#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1rk6 s PHE 8 N 0.00 3.02 0.18 0.54 0.08 -0.27 -4.89 117.98 116.63 1rk6 s PHE 8 Ca 0.00 1.54 -0.08 0.00 0.12 0.00 0.00 56.93 58.51 1rk6 s PHE 8 Cb 0.00 -3.03 0.06 0.00 -0.57 0.00 0.00 43.02 39.48 1rk6 s PHE 8 CO 0.00 -0.92 1.56 -0.44 -0.10 0.00 0.00 175.22 175.32 1rk6 h ASP 9 N 1.08 0.93 -4.87 1.36 3.32 -1.09 -0.90 116.42 116.26 1rk6 h ASP 9 Ca -0.48 -0.37 0.06 0.00 0.02 0.00 0.00 57.03 56.27 1rk6 h ASP 9 Cb 1.22 -0.26 -0.13 0.00 0.22 0.00 0.00 39.33 40.38 1rk6 h ASP 9 CO 0.58 1.13 0.37 -0.72 -1.72 0.00 0.00 179.24 178.89 1rk6 s TYR 10 N -4.58 -0.39 -0.06 4.55 1.13 -1.16 -3.00 117.35 113.84 1rk6 s TYR 10 Ca -0.10 0.19 0.02 0.00 -1.41 0.00 0.00 57.07 55.77 1rk6 s TYR 10 Cb 0.12 0.57 0.01 0.00 -1.10 0.00 0.00 41.96 41.56 1rk6 s TYR 10 CO 0.86 -0.73 -0.12 0.42 -2.51 0.00 0.00 175.55 173.47 1rk6 s ILE 11 N -3.43 1.09 -0.56 -3.49 1.01 -0.11 -1.13 121.20 114.58 1rk6 s ILE 11 Ca 0.05 -0.46 -0.22 0.00 0.00 0.00 0.00 60.65 60.01 1rk6 s ILE 11 Cb -0.01 -0.99 0.06 0.00 0.01 0.00 0.00 42.46 41.52 1rk6 s ILE 11 CO -0.08 0.34 0.82 -0.76 0.00 0.00 0.00 174.94 175.26 1rk6 s LEU 12 N 0.59 4.54 -0.02 2.97 1.43 0.56 -0.60 118.68 128.16 1rk6 s LEU 12 Ca -0.13 -0.73 0.00 0.00 -1.03 0.00 0.00 54.13 52.24 1rk6 s LEU 12 Cb -0.15 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.45 1rk6 s LEU 12 CO 0.03 -1.15 0.02 -0.94 0.23 0.00 0.00 176.35 174.54 1rk6 s SER 13 N 3.00 5.27 0.00 2.29 1.04 0.35 -1.58 113.70 124.07 1rk6 s SER 13 Ca 0.22 0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.71 1rk6 s SER 13 Cb -0.16 -1.43 0.00 0.00 0.10 0.00 0.00 66.02 64.53 1rk6 s SER 13 CO 0.14 0.29 0.00 0.61 0.98 0.00 0.00 173.24 175.27 1rk6 n GLY 14 N 1.47 0.80 0.00 7.32 0.00 -1.26 -0.83 105.19 112.69 1rk6 n GLY 14 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 1rk6 n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rk6 n GLY 15 N -2.09 1.61 3.42 -0.02 0.00 -1.25 -3.99 105.19 102.87 1rk6 n GLY 15 Ca 0.00 -2.06 -0.35 0.00 0.00 0.00 0.00 46.02 43.61 1rk6 n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1rk6 s THR 16 N 0.98 3.89 -0.17 2.61 2.01 -0.38 -1.98 115.64 122.60 1rk6 s THR 16 Ca 0.00 -0.33 -0.18 0.00 0.31 0.00 0.00 61.69 61.49 1rk6 s THR 16 Cb 0.00 -2.77 -0.04 0.00 0.01 0.00 0.00 72.50 69.71 1rk6 s THR 16 CO 0.00 0.42 0.49 -0.69 -0.69 0.00 0.00 174.62 174.15 1rk6 s VAL 17 N 1.14 5.14 -0.36 3.82 1.01 0.70 -0.63 120.40 131.22 1rk6 s VAL 17 Ca 0.03 0.94 -0.03 0.00 0.00 0.00 0.00 61.98 62.91 1rk6 s VAL 17 Cb -0.14 -3.82 0.08 0.00 0.00 0.00 0.00 36.38 32.49 1rk6 s VAL 17 CO 0.01 0.24 0.12 -0.63 0.00 0.00 0.00 175.10 174.84 1rk6 s ILE 18 N 1.22 3.22 -2.00 2.22 1.01 -0.48 -1.82 121.20 124.57 1rk6 s ILE 18 Ca 0.24 -1.73 0.28 0.00 0.00 0.00 0.00 60.65 59.45 1rk6 s ILE 18 Cb -0.15 -3.05 0.81 0.00 0.01 0.00 0.00 42.46 40.08 1rk6 s ILE 18 CO 0.10 -0.43 2.07 -0.90 0.00 0.00 0.00 174.94 175.77 1rk6 n ASP 19 N 4.62 0.00 0.00 3.58 5.68 -1.26 -4.01 116.55 125.16 1rk6 n ASP 19 Ca -0.07 -1.02 0.00 0.00 -0.50 0.00 0.00 54.79 53.20 1rk6 n ASP 19 Cb 0.42 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.40 1rk6 n ASP 19 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1rk6 n GLY 20 N 0.88 0.78 1.05 6.12 0.00 -1.26 -0.73 105.19 112.03 1rk6 n GLY 20 Ca 0.21 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.33 1rk6 n GLY 20 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1rk6 n THR 21 N -2.19 0.98 -2.76 2.61 -2.24 -1.26 -3.20 114.28 106.21 1rk6 n THR 21 Ca 0.00 -0.99 -0.10 0.00 -2.27 0.00 0.00 64.05 60.69 1rk6 n THR 21 Cb 0.00 0.52 0.05 0.00 -2.10 0.00 0.00 70.33 68.80 1rk6 n THR 21 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1rk6 n ASN 22 N 1.18 -3.86 -4.03 3.42 5.15 -1.26 -5.06 115.26 110.79 1rk6 n ASN 22 Ca 0.19 -0.44 -0.17 0.00 -0.60 0.00 0.00 54.58 53.55 1rk6 n ASN 22 Cb 0.54 -3.57 -0.14 0.00 -0.53 0.00 0.00 39.78 36.08 1rk6 n ASN 22 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1rk6 s ALA 23 N -3.25 0.72 0.42 5.20 0.00 -1.26 -4.94 121.76 118.65 1rk6 s ALA 23 Ca 0.18 -0.48 -0.25 0.00 0.00 0.00 0.00 51.96 51.42 1rk6 s ALA 23 Cb -0.02 -0.14 -0.10 0.00 0.00 0.00 0.00 23.12 22.85 1rk6 s ALA 23 CO 0.48 0.14 1.05 -2.30 0.00 0.00 0.00 175.76 175.13 1rk6 n PRO 24 N 2.52 1.43 -1.35 0.00 -0.02 -1.26 -4.69 135.00 131.63 1rk6 n PRO 24 Ca -0.15 0.51 -0.35 0.00 -2.02 0.00 0.00 63.50 61.49 1rk6 n PRO 24 Cb 0.56 -2.08 0.10 0.00 -0.02 0.00 0.00 33.50 32.07 1rk6 n PRO 24 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1rk6 s GLY 25 N -0.71 2.39 0.02 -1.23 0.00 -1.26 -4.94 107.32 101.60 1rk6 s GLY 25 Ca 0.63 0.95 0.01 0.00 0.00 0.00 0.00 44.72 46.31 1rk6 s GLY 25 CO 0.57 1.37 -0.05 1.09 0.00 0.00 0.00 173.10 176.08 1rk6 s ARG 26 N -3.89 0.39 -0.02 2.90 1.70 -0.76 -4.92 118.95 114.35 1rk6 s ARG 26 Ca 0.76 -0.53 -0.30 0.00 -0.47 0.00 0.00 55.73 55.20 1rk6 s ARG 26 Cb -0.31 -0.16 -0.06 0.00 -0.57 0.00 0.00 34.95 33.84 1rk6 s ARG 26 CO 0.46 0.03 1.68 -0.51 -1.08 0.00 0.00 175.30 175.88 1rk6 s LEU 27 N -1.10 4.34 -0.10 -1.89 1.43 -1.26 -0.21 118.68 119.88 1rk6 s LEU 27 Ca -0.08 2.33 -0.30 0.00 -1.03 0.00 0.00 54.13 55.05 1rk6 s LEU 27 Cb -0.07 -3.54 0.11 0.00 0.03 0.00 0.00 46.19 42.72 1rk6 s LEU 27 CO -0.00 -0.92 0.94 0.00 0.23 0.00 0.00 176.35 176.60 1rk6 s ALA 28 N 3.75 -1.89 0.27 4.21 0.00 -0.84 -4.89 121.76 122.37 1rk6 s ALA 28 Ca 0.75 1.39 -0.00 0.00 0.00 0.00 0.00 51.96 54.10 1rk6 s ALA 28 Cb -0.36 -0.29 -0.04 0.00 0.00 0.00 0.00 23.12 22.43 1rk6 s ALA 28 CO 0.31 -0.44 0.46 -0.51 0.00 0.00 0.00 175.76 175.59 1rk6 s ASP 29 N -1.56 6.35 -0.11 0.00 1.01 0.84 -4.07 116.67 119.14 1rk6 s ASP 29 Ca -0.00 0.41 0.01 0.00 0.71 0.00 0.00 52.55 53.68 