.70 -0.30 2.46 -4.23 -1.19 -5.00 115.64 107.46 3ks0 s THR 208 Ca 0.00 -0.76 -0.10 0.00 -1.18 0.00 0.00 61.69 59.65 3ks0 s THR 208 Cb 0.00 -2.94 0.18 0.00 1.34 0.00 0.00 72.50 71.08 3ks0 s THR 208 CO 0.00 0.00 0.94 -0.75 -0.54 0.00 0.00 174.62 174.27 3ks0 s LYS 209 N -4.67 0.27 0.29 3.99 2.47 -1.26 -2.43 119.74 118.39 3ks0 s LYS 209 Ca 0.57 0.44 0.08 0.00 -1.56 0.00 0.00 55.97 55.50 3ks0 s LYS 209 Cb -0.10 0.24 -0.06 0.00 -1.46 0.00 0.00 37.83 36.45 3ks0 s LYS 209 CO 0.37 -0.34 -0.08 0.14 0.16 0.00 0.00 175.35 175.60 3ks0 s VAL 210 N 2.93 1.85 -0.20 4.02 -7.23 0.58 -4.98 120.40 117.38 3ks0 s VAL 210 Ca 0.07 -2.17 -0.04 0.00 -1.81 0.00 0.00 61.98 58.04 3ks0 s VAL 210 Cb -0.10 -2.45 0.10 0.00 0.56 0.00 0.00 36.38 34.48 3ks0 s VAL 210 CO -0.15 -0.31 0.25 1.51 -0.31 0.00 0.00 175.10 176.09 3ks0 s ASP 211 N -3.48 1.06 -0.11 4.85 3.84 -1.26 -0.52 116.67 121.06 3ks0 s ASP 211 Ca 0.30 -0.04 -0.23 0.00 -0.00 0.00 0.00 52.55 52.58 3ks0 s ASP 211 Cb 0.02 0.54 -0.03 0.00 -1.38 0.00 0.00 42.92 42.07 3ks0 s ASP 211 CO 0.13 -0.31 0.70 -0.54 -0.00 0.00 0.00 175.17 175.14 3ks0 s LYS 212 N 2.37 4.37 0.31 2.11 3.01 -0.08 -4.81 119.74 127.02 3ks0 s LYS 212 Ca 0.07 0.83 -0.27 0.00 -1.01 0.00 0.00 55.97 55.59 3ks0 s LYS 212 Cb -0.15 -3.49 -0.09 0.00 -1.01 0.00 0.00 37.83 33.09 3ks0 s LYS 212 CO -0.12 -0.04 0.99 0.21 0.51 0.00 0.00 175.35 176.90 3ks0 s LYS 213 N 1.17 4.59 -0.29 1.68 2.20 -1.26 0.15 119.74 127.98 3ks0 s LYS 213 Ca 0.35 1.50 -0.12 0.00 -0.36 0.00 0.00 55.97 57.34 3ks0 s LYS 213 Cb -0.17 -2.95 -0.04 0.00 -1.51 0.00 0.00 37.83 33.16 3ks0 s LYS 213 CO 0.16 0.25 0.23 0.42 -0.36 0.00 0.00 175.35 176.05 3ks0 s ILE 214 N -1.42 5.28 0.07 5.43 -1.09 -0.73 -4.83 121.20 123.90 3ks0 s ILE 214 Ca 0.48 0.16 0.09 0.00 -2.23 0.00 0.00 60.65 59.15 3ks0 s ILE 214 Cb -0.24 -3.60 -0.03 0.00 -1.58 0.00 0.00 42.46 37.01 3ks0 s ILE 214 CO 0.30 0.17 -0.25 0.54 -1.23 0.00 0.00 174.94 174.48 3ks0 s VAL 215 N 1.81 2.33 0.21 2.92 0.11 -1.26 -4.66 120.40 121.86 3ks0 s VAL 215 Ca 0.08 -1.46 -0.30 0.00 -2.93 0.00 0.00 61.98 57.38 3ks0 s VAL 215 Cb -0.16 -1.96 -0.16 0.00 -1.53 0.00 0.00 36.38 32.57 3ks0 s VAL 215 CO 0.11 0.27 0.86 -2.65 -3.33 0.00 0.00 175.10 170.37 3ks0 n PRO 216 N 1.45 0.72 0.00 1.54 -0.02 -1.26 -4.78 135.00 132.66 3ks0 n PRO 216 Ca -0.17 0.25 0.11 0.00 -2.02 0.00 0.00 63.50 61.68 3ks0 n PRO 216 Cb 0.52 -1.52 0.66 0.00 -0.02 0.00 0.00 33.50 33.14 3ks0 n PRO 216 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02