1rk6 s ASP 29 Cb -0.01 -2.01 0.02 0.00 1.01 0.00 0.00 42.92 41.93 1rk6 s ASP 29 CO -0.01 -0.15 -0.11 -0.69 0.21 0.00 0.00 175.17 174.42 1rk6 s VAL 30 N -2.06 1.26 -0.10 -1.27 1.01 -0.62 -1.43 120.40 117.19 1rk6 s VAL 30 Ca 0.39 -0.46 -0.03 0.00 0.00 0.00 0.00 61.98 61.88 1rk6 s VAL 30 Cb -0.10 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 1rk6 s VAL 30 CO 0.31 0.40 0.01 -0.83 0.00 0.00 0.00 175.10 175.00 1rk6 s GLY 31 N 1.35 1.87 -0.04 4.51 0.00 -0.09 -0.32 107.32 114.61 1rk6 s GLY 31 Ca -0.00 -0.79 0.06 0.00 0.00 0.00 0.00 44.72 43.99 1rk6 s GLY 31 CO -0.06 -0.49 -0.22 0.14 0.00 0.00 0.00 173.10 172.46 1rk6 s VAL 32 N -0.76 1.82 -0.13 1.40 1.01 -0.28 0.38 120.40 123.84 1rk6 s VAL 32 Ca 0.12 -0.95 -0.01 0.00 0.00 0.00 0.00 61.98 61.14 1rk6 s VAL 32 Cb -0.12 -1.53 0.03 0.00 0.00 0.00 0.00 36.38 34.77 1rk6 s VAL 32 CO 0.02 0.51 -0.04 -0.60 0.00 0.00 0.00 175.10 174.99 1rk6 s ARG 33 N -0.24 1.23 7.97 2.72 3.52 -0.42 -0.43 118.95 133.29 1rk6 s ARG 33 Ca 0.01 -0.28 0.00 0.00 -0.13 0.00 0.00 55.73 55.32 1rk6 s ARG 33 Cb -0.12 -1.65 0.00 0.00 -1.56 0.00 0.00 34.95 31.63 1rk6 s ARG 33 CO 0.02 -0.36 0.00 0.41 -0.81 0.00 0.00 175.30 174.55 1rk6 n GLY 34 N 4.97 3.70 0.88 8.12 0.00 -1.26 -1.80 105.19 119.80 1rk6 n GLY 34 Ca -0.11 -0.07 0.09 0.00 0.00 0.00 0.00 46.02 45.93 1rk6 n GLY 34 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1rk6 n ASP 35 N 5.71 2.58 -4.47 1.61 5.68 -1.26 -4.24 116.55 122.17 1rk6 n ASP 35 Ca 0.00 -1.95 -0.29 0.00 -0.50 0.00 0.00 54.79 52.05 1rk6 n ASP 35 Cb 0.00 -0.29 -0.12 0.00 -1.14 0.00 0.00 41.12 39.58 1rk6 n ASP 35 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1rk6 s ARG 36 N -1.43 1.70 -0.26 0.11 1.81 -0.75 -0.66 118.95 119.47 1rk6 s ARG 36 Ca 0.34 -1.25 -0.29 0.00 -1.72 0.00 0.00 55.73 52.80 1rk6 s ARG 36 Cb 0.18 -2.05 0.01 0.00 -0.45 0.00 0.00 34.95 32.64 1rk6 s ARG 36 CO 0.24 0.46 1.14 0.42 -0.68 0.00 0.00 175.30 176.88 1rk6 s ILE 37 N -1.22 4.45 -0.01 1.52 1.01 0.14 -1.30 121.20 125.79 1rk6 s ILE 37 Ca 0.18 1.70 -0.01 0.00 0.00 0.00 0.00 60.65 62.52 1rk6 s ILE 37 Cb -0.10 -4.27 -0.27 0.00 0.01 0.00 0.00 42.46 37.84 1rk6 s ILE 37 CO 0.10 -0.34 0.80 0.00 0.00 0.00 0.00 174.94 175.50 1rk6 h ALA 38 N 8.15 0.35 -2.69 9.38 0.00 -0.40 0.14 119.26 134.19 1rk6 h ALA 38 Ca -0.22 -1.18 0.03 0.00 0.00 0.00 0.00 54.91 53.54 1rk6 h ALA 38 Cb 1.07 0.34 -0.14 0.00 0.00 0.00 0.00 17.79 19.07 1rk6 h ALA 38 CO 1.01 1.21 0.32 0.00 0.00 0.00 0.00 179.25 181.79 1rk6 s ALA 39 N -2.61 -1.69 -0.05 0.00 0.00 -1.16 -4.62 121.76 111.63 1rk6 s ALA 39 Ca -0.10 0.72 -0.02 0.00 0.00 0.00 0.00 51.96 52.56 1rk6 s ALA 39 Cb 0.07 0.67 0.03 0.00 0.00 0.00 0.00 23.12 23.89 1rk6 s ALA 39 CO 0.84 -0.72 0.11 0.08 0.00 0.00 0.00 175.76 176.07 1rk6 s VAL 40 N -3.40 -0.05 -4.88 0.00 1.01 -1.26 -0.91 120.40 110.90 1rk6 s VAL 40 Ca 0.02 0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.18 1rk6 s VAL 40 Cb -0.01 -0.19 0.00 0.00 0.00 0.00 0.00 36.38 36.18 1rk6 s VAL 40 CO -0.11 0.07 0.00 0.61 0.00 0.00 0.00 175.10 175.68 1rk6 n GLY 41 N 4.14 0.72 3.59 4.51 0.00 -0.51 -4.94 105.19 112.69 1rk6 n GLY 41 Ca -0.26 -1.60 -0.43 0.00 0.00 0.00 0.00 46.02 43.73 1rk6 n GLY 41 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1rk6 s ASP 42 N -4.00 6.56 -0.23 1.61 -1.08 -1.26 -0.11 116.67 118.16 1rk6 s ASP 42 Ca 0.00 0.29 0.14 0.00 -0.52 0.00 0.00 52.55 52.46 1rk6 s ASP 42 Cb 0.00 -2.53 0.61 0.00 -1.46 0.00 0.00 42.92 39.54 1rk6 s ASP 42 CO 0.00 -1.27 1.54 0.18 0.52 0.00 0.00 175.17 176.15 1rk6 n LEU 43 N 7.84 4.58 0.09 -1.34 4.77 -1.26 -4.63 117.00 127.04 1rk6 n LEU 43 Ca 0.10 -3.14 0.10 0.00 -0.03 0.00 0.00 56.01 53.04 1rk6 n LEU 43 Cb 0.49 -0.61 0.57 0.00 -2.33 0.00 0.00 43.42 41.53 1rk6 n LEU 43 CO 0.70 0.76 1.14 0.77 -1.33 0.00 0.00 177.39 179.43 1rk6 h SER 44 N 2.17 0.19 -0.02 -1.43 4.64 -2.01 -1.82 113.55 115.26 1rk6 h SER 44 Ca 0.08 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1rk6 h SER 44 Cb 1.71 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 63.76 1rk6 h SER 44 CO 0.38 0.12 0.00 0.00 -0.87 0.00 0.00 176.83 176.46 1rk6 n ALA 45 N -2.54 2.61 -2.69 5.18 0.00 -1.26 -4.81 120.51 117.01 1rk6 n ALA 45 Ca 0.03 -0.36 -0.37 0.00 0.00 0.00 0.00 53.44 52.74 1rk6 n ALA 45 Cb 0.23 -1.28 -0.08 0.00 0.00 0.00 0.00 19.45 18.31 1rk6 n ALA 45 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1rk6 s SER 46 N -1.97 6.34 0.31 0.00 0.01 -0.69 -5.06 113.70 112.65 1rk6 s SER 46 Ca 0.41 0.39 -0.29 0.00 1.31 0.00 0.00 55.95 57.77 1rk6 s SER 46 Cb 0.21 -2.18 -0.10 0.00 0.21 0.00 0.00 66.02 64.16 1rk6 s SER 46 CO 0.34 0.02 1.41 -0.55 0.41 0.00 0.00 173.24 174.87 1rk6 s SER 47 N 0.86 6.62 -0.03 2.44 0.15 -1.26 -4.93 113.70 117.54 1rk6 s SER 47 Ca 0.15 2.78 -0.10 0.00 0.70 0.00 0.00 55.95 59.47 1rk6 s SER 47 Cb -0.14 -2.64 0.01 0.00 -1.71 0.00 0.00 66.02 61.54 1rk6 s SER 47 CO 0.05 -0.69 0.22 0.00 1.20 0.00 0.00 173.24 174.03 1rk6 s ALA 48 N -0.68 -0.55 -0.05 5.45 0.00 -1.26 -1.11 121.76 123.56 1rk6 s ALA 48 Ca 0.54 0.25 0.23 0.00 0.00 0.00 0.00 51.96 52.99 1rk6 s ALA 48 Cb -0.42 -0.05 0.69 0.00 0.00 0.00 0.00 23.12 23.33 1rk6 s ALA 48 CO 0.52 -0.20 1.73 0.00 0.00 0.00 0.00 175.76 177.80 1rk6 h ARG 49 N 4.60 0.00 -3.15 0.00 3.08 -1.21 -3.44 114.38 114.26 1rk6 h ARG 49 Ca -0.29 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.59 1rk6 h ARG 49 Cb 1.19 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 30.98 1rk6 h ARG 49 CO 0.39 0.21 -0.44 1.03 -1.07 0.00 0.00 179.97 180.09 1rk6 s ARG 50 N -3.42 0.28 -0.39 0.04 0.52 -1.16 -5.00 118.95 109.82 1rk6 s ARG 50 Ca 0.03 0.33 0.02 0.00 -0.52 0.00 0.00 55.73 55.59 1rk6 s ARG 50 Cb 0.08 0.14 0.11 0.00 0.52 0.00 0.00 34.95 35.80 1rk6 s ARG 50 CO 0.65 -0.03 0.14 0.50 0.02 0.00 0.00 175.30 176.58 1rk6 s ARG 51 N 0.12 1.31 -0.27 3.54 3.52 -1.26 -0.94 118.95 124.97 1rk6 s ARG 51 Ca -0.00 -1.82 -0.25 0.00 -0.13 0.00 0.00 55.73 53.53 1rk6 s ARG 51 Cb -0.02 -2.68 0.00 0.00 -1.56 0.00 0.00 34.95 30.69 1rk6 s ARG 51 CO 0.00 -1.04 0.85 0.42 -0.81 0.00 0.00 175.30 174.73 1rk6 s ILE 52 N 0.76 4.77 -0.23 4.11 1.01 0.23 -4.89 121.20 126.96 1rk6 s ILE 52 Ca 0.13 1.47 -0.29 0.00 0.00 0.00 0.00 60.65 61.96 1rk6 s ILE 52 Cb -0.21 -4.17 -0.02 0.00 0.01 0.00 0.00 42.46 38.07 1rk6 s ILE 52 CO -0.09 -0.19 1.42 -0.62 0.00 0.00 0.00 174.94 175.46 1rk6 s ASP 53 N 1.47 6.63 -0.21 3.58 2.15 -1.26 -0.49 116.67 128.54 1rk6 s ASP 53 Ca 0.36 1.52 0.12 0.00 0.43 0.00 0.00 52.55 54.98 1rk6 s ASP 53 Cb -0.14 -2.54 0.44 0.00 -0.30 0.00 0.00 42.92 40.38 1rk6 s ASP 53 CO 0.10 -1.06 1.20 1.33 -0.17 0.00 0.00 175.17 176.57 1rk6 n VAL 54 N 6.04 2.00 -1.72 1.11 0.24 -0.01 -4.93 118.33 121.07 1rk6 n VAL 54 Ca 0.16 -3.25 -0.42 0.00 -2.04 0.00 0.00 64.34 58.79 1rk6 n VAL 54 Cb 0.45 -0.26 -0.01 0.00 -1.47 0.00 0.00 33.84 32.55 1rk6 n VAL 54 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1rk6 n ALA 55 N -0.79 1.59 -0.26 2.33 0.00 -1.25 -1.36 120.51 120.77 1rk6 n ALA 55 Ca 0.24 0.36 0.00 0.00 0.00 0.00 0.00 53.44 54.04 1rk6 n ALA 55 Cb 0.83 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.97 1rk6 n ALA 55 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1rk6 n GLY 56 N 0.86 1.84 3.82 0.00 0.00 -1.26 -4.96 105.19 105.48 1rk6 n GLY 56 Ca 0.05 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.85 1rk6 n GLY 56 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk6 s LYS 57 N -0.23 2.56 -0.11 1.61 -0.14 -0.47 -4.54 119.74 118.43 1rk6 s LYS 57 Ca 0.00 -1.44 -0.03 0.00 -1.36 0.00 0.00 55.97 53.14 1rk6 s LYS 57 Cb 0.00 -2.34 -0.03 0.00 -1.68 0.00 0.00 37.83 33.77 1rk6 s LYS 57 CO 0.00 0.04 -0.00 0.08 -0.76 0.00 0.00 175.35 174.70 1rk6 s VAL 58 N -2.39 4.25 -0.23 3.17 1.01 0.55 -1.25 120.40 125.52 1rk6 s VAL 58 Ca 0.41 -0.26 -0.05 0.00 0.00 0.00 0.00 61.98 62.08 1rk6 s VAL 58 Cb -0.04 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.51 1rk6 s VAL 58 CO 0.25 0.57 -0.00 -0.69 0.00 0.00 0.00 175.10 175.23 1rk6 s VAL 59 N -0.51 3.73 0.34 2.92 1.01 0.19 -0.99 120.40 127.09 1rk6 s VAL 59 Ca 0.09 -0.37 0.03 0.00 0.00 0.00 0.00 61.98 61.73 1rk6 s VAL 59 Cb -0.12 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.50 1rk6 s VAL 59 CO 0.02 0.39 0.09 -0.94 0.00 0.00 0.00 175.10 174.66 1rk6 s SER 60 N 1.51 2.30 0.74 3.32 1.04 -0.25 -1.38 113.70 120.98 1rk6 s SER 60 Ca 0.06 -1.48 -0.12 0.00 0.48 0.00 0.00 55.95 54.89 1rk6 s SER 60 Cb -0.15 0.17 0.04 0.00 0.10 0.00 0.00 66.02 66.18 1rk6 s SER 60 CO -0.01 -0.74 1.09 -2.84 0.98 0.00 0.00 173.24 171.72 1rk6 s PRO 61 N -3.85 2.46 0.54 4.02 0.02 -1.26 -1.06 135.00 135.86 1rk6 s PRO 61 Ca 0.32 1.22 -0.21 0.00 0.02 0.00 0.00 61.00 62.34 1rk6 s PRO 61 Cb 0.06 -1.92 -0.05 0.00 0.02 0.00 0.00 34.50 32.62 1rk6 s PRO 61 CO 0.15 -1.50 1.30 0.20 -0.33 0.00 0.00 177.00 176.82 1rk6 s GLY 62 N -3.19 2.85 0.19 0.52 0.00 -0.28 -4.12 107.32 103.29 1rk6 s GLY 62 Ca 0.63 1.21 -0.30 0.00 0.00 0.00 0.00 44.72 46.25 1rk6 s GLY 62 CO 0.52 1.69 1.03 -1.36 0.00 0.00 0.00 173.10 174.98 1rk6 s PHE 63 N -1.39 3.73 -0.29 1.90 0.08 -0.48 -4.73 117.98 116.79 1rk6 s PHE 63 Ca 0.71 1.73 -0.09 0.00 0.12 0.00 0.00 56.93 59.40 1rk6 s PHE 63 Cb -0.37 -3.16 -0.01 0.00 -0.57 0.00 0.00 43.02 38.91 1rk6 s PHE 63 CO 0.43 -0.19 0.12 0.42 -0.10 0.00 0.00 175.22 175.90 1rk6 s ILE 64 N -0.51 4.48 -0.94 0.64 1.01 0.17 -0.66 121.20 125.39 1rk6 s ILE 64 Ca 0.46 -0.36 -0.22 0.00 0.00 0.00 0.00 60.65 60.54 1rk6 s ILE 64 Cb -0.28 -3.23 0.08 0.00 0.01 0.00 0.00 42.46 39.04 1rk6 s ILE 64 CO 0.34 0.15 1.29 -0.62 0.00 0.00 0.00 174.94 176.10 1rk6 s ASP 65 N 1.61 6.50 0.00 3.58 -1.08 0.08 -4.80 116.67 122.56 1rk6 s ASP 65 Ca 0.05 -1.57 0.02 0.00 -0.52 0.00 0.00 52.55 50.53 1rk6 s ASP 65 Cb -0.16 -2.50 0.12 0.00 -1.46 0.00 0.00 42.92 38.91 1rk6 s ASP 65 CO 0.05 -1.37 1.08 -1.54 0.52 0.00 0.00 175.17 173.91 1rk6 n SER 66 N 8.00 0.06 -3.67 -0.34 3.41 -1.23 -1.58 113.62 118.27 1rk6 n SER 66 Ca 0.25 -1.94 -0.30 0.00 -0.26 0.00 0.00 58.87 56.62 1rk6 n SER 66 Cb 0.50 -0.01 -0.14 0.00 -0.26 0.00 0.00 64.21 64.30 1rk6 n SER 66 CO 0.00 0.00 0.00 -2.28 -0.16 0.00 0.00 175.04 172.60 1rk6 s HIS 67 N -1.99 1.51 0.30 7.33 5.65 -1.26 -4.67 115.29 122.16 1rk6 s HIS 67 Ca 0.03 -1.85 0.06 0.00 0.25 0.00 0.00 55.06 53.56 1rk6 s HIS 67 Cb 0.02 -1.57 -0.06 0.00 -1.18 0.00 0.00 32.58 29.78 1rk6 s HIS 67 CO 0.03 -0.84 -0.04 0.95 -0.65 0.00 0.00 174.74 174.19 1rk6 s THR 68 N 1.20 1.66 -0.36 0.89 -4.23 -0.71 -0.40 115.64 113.69 1rk6 s THR 68 Ca 0.13 -2.10 0.10 0.00 -1.18 0.00 0.00 61.69 58.64 1rk6 s THR 68 Cb -0.20 -2.55 0.45 0.00 1.34 0.00 0.00 72.50 71.53 1rk6 s THR 68 CO -0.15 -0.23 1.10 1.41 -0.54 0.00 0.00 174.62 176.22 1rk6 n HIS 69 N -0.64 2.61 0.45 3.99 8.25 -1.24 -4.07 115.22 124.56 1rk6 n HIS 69 Ca -0.05 -2.74 0.09 0.00 -0.26 0.00 0.00 57.72 54.75 1rk6 n HIS 69 Cb 0.64 -0.21 0.24 0.00 1.12 0.00 0.00 29.99 31.77 1rk6 n HIS 69 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 1rk6 n ASP 70 N -0.47 2.68 -0.32 0.41 8.00 -1.26 -4.61 116.55 120.98 1rk6 n ASP 70 Ca 0.31 -1.97 -0.02 0.00 0.71 0.00 0.00 54.79 53.82 1rk6 n ASP 70 Cb 0.78 -0.31 0.04 0.00 -0.02 0.00 0.00 41.12 41.61 1rk6 n ASP 70 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1rk6 h ASP 71 N 3.00 -1.28 0.63 -2.24 5.19 -1.95 -0.87 116.42 118.91 1rk6 h ASP 71 Ca 0.00 0.28 -0.27 0.00 -0.62 0.00 0.00 57.03 56.43 1rk6 h ASP 71 Cb 0.68 0.68 -0.04 0.00 0.18 0.00 0.00 39.33 40.83 1rk6 h ASP 71 CO 0.00 -0.29 -1.52 -1.13 -3.12 0.00 0.00 179.24 173.18 1rk6 h ASN 72 N -0.05 0.00 -0.48 6.45 -1.24 -1.83 -3.35 115.58 115.08 1rk6 h ASN 72 Ca 0.32 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.34 1rk6 h ASN 72 Cb 0.59 0.00 -0.02 0.00 0.73 0.00 0.00 38.32 39.62 1rk6 h ASN 72 CO -0.89 0.98 0.32 0.22 -1.29 0.00 0.00 177.43 176.76 1rk6 h TYR 73 N 0.00 0.62 -0.04 0.67 3.20 -1.59 -0.47 116.97 119.36 1rk6 h TYR 73 Ca -0.21 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.68 1rk6 h TYR 73 Cb 1.93 -0.21 -0.00 0.00 1.54 0.00 0.00 36.73 39.99 1rk6 h TYR 73 CO 0.00 0.39 0.03 -0.07 -1.64 0.00 0.00 178.16 176.87 1rk6 h LEU 74 N 0.66 0.02 0.16 2.82 3.38 -1.33 0.13 115.31 121.16 1rk6 h LEU 74 Ca 0.18 -0.00 -0.35 0.00 0.09 0.00 0.00 57.88 57.79 1rk6 h LEU 74 Cb -0.06 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1rk6 h LEU 74 CO -0.04 0.02 -1.81 -0.07 0.09 0.00 0.00 178.44 176.63 1rk6 h LEU 75 N 0.02 0.54 0.00 1.67 3.38 -1.32 -3.37 115.31 116.24 1rk6 h LEU 75 Ca 0.02 -0.90 -0.07 0.00 0.09 0.00 0.00 57.88 57.01 1rk6 h LEU 75 Cb 0.04 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.60 1rk6 h LEU 75 CO -0.00 1.78 -1.35 0.29 0.09 0.00 0.00 178.44 179.24 1rk6 n LYS 76 N -3.54 0.62 -3.26 1.13 4.76 -0.51 -4.54 118.16 112.81 1rk6 n LYS 76 Ca -0.26 0.10 -0.25 0.00 -2.87 0.00 0.00 58.31 55.03 1rk6 n LYS 76 Cb 1.07 -1.76 -0.08 0.00 -1.84 0.00 0.00 35.03 32.41 1rk6 n LYS 76 CO 0.00 0.00 0.00 0.72 -1.37 0.00 0.00 177.40 176.75 1rk6 n HIS 77 N -2.69 -0.57 0.28 2.13 8.25 0.44 -4.99 115.22 118.08 1rk6 n HIS 77 Ca -0.05 -3.47 0.18 0.00 -0.26 0.00 0.00 57.72 54.12 1rk6 n HIS 77 Cb 0.67 -0.13 0.96 0.00 1.12 0.00 0.00 29.99 32.62 1rk6 n HIS 77 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1rk6 h ARG 78 N 4.58 0.00 -0.08 -0.41 3.08 -1.72 -0.38 114.38 119.46 1rk6 h ARG 78 Ca 0.14 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1rk6 h ARG 78 Cb 0.89 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.93 1rk6 h ARG 78 CO 0.43 0.00 -0.05 0.38 -1.07 0.00 0.00 179.97 179.66 1rk6 h ASP 79 N 0.00 0.10 -5.28 7.04 3.04 -1.91 0.53 116.42 119.94 1rk6 h ASP 79 Ca 0.03 -0.01 -0.40 0.00 -3.24 0.00 0.00 57.03 53.41 1rk6 h ASP 79 Cb 0.22 -0.03 -0.03 0.00 -1.04 0.00 0.00 39.33 38.45 1rk6 h ASP 79 CO -0.00 0.17 -0.60 0.23 -2.04 0.00 0.00 179.24 177.00 1rk6 n MET 80 N -4.42 -4.13 -0.33 4.15 2.81 -0.15 -4.62 117.12 110.44 1rk6 n MET 80 Ca -0.02 0.62 0.09 0.00 -1.81 0.00 0.00 57.70 56.58 1rk6 n MET 80 Cb 0.17 -5.40 0.26 0.00 -0.71 0.00 0.00 33.22 27.54 1rk6 n MET 80 CO 0.00 0.00 0.00 1.15 1.51 0.00 0.00 175.97 178.63 1rk6 h THR 81 N -1.24 0.75 -0.44 2.03 2.02 -1.90 -0.64 112.91 113.48 1rk6 h THR 81 Ca -0.48 -0.25 0.09 0.00 0.77 0.00 0.00 66.41 66.54 1rk6 h THR 81 Cb 1.32 -0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 67.66 1rk6 h THR 81 CO 0.56 0.13 0.31 -0.65 0.37 0.00 0.00 175.52 176.24 1rk6 h PRO 82 N 0.73 0.20 0.00 6.66 0.11 -1.89 -1.91 132.00 135.90 1rk6 h PRO 82 Ca 0.51 -0.01 -0.29 0.00 0.11 0.00 0.00 66.00 66.32 1rk6 h PRO 82 Cb 0.72 -0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.74 1rk6 h PRO 82 CO -0.36 0.13 -1.59 1.63 -0.21 0.00 0.00 178.00 177.61 1rk6 n LYS 83 N -4.46 0.57 0.24 1.05 4.76 -0.40 -4.23 118.16 115.69 1rk6 n LYS 83 Ca 0.07 0.49 0.08 0.00 -2.87 0.00 0.00 58.31 56.08 1rk6 n LYS 83 Cb 0.37 -1.67 0.60 0.00 -1.84 0.00 0.00 35.03 32.49 1rk6 n LYS 83 CO 0.00 0.00 0.00 -0.84 -1.37 0.00 0.00 177.40 175.19 1rk6 h ILE 84 N -1.00 0.92 0.00 -0.18 3.07 -1.19 -1.01 117.51 118.13 1rk6 h ILE 84 Ca -0.43 -0.52 0.00 0.00 1.55 0.00 0.00 64.86 65.45 1rk6 h ILE 84 Cb 1.36 1.30 0.00 0.00 -0.27 0.00 0.00 36.82 39.21 1rk6 h ILE 84 CO -0.26 0.14 0.00 -1.54 -1.05 0.00 0.00 178.15 175.44 1rk6 n SER 85 N -4.10 0.56 -0.66 2.16 3.41 -0.72 -1.61 113.62 112.65 1rk6 n SER 85 Ca -0.02 0.65 0.10 0.00 -0.26 0.00 0.00 58.87 59.34 1rk6 n SER 85 Cb 0.22 -0.76 0.04 0.00 -0.26 0.00 0.00 64.21 63.45 1rk6 n SER 85 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rk6 n GLN 86 N -2.13 1.69 -0.17 4.33 6.02 -0.46 -4.39 117.38 122.27 1rk6 n GLN 86 Ca 0.02 -1.36 0.00 0.00 -0.01 0.00 0.00 57.00 55.65 1rk6 n GLN 86 Cb 0.19 -1.41 0.00 0.00 1.02 0.00 0.00 30.24 30.04 1rk6 n GLN 86 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1rk6 n GLY 87 N 1.27 0.78 3.72 1.08 0.00 -0.63 -4.53 105.19 106.87 1rk6 n GLY 87 Ca 0.10 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.71 1rk6 n GLY 87 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1rk6 s VAL 88 N -2.14 4.20 -0.05 1.61 1.01 -0.76 -1.39 120.40 122.89 1rk6 s VAL 88 Ca 0.00 1.70 0.03 0.00 0.00 0.00 0.00 61.98 63.71 1rk6 s VAL 88 Cb 0.00 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.25 1rk6 s VAL 88 CO 0.00 0.20 0.08 0.35 0.00 0.00 0.00 175.10 175.73 1rk6 n THR 89 N 3.25 0.00 -3.83 3.92 -2.24 0.17 -4.00 114.28 111.56 1rk6 n THR 89 Ca 0.05 -0.20 -0.13 0.00 -2.27 0.00 0.00 64.05 61.51 1rk6 n THR 89 Cb 0.48 0.65 -0.13 0.00 -2.10 0.00 0.00 70.33 69.22 1rk6 n THR 89 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1rk6 s THR 90 N -1.83 -0.01 -0.01 4.28 2.01 -1.18 -0.80 115.64 118.10 1rk6 s THR 90 Ca -0.00 0.03 0.08 0.00 0.31 0.00 0.00 61.69 62.11 1rk6 s THR 90 Cb 0.02 -0.14 -0.02 0.00 0.01 0.00 0.00 72.50 72.36 1rk6 s THR 90 CO 0.11 0.01 -0.25 0.68 -0.69 0.00 0.00 174.62 174.48 1rk6 s VAL 91 N 0.23 1.94 -0.28 3.82 -7.23 -0.01 -0.74 120.40 118.13 1rk6 s VAL 91 Ca -0.02 -1.09 -0.12 0.00 -1.81 0.00 0.00 61.98 58.95 1rk6 s VAL 91 Cb -0.03 -1.62 -0.05 0.00 0.56 0.00 0.00 36.38 35.25 1rk6 s VAL 91 CO -0.01 0.51 0.24 -0.69 -0.31 0.00 0.00 175.10 174.85 1rk6 s VAL 92 N -0.61 5.27 0.48 1.32 1.01 -0.61 -0.92 120.40 126.34 1rk6 s VAL 92 Ca 0.10 0.25 0.06 0.00 0.00 0.00 0.00 61.98 62.39 1rk6 s VAL 92 Cb -0.09 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.71 1rk6 s VAL 92 CO -0.01 0.21 0.34 0.42 0.00 0.00 0.00 175.10 176.07 1rk6 s THR 93 N 1.84 2.06 -0.40 3.92 -4.23 -0.21 -1.74 115.64 116.87 1rk6 s THR 93 Ca 0.09 -1.50 -0.01 0.00 -1.18 0.00 0.00 61.69 59.09 1rk6 s THR 93 Cb -0.16 -2.56 0.00 0.00 1.34 0.00 0.00 72.50 71.12 1rk6 s THR 93 CO 0.11 0.00 0.34 0.61 -0.54 0.00 0.00 174.62 175.14 1rk6 n GLY 94 N -1.58 0.28 3.95 3.99 0.00 -1.26 -1.50 105.19 109.06 1rk6 n GLY 94 Ca -0.00 -0.32 -0.24 0.00 0.00 0.00 0.00 46.02 45.46 1rk6 n GLY 94 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1rk6 s ASN 95 N -3.33 6.32 -1.82 1.61 -0.87 -1.15 -4.42 114.94 111.29 1rk6 s ASN 95 Ca 0.06 0.34 0.00 0.00 -1.57 0.00 0.00 52.86 51.69 1rk6 s ASN 95 Cb -0.03 -1.98 0.00 0.00 -0.02 0.00 0.00 41.25 39.22 1rk6 s ASN 95 CO 0.23 -0.18 0.00 0.00 -2.57 0.00 0.00 177.10 174.58 1rk6 n GLY 97 N -0.97 0.94 3.27 0.00 0.00 -1.19 -2.95 105.19 104.30 1rk6 n GLY 97 Ca -0.25 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.37 1rk6 n GLY 97 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rk6 s ILE 98 N -3.77 4.32 0.17 -0.61 1.01 -0.07 -0.86 121.20 121.39 1rk6 s ILE 98 Ca 0.00 -1.41 0.09 0.00 0.00 0.00 0.00 60.65 59.33 1rk6 s ILE 98 Cb 0.00 -3.66 -0.04 0.00 0.01 0.00 0.00 42.46 38.77 1rk6 s ILE 98 CO 0.00 -0.54 -0.19 -0.94 0.00 0.00 0.00 174.94 173.26 1rk6 s SER 99 N 2.22 2.80 0.25 3.58 1.04 -1.26 -2.91 113.70 119.42 1rk6 s SER 99 Ca 0.03 -0.85 0.02 0.00 0.48 0.00 0.00 55.95 55.63 1rk6 s SER 99 Cb -0.23 -0.17 0.29 0.00 0.10 0.00 0.00 66.02 66.00 1rk6 s SER 99 CO 0.02 -0.00 1.62 0.25 0.98 0.00 0.00 173.24 176.11 1rk6 h LEU 100 N 3.30 0.44 -8.89 2.42 5.85 -1.93 -3.45 115.31 113.05 1rk6 h LEU 100 Ca -0.43 -0.20 -0.52 0.00 0.84 0.00 0.00 57.88 57.56 1rk6 h LEU 100 Cb 1.20 -0.12 -0.17 0.00 0.37 0.00 0.00 40.66 41.94 1rk6 h LEU 100 CO 0.50 0.83 -0.77 0.00 -0.34 0.00 0.00 178.44 178.65 1rk6 s ALA 101 N -4.13 2.11 -0.25 1.25 0.00 -1.26 -4.16 121.76 115.31 1rk6 s ALA 101 Ca -0.06 -1.57 -0.15 0.00 0.00 0.00 0.00 51.96 50.18 1rk6 s ALA 101 Cb 0.13 -0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.03 1rk6 s ALA 101 CO 0.80 0.21 0.39 -1.25 0.00 0.00 0.00 175.76 175.92 1rk6 s PRO 102 N -3.04 4.07 -0.30 0.00 0.04 -1.26 -4.54 135.00 129.97 1rk6 s PRO 102 Ca 0.19 0.11 -0.16 0.00 0.04 0.00 0.00 61.00 61.18 1rk6 s PRO 102 Cb -0.05 -3.62 0.17 0.00 0.04 0.00 0.00 34.50 31.05 1rk6 s PRO 102 CO 0.08 -0.20 1.07 -1.17 0.04 0.00 0.00 177.00 176.82 1rk6 s LEU 103 N 1.83 -0.44 -0.40 -3.56 2.96 0.15 -4.66 118.68 114.57 1rk6 s LEU 103 Ca 0.17 0.55 -0.12 0.00 -0.22 0.00 0.00 54.13 54.51 1rk6 s LEU 103 Cb -0.15 1.48 0.04 0.00 0.50 0.00 0.00 46.19 48.06 1rk6 s LEU 103 CO 0.09 -0.08 0.25 0.00 -1.32 0.00 0.00 176.35 175.29 1rk6 s ALA 104 N 2.41 3.34 -0.24 5.97 0.00 -1.26 -3.69 121.76 128.30 1rk6 s ALA 104 Ca -0.01 -1.87 -0.14 0.00 0.00 0.00 0.00 51.96 49.94 1rk6 s ALA 104 Cb -0.05 -2.71 0.07 0.00 0.00 0.00 0.00 23.12 20.43 1rk6 s ALA 104 CO -0.16 -1.50 0.59 -1.58 0.00 0.00 0.00 175.76 173.10 1rk6 s HIS 105 N 1.55 -0.87 -0.44 0.00 5.04 -0.59 -5.01 115.29 114.98 1rk6 s HIS 105 Ca 0.03 1.80 0.25 0.00 -1.54 0.00 0.00 55.06 55.59 1rk6 s HIS 105 Cb -0.21 0.47 0.58 0.00 0.04 0.00 0.00 32.58 33.46 1rk6 s HIS 105 CO 0.06 -0.44 1.69 0.00 -2.34 0.00 0.00 174.74 173.71 1rk6 h ALA 106 N 6.85 1.00 -1.45 1.58 0.00 -1.96 -3.39 119.26 121.89 1rk6 h ALA 106 Ca -0.32 0.00 -0.45 0.00 0.00 0.00 0.00 54.91 54.14 1rk6 h ALA 106 Cb 1.21 0.00 -0.32 0.00 0.00 0.00 0.00 17.79 18.67 1rk6 h ALA 106 CO 0.20 0.00 -0.96 0.09 0.00 0.00 0.00 179.25 178.58 1rk6 n ASN 107 N -2.89 -0.46 -4.75 0.00 3.02 -1.26 -4.61 115.26 104.31 1rk6 n ASN 107 Ca 0.04 -2.98 -0.38 0.00 -0.03 0.00 0.00 54.58 51.22 1rk6 n ASN 107 Cb 0.47 0.06 0.05 0.00 -0.61 0.00 0.00 39.78 39.75 1rk6 n ASN 107 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1rk6 s PRO 108 N -1.03 3.04 0.37 3.52 0.04 -1.26 -4.94 135.00 134.74 1rk6 s PRO 108 Ca 0.34 2.24 -0.27 0.00 0.04 0.00 0.00 61.00 63.36 1rk6 s PRO 108 Cb 0.24 -2.20 -0.09 0.00 0.04 0.00 0.00 34.50 32.48 1rk6 s PRO 108 CO -0.12 -1.27 1.27 -1.25 0.04 0.00 0.00 177.00 175.67 1rk6 s PRO 109 N -2.97 4.18 0.51 0.56 0.04 -1.26 -4.35 135.00 131.72 1rk6 s PRO 109 Ca 0.73 2.11 -0.23 0.00 0.04 0.00 0.00 61.00 63.66 1rk6 s PRO 109 Cb -0.41 -2.90 -0.06 0.00 0.04 0.00 0.00 34.50 31.17 1rk6 s PRO 109 CO 0.48 -0.30 1.40 0.00 0.04 0.00 0.00 177.00 178.62 1rk6 s ALA 110 N -1.23 2.99 -1.19 8.56 0.00 -1.26 -0.64 121.76 128.98 1rk6 s ALA 110 Ca 0.53 1.41 0.07 0.00 0.00 0.00 0.00 51.96 53.97 1rk6 s ALA 110 Cb -0.37 -3.59 0.32 0.00 0.00 0.00 0.00 23.12 19.48 1rk6 s ALA 110 CO 0.49 -1.34 1.10 -0.35 0.00 0.00 0.00 175.76 175.66 1rk6 n PRO 111 N -0.72 2.28 0.26 0.00 -0.04 -1.26 -4.44 135.00 131.08 1rk6 n PRO 111 Ca 0.08 -1.23 0.11 0.00 -0.04 0.00 0.00 63.50 62.42 1rk6 n PRO 111 Cb 0.43 -1.60 0.72 0.00 -0.04 0.00 0.00 33.50 33.02 1rk6 n PRO 111 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 1rk6 h LEU 112 N 1.72 0.00 -0.99 1.53 4.07 -1.18 -1.64 115.31 118.82 1rk6 h LEU 112 Ca 0.00 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1rk6 h LEU 112 Cb 0.85 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.59 1rk6 h LEU 112 CO 0.13 0.09 0.00 -0.90 -1.08 0.00 0.00 178.44 176.68 1rk6 n ASP 113 N -3.93 0.46 0.27 -0.43 5.75 -1.25 -1.71 116.55 115.71 1rk6 n ASP 113 Ca -0.02 0.69 0.18 0.00 -0.01 0.00 0.00 54.79 55.63 1rk6 n ASP 113 Cb 0.18 -0.76 0.85 0.00 -1.03 0.00 0.00 41.12 40.37 1rk6 n ASP 113 CO 0.00 0.00 0.00 -0.07 -0.11 0.00 0.00 177.20 177.02 1rk6 h LEU 114 N 0.00 0.00 -0.40 -2.12 3.38 -1.67 -2.28 115.31 112.22 1rk6 h LEU 114 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1rk6 h LEU 114 Cb 0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1rk6 h LEU 114 CO 0.00 0.00 -0.65 0.18 0.09 0.00 0.00 178.44 178.06 1rk6 n LEU 115 N -2.92 1.27 -4.75 1.67 4.77 -0.69 -4.58 117.00 111.77 1rk6 n LEU 115 Ca -0.01 -0.48 -0.38 0.00 -0.03 0.00 0.00 56.01 55.11 1rk6 n LEU 115 Cb 0.19 -0.05 -0.06 0.00 -2.33 0.00 0.00 43.42 41.17 1rk6 n LEU 115 CO 0.22 0.27 0.22 -0.62 -1.33 0.00 0.00 177.39 176.15 1rk6 s ASP 116 N -2.76 6.83 0.00 -1.43 -1.08 -0.86 -4.66 116.67 112.71 1rk6 s ASP 116 Ca 0.14 0.99 0.16 0.00 -0.52 0.00 0.00 52.55 53.32 1rk6 s ASP 116 Cb 0.17 -2.32 0.05 0.00 -1.46 0.00 0.00 42.92 39.36 1rk6 s ASP 116 CO 0.70 0.08 0.92 -0.62 0.52 0.00 0.00 175.17 176.77 1rk6 n GLU 117 N 3.05 1.56 0.00 4.34 1.02 -1.26 -5.00 120.64 124.34 1rk6 n GLU 117 Ca -0.08 -1.06 0.00 0.00 -0.02 0.00 0.00 57.16 56.00 1rk6 n GLU 117 Cb 0.51 -1.29 0.00 0.00 -0.02 0.00 0.00 31.44 30.65 1rk6 n GLU 117 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rk6 n GLY 118 N 1.07 2.52 2.31 0.62 0.00 -1.26 -4.91 105.19 105.54 1rk6 n GLY 118 Ca 0.08 -0.77 -0.12 0.00 0.00 0.00 0.00 46.02 45.21 1rk6 n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1rk6 n GLY 119 N 0.00 0.80 0.18 -0.02 0.00 -1.26 -4.91 105.19 99.97 1rk6 n GLY 119 Ca 0.00 -0.43 0.06 0.00 0.00 0.00 0.00 46.02 45.65 1rk6 n GLY 119 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1rk6 h SER 120 N 0.00 0.00 -1.58 1.61 0.02 -1.91 -3.38 113.55 108.31 1rk6 h SER 120 Ca -0.26 0.00 -0.68 0.00 -0.84 0.00 0.00 61.79 60.00 1rk6 h SER 120 Cb 0.95 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.36 1rk6 h SER 120 CO 0.36 0.37 1.57 -0.36 -1.14 0.00 0.00 176.83 177.63 1rk6 s PHE 121 N -3.30 3.01 0.00 3.45 0.40 -1.26 -4.60 117.98 115.68 1rk6 s PHE 121 Ca 0.02 -1.58 0.00 0.00 -0.60 0.00 0.00 56.93 54.77 1rk6 s PHE 121 Cb 0.09 -4.53 0.00 0.00 0.51 0.00 0.00 43.02 39.09 1rk6 s PHE 121 CO 0.70 -1.65 0.68 2.89 0.70 0.00 0.00 175.22 178.53 1rk6 n ARG 122 N 7.34 0.74 -3.40 0.44 1.85 -1.24 -1.54 116.66 120.85 1rk6 n ARG 122 Ca 0.38 -0.88 -0.44 0.00 -1.00 0.00 0.00 57.85 55.91 1rk6 n ARG 122 Cb 0.47 -0.95 -0.08 0.00 -1.05 0.00 0.00 32.46 30.84 1rk6 n ARG 122 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1rk6 s PHE 123 N -0.41 3.23 0.20 2.89 0.08 -1.25 -4.86 117.98 117.86 1rk6 s PHE 123 Ca 0.00 -0.75 0.24 0.00 0.12 0.00 0.00 56.93 56.54 1rk6 s PHE 123 Cb 0.00 -2.95 0.99 0.00 -0.57 0.00 0.00 43.02 40.49 1rk6 s PHE 123 CO 0.00 -0.73 1.86 0.00 -0.10 0.00 0.00 175.22 176.26 1rk6 h ALA 124 N 8.72 1.08 -3.68 5.36 0.00 -1.93 0.46 119.26 129.25 1rk6 h ALA 124 Ca -0.28 -0.21 -0.41 0.00 0.00 0.00 0.00 54.91 54.01 1rk6 h ALA 124 Cb 1.11 -0.04 -0.24 0.00 0.00 0.00 0.00 17.79 18.62 1rk6 h ALA 124 CO 0.82 0.29 -0.78 1.03 0.00 0.00 0.00 179.25 180.61 1rk6 s ARG 125 N -3.77 0.84 0.28 0.00 0.52 -1.26 -4.46 118.95 111.10 1rk6 s ARG 125 Ca -0.00 -0.72 -0.04 0.00 -0.52 0.00 0.00 55.73 54.45 1rk6 s ARG 125 Cb 0.11 -0.82 0.36 0.00 0.52 0.00 0.00 34.95 35.12 1rk6 s ARG 125 CO 0.63 0.20 1.95 0.35 0.02 0.00 0.00 175.30 178.45 1rk6 h PHE 126 N 4.95 1.14 -0.15 -0.53 3.57 -1.89 -1.86 116.94 122.17 1rk6 h PHE 126 Ca -0.37 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.20 1rk6 h PHE 126 Cb 1.18 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 39.53 1rk6 h PHE 126 CO 0.54 0.72 0.11 0.66 -2.23 0.00 0.00 178.31 178.10 1rk6 h SER 127 N 1.23 0.01 -0.71 0.41 4.64 -1.91 -0.63 113.55 116.60 1rk6 h SER 127 Ca 0.34 -0.00 -0.07 0.00 -0.47 0.00 0.00 61.79 61.58 1rk6 h SER 127 Cb -0.13 -0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 61.93 1rk6 h SER 127 CO -0.07 0.01 0.16 0.44 -0.87 0.00 0.00 176.83 176.49 1rk6 h ASP 128 N 0.01 1.08 -0.17 4.97 3.32 -1.74 -0.66 116.42 123.24 1rk6 h ASP 128 Ca 0.07 -0.24 -0.04 0.00 0.02 0.00 0.00 57.03 56.85 1rk6 h ASP 128 Cb 0.27 -0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.52 1rk6 h ASP 128 CO -0.00 1.04 -0.03 0.22 -1.72 0.00 0.00 179.24 178.75 1rk6 h TYR 129 N 1.07 0.36 -0.57 4.55 3.20 -1.12 -2.15 116.97 122.32 1rk6 h TYR 129 Ca 0.22 -0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.96 1rk6 h TYR 129 Cb 0.39 -0.09 -0.03 0.00 1.54 0.00 0.00 36.73 38.54 1rk6 h TYR 129 CO 0.03 0.58 0.12 -0.07 -1.64 0.00 0.00 178.16 177.19 1rk6 h LEU 130 N 0.04 0.83 -0.93 2.82 3.38 -1.24 -2.30 115.31 117.90 1rk6 h LEU 130 Ca 0.04 -0.16 -0.03 0.00 0.09 0.00 0.00 57.88 57.82 1rk6 h LEU 130 Cb 0.46 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.95 1rk6 h LEU 130 CO 0.02 0.82 0.37 -0.33 0.09 0.00 0.00 178.44 179.41 1rk6 h GLU 131 N 0.85 1.14 -0.66 1.13 4.39 -1.05 -1.25 114.58 119.13 1rk6 h GLU 131 Ca 0.18 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.65 1rk6 h GLU 131 Cb 0.33 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.74 1rk6 h GLU 131 CO 0.00 0.88 0.16 0.00 -1.16 0.00 0.00 179.01 178.90 1rk6 h ALA 132 N 1.28 1.05 -0.41 3.43 0.00 -0.89 -1.18 119.26 122.55 1rk6 h ALA 132 Ca 0.27 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 1rk6 h ALA 132 Cb 0.12 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1rk6 h ALA 132 CO -0.03 0.63 -0.01 -0.07 0.00 0.00 0.00 179.25 179.76 1rk6 h LEU 133 N 0.98 0.72 -0.93 0.00 3.38 -1.02 -2.50 115.31 115.94 1rk6 h LEU 133 Ca 0.21 -0.31 -0.09 0.00 0.09 0.00 0.00 57.88 57.77 1rk6 h LEU 133 Cb 0.34 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 1rk6 h LEU 133 CO -0.00 0.86 -0.20 0.03 0.09 0.00 0.00 178.44 179.22 1rk6 h ARG 134 N 0.56 0.55 0.00 1.13 3.08 -1.00 -1.89 114.38 116.82 1rk6 h ARG 134 Ca 0.11 -0.19 -0.12 0.00 0.07 0.00 0.00 59.98 59.85 1rk6 h ARG 134 Cb 0.50 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.49 1rk6 h ARG 134 CO 0.02 0.72 -0.56 0.00 -1.07 0.00 0.00 179.97 179.09 1rk6 h ALA 135 N 1.29 0.90 -2.14 0.04 0.00 -1.11 -3.34 119.26 114.90 1rk6 h ALA 135 Ca 0.08 -0.51 -0.57 0.00 0.00 0.00 0.00 54.91 53.91 1rk6 h ALA 135 Cb 0.62 -0.09 -0.39 0.00 0.00 0.00 0.00 17.79 17.93 1rk6 h ALA 135 CO 0.04 0.69 -0.98 0.00 0.00 0.00 0.00 179.25 179.01 1rk6 n ALA 136 N -2.35 2.81 -1.72 0.00 0.00 -0.95 -5.10 120.51 113.18 1rk6 n ALA 136 Ca -0.00 -3.61 -0.39 0.00 0.00 0.00 0.00 53.44 49.44 1rk6 n ALA 136 Cb 0.62 -0.82 0.04 0.00 0.00 0.00 0.00 19.45 19.28 1rk6 n ALA 136 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1rk6 n PRO 137 N 1.60 1.64 -2.23 0.00 -0.04 -0.72 -4.74 135.00 130.51 1rk6 n PRO 137 Ca 0.24 0.60 -0.27 0.00 -0.04 0.00 0.00 63.50 64.03 1rk6 n PRO 137 Cb 0.49 -2.51 0.15 0.00 -0.04 0.00 0.00 33.50 31.60 1rk6 n PRO 137 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1rk6 s PRO 138 N -2.78 1.07 0.49 0.54 0.04 -1.26 -4.76 135.00 128.33 1rk6 s PRO 138 Ca 0.71 -0.74 0.29 0.00 0.04 0.00 0.00 61.00 61.29 1rk6 s PRO 138 Cb -0.43 -2.06 0.92 0.00 0.04 0.00 0.00 34.50 32.97 1rk6 s PRO 138 CO 0.50 -2.01 1.82 0.00 0.04 0.00 0.00 177.00 177.35 1rk6 h ALA 139 N -1.16 1.00 -2.31 8.56 0.00 -1.13 0.23 119.26 124.45 1rk6 h ALA 139 Ca -0.41 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 53.92 1rk6 h ALA 139 Cb 1.25 0.00 -0.12 0.00 0.00 0.00 0.00 17.79 18.92 1rk6 h ALA 139 CO 0.38 0.00 -0.69 0.14 0.00 0.00 0.00 179.25 179.08 1rk6 s VAL 140 N -3.45 3.09 0.65 0.00 -7.23 -1.26 -3.57 120.40 108.62 1rk6 s VAL 140 Ca 0.04 -2.05 -0.14 0.00 -1.81 0.00 0.00 61.98 58.02 1rk6 s VAL 140 Cb 0.07 -2.63 -0.01 0.00 0.56 0.00 0.00 36.38 34.38 1rk6 s VAL 140 CO 0.59 -0.35 1.07 0.20 -0.31 0.00 0.00 175.10 176.30 1rk6 s ASN 141 N -3.52 5.40 -0.07 4.85 0.01 0.02 -4.12 114.94 117.51 1rk6 s ASN 141 Ca 0.30 1.82 0.01 0.00 -0.71 0.00 0.00 52.86 54.28 1rk6 s ASN 141 Cb -0.06 -2.53 0.02 0.00 0.41 0.00 0.00 41.25 39.09 1rk6 s ASN 141 CO 0.18 -1.43 -0.09 0.00 -1.51 0.00 0.00 177.10 174.25 1rk6 s ALA 142 N -2.59 1.11 -0.29 0.60 0.00 -0.32 -0.83 121.76 119.44 1rk6 s ALA 142 Ca 0.63 -0.35 -0.02 0.00 0.00 0.00 0.00 51.96 52.22 1rk6 s ALA 142 Cb -0.17 -0.63 0.05 0.00 0.00 0.00 0.00 23.12 22.37 1rk6 s ALA 142 CO 0.44 -0.07 -0.02 0.00 0.00 0.00 0.00 175.76 176.11 1rk6 s ALA 143 N 1.04 2.78 -0.15 0.00 0.00 -0.10 -0.50 121.76 124.84 1rk6 s ALA 143 Ca -0.08 -1.71 -0.04 0.00 0.00 0.00 0.00 51.96 50.13 1rk6 s ALA 143 Cb -0.14 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.07 1rk6 s ALA 143 CO -0.00 -1.19 -0.01 0.00 0.00 0.00 0.00 175.76 174.55 1rk6 s MET 145 N 0.11 2.76 -0.08 0.00 -1.94 -0.56 -0.52 119.30 119.07 1rk6 s MET 145 Ca 0.01 -1.05 -0.05 0.00 -1.71 0.00 0.00 55.69 52.89 1rk6 s MET 145 Cb -0.13 -2.51 -0.04 0.00 2.01 0.00 0.00 34.83 34.16 1rk6 s MET 145 CO 0.02 0.43 0.15 0.54 -0.01 0.00 0.00 175.02 176.16 1rk6 s VAL 146 N -1.97 5.46 -0.16 -6.03 0.11 -0.61 -4.21 120.40 112.99 1rk6 s VAL 146 Ca 0.31 0.06 -0.07 0.00 -2.93 0.00 0.00 61.98 59.35 1rk6 s VAL 146 Cb -0.09 -3.45 -0.04 0.00 -1.53 0.00 0.00 36.38 31.27 1rk6 s VAL 146 CO 0.23 0.50 0.09 -0.83 -3.33 0.00 0.00 175.10 171.76 1rk6 s GLY 147 N -1.39 1.99 0.42 6.54 0.00 -1.26 -1.33 107.32 112.28 1rk6 s GLY 147 Ca 0.20 -0.71 0.08 0.00 0.00 0.00 0.00 44.72 44.28 1rk6 s GLY 147 CO 0.10 -0.08 2.06 0.84 0.00 0.00 0.00 173.10 176.02 1rk6 h HIS 148 N 6.16 0.47 -0.18 1.90 2.76 -0.70 -1.27 115.15 124.29 1rk6 h HIS 148 Ca -0.43 0.01 -0.16 0.00 -2.20 0.00 0.00 60.37 57.59 1rk6 h HIS 148 Cb 1.18 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 29.97 1rk6 h HIS 148 CO 0.61 0.31 -0.55 0.77 -1.30 0.00 0.00 177.93 177.77 1rk6 h SER 149 N 0.50 0.61 -0.68 3.26 0.02 -1.24 -0.09 113.55 115.93 1rk6 h SER 149 Ca 0.13 -0.33 -0.03 0.00 -0.84 0.00 0.00 61.79 60.73 1rk6 h SER 149 Cb -0.04 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 62.29 1rk6 h SER 149 CO -0.03 1.04 0.31 0.74 -1.14 0.00 0.00 176.83 177.75 1rk6 h THR 150 N 0.42 1.23 -0.64 -2.27 2.02 -0.85 -0.83 112.91 112.00 1rk6 h THR 150 Ca 0.01 -0.69 -0.01 0.00 0.77 0.00 0.00 66.41 66.49 1rk6 h THR 150 Cb 1.09 0.42 -0.03 0.00 -1.74 0.00 0.00 68.15 67.89 1rk6 h THR 150 CO 0.10 0.28 0.34 -0.07 0.37 0.00 0.00 175.52 176.55 1rk6 h LEU 151 N 0.96 0.81 -0.60 2.58 3.38 -0.89 -0.78 115.31 120.76 1rk6 h LEU 151 Ca 0.23 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 1rk6 h LEU 151 Cb 0.15 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 1rk6 h LEU 151 CO -0.03 0.68 0.33 0.03 0.09 0.00 0.00 178.44 179.54 1rk6 h ARG 152 N 0.87 0.84 -0.30 1.13 3.08 -0.73 -1.65 114.38 117.63 1rk6 h ARG 152 Ca 0.22 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 60.14 1rk6 h ARG 152 Cb 0.06 -0.16 -0.02 0.00 0.08 0.00 0.00 29.97 29.92 1rk6 h ARG 152 CO -0.03 0.64 0.01 0.00 -1.07 0.00 0.00 179.97 179.52 1rk6 h ALA 153 N 1.15 1.46 0.00 0.04 0.00 -0.71 0.26 119.26 121.47 1rk6 h ALA 153 Ca 0.21 -0.17 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 1rk6 h ALA 153 Cb 0.04 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 1rk6 h ALA 153 CO -0.03 0.38 -0.67 0.00 0.00 0.00 0.00 179.25 178.93 1rk6 h ALA 154 N 1.58 0.75 0.00 0.00 0.00 -0.62 -3.39 119.26 117.57 1rk6 h ALA 154 Ca 0.10 -0.61 -0.26 0.00 0.00 0.00 0.00 54.91 54.13 1rk6 h ALA 154 Cb 0.27 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.91 1rk6 h ALA 154 CO 0.01 0.84 -2.00 0.28 0.00 0.00 0.00 179.25 178.38 1rk6 n VAL 155 N -3.53 1.00 -3.18 0.00 0.31 -0.67 -5.02 118.33 107.24 1rk6 n VAL 155 Ca -0.00 -0.41 -0.40 0.00 -0.01 0.00 0.00 64.34 63.52 1rk6 n VAL 155 Cb 0.71 -1.07 -0.06 0.00 -0.91 0.00 0.00 33.84 32.51 1rk6 n VAL 155 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 1rk6 s MET 156 N -2.35 4.20 0.39 5.55 1.00 0.87 -4.94 119.30 124.02 1rk6 s MET 156 Ca -0.22 0.51 0.18 0.00 0.00 0.00 0.00 55.69 56.17 1rk6 s MET 156 Cb 0.06 -3.57 0.78 0.00 0.00 0.00 0.00 34.83 32.10 1rk6 s MET 156 CO 0.42 -0.19 1.80 -1.35 0.00 0.00 0.00 175.02 175.70 1rk6 h PRO 157 N 7.46 0.00 -3.85 2.03 0.11 -1.92 -3.40 132.00 132.42 1rk6 h PRO 157 Ca -0.33 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.25 1rk6 h PRO 157 Cb 1.15 0.00 -0.39 0.00 0.11 0.00 0.00 31.00 31.87 1rk6 h PRO 157 CO 0.76 0.36 -0.77 0.34 -0.21 0.00 0.00 178.00 178.47 1rk6 s ASP 158 N -6.55 2.97 0.32 -2.05 2.15 -1.26 -5.01 116.67 107.24 1rk6 s ASP 158 Ca -0.01 -0.80 0.25 0.00 0.43 0.00 0.00 52.55 52.42 1rk6 s ASP 158 Cb 0.12 -0.77 0.65 0.00 -0.30 0.00 0.00 42.92 42.62 1rk6 s ASP 158 CO 0.69 -0.26 1.72 -0.07 -0.17 0.00 0.00 175.17 177.08 1rk6 h LEU 159 N 8.17 0.00 -3.27 -1.34 3.38 -1.92 -3.38 115.31 116.95 1rk6 h LEU 159 Ca -0.19 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.73 1rk6 h LEU 159 Cb 1.11 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.84 1rk6 h LEU 159 CO 0.36 0.00 -0.09 0.54 0.09 0.00 0.00 178.44 179.34 1rk6 n ARG 160 N -2.63 1.28 -3.69 1.13 1.74 -1.26 -4.60 116.66 108.64 1rk6 n ARG 160 Ca 0.05 -0.30 -0.02 0.00 -0.77 0.00 0.00 57.85 56.81 1rk6 n ARG 160 Cb 0.46 -1.27 -0.01 0.00 -1.02 0.00 0.00 32.46 30.61 1rk6 n ARG 160 CO 0.00 0.00 0.00 -0.98 -1.52 0.00 0.00 177.63 175.13 1rk6 s ARG 161 N 0.21 0.88 0.56 5.56 1.70 -1.26 -4.99 118.95 121.62 1rk6 s ARG 161 Ca 0.18 -0.48 -0.19 0.00 -0.47 0.00 0.00 55.73 54.77 1rk6 s ARG 161 Cb 0.09 0.31 -0.05 0.00 -0.57 0.00 0.00 34.95 34.73 1rk6 s ARG 161 CO -0.00 -0.40 1.14 -2.00 -1.08 0.00 0.00 175.30 172.95 1rk6 s GLU 162 N -2.97 3.27 0.44 3.89 2.12 -1.18 -4.54 118.70 119.72 1rk6 s GLU 162 Ca 0.12 1.62 -0.22 0.00 0.36 0.00 0.00 54.97 56.85 1rk6 s GLU 162 Cb 0.01 -1.99 -0.09 0.00 0.26 0.00 0.00 34.13 32.31 1rk6 s GLU 162 CO -0.01 -0.92 1.03 0.00 -0.54 0.00 0.00 175.26 174.82 1rk6 s ALA 163 N -1.80 3.00 0.80 6.30 0.00 -1.26 -5.05 121.76 123.74 1rk6 s ALA 163 Ca 0.73 0.62 -0.12 0.00 0.00 0.00 0.00 51.96 53.19 1rk6 s ALA 163 Cb -0.24 -3.25 0.07 0.00 0.00 0.00 0.00 23.12 19.71 1rk6 s ALA 163 CO 0.29 -0.20 1.17 0.95 0.00 0.00 0.00 175.76 177.97 1rk6 s THR 164 N -1.85 2.14 0.24 0.00 -4.23 -1.26 -4.81 115.64 105.87 1rk6 s THR 164 Ca 0.62 0.04 -0.06 0.00 -1.18 0.00 0.00 61.69 61.11 1rk6 s THR 164 Cb -0.18 -3.04 0.24 0.00 1.34 0.00 0.00 72.50 70.86 1rk6 s THR 164 CO 0.22 -0.06 1.90 0.00 -0.54 0.00 0.00 174.62 176.15 1rk6 h ALA 165 N -1.02 1.23 -0.73 3.99 0.00 -1.98 0.43 119.26 121.18 1rk6 h ALA 165 Ca -0.46 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.35 1rk6 h ALA 165 Cb 1.32 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 18.69 1rk6 h ALA 165 CO 0.66 0.66 0.42 -0.44 0.00 0.00 0.00 179.25 180.55 1rk6 h ASP 166 N 1.33 0.90 -0.46 0.00 3.32 -1.99 0.13 116.42 119.64 1rk6 h ASP 166 Ca 0.35 -0.08 -0.12 0.00 0.02 0.00 0.00 57.03 57.20 1rk6 h ASP 166 Cb -0.10 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.21 1rk6 h ASP 166 CO -0.07 0.72 -0.17 -0.33 -1.72 0.00 0.00 179.24 177.67 1rk6 h GLU 167 N 1.00 0.93 -0.80 3.56 5.08 -1.77 -1.40 114.58 121.18 1rk6 h GLU 167 Ca 0.26 -0.38 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 1rk6 h GLU 167 Cb 0.00 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.18 1rk6 h GLU 167 CO -0.04 1.04 0.51 0.82 -1.00 0.00 0.00 179.01 180.34 1rk6 h ILE 168 N 0.77 1.21 -0.63 3.13 2.04 -0.62 0.18 117.51 123.59 1rk6 h ILE 168 Ca 0.11 -0.42 -0.01 0.00 1.00 0.00 0.00 64.86 65.55 1rk6 h ILE 168 Cb 0.74 0.06 -0.03 0.00 -0.74 0.00 0.00 36.82 36.84 1rk6 h ILE 168 CO 0.06 0.21 0.37 1.56 0.00 0.00 0.00 178.15 180.35 1rk6 h GLN 169 N 1.09 0.87 -0.46 2.37 4.20 -0.43 0.18 115.11 122.92 1rk6 h GLN 169 Ca 0.29 -0.09 -0.06 0.00 0.06 0.00 0.00 58.65 58.85 1rk6 h GLN 169 Cb -0.09 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 27.49 1rk6 h GLN 169 CO -0.06 0.64 0.05 0.00 -0.67 0.00 0.00 178.83 178.78 1rk6 h ALA 170 N 1.18 0.62 -0.55 3.87 0.00 -0.77 -1.33 119.26 122.28 1rk6 h ALA 170 Ca 0.23 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.81 1rk6 h ALA 170 Cb 0.00 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 1rk6 h ALA 170 CO -0.04 0.37 0.04 0.52 0.00 0.00 0.00 179.25 180.14 1rk6 h MET 171 N 0.64 0.95 -0.37 0.00 2.86 -0.72 -2.25 114.93 116.05 1rk6 h MET 171 Ca 0.14 -0.29 -0.06 0.00 -2.06 0.00 0.00 59.70 57.44 1rk6 h MET 171 Cb 0.43 -0.10 -0.02 0.00 0.06 0.00 0.00 31.60 31.98 1rk6 h MET 171 CO 0.01 0.94 -0.01 0.37 1.06 0.00 0.00 176.91 179.29 1rk6 h GLN 172 N 0.84 0.58 -0.46 1.72 -0.00 -0.50 -0.07 115.11 117.22 1rk6 h GLN 172 Ca 0.16 -0.13 -0.09 0.00 -0.00 0.00 0.00 58.65 58.59 1rk6 h GLN 172 Cb 0.49 -0.08 -0.02 0.00 0.00 0.00 0.00 27.48 27.87 1rk6 h GLN 172 CO 0.02 0.61 -0.06 0.00 0.00 0.00 0.00 178.83 179.40 1rk6 h ALA 173 N 1.44 0.63 -0.74 3.38 0.00 -1.01 0.17 119.26 123.13 1rk6 h ALA 173 Ca 0.12 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.65 1rk6 h ALA 173 Cb 0.37 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 1rk6 h ALA 173 CO 0.01 0.48 0.22 -0.07 0.00 0.00 0.00 179.25 179.89 1rk6 h LEU 174 N 0.69 1.09 -0.42 0.00 3.38 -0.97 -0.75 115.31 118.34 1rk6 h LEU 174 Ca 0.12 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.79 1rk6 h LEU 174 Cb 0.59 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.04 1rk6 h LEU 174 CO 0.04 1.02 -0.07 0.00 0.09 0.00 0.00 178.44 179.52 1rk6 h ALA 175 N 1.11 0.57 -0.67 1.53 0.00 -0.72 -0.65 119.26 120.44 1rk6 h ALA 175 Ca 0.24 -0.30 -0.04 0.00 0.00 0.00 0.00 54.91 54.80 1rk6 h ALA 175 Cb 0.33 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1rk6 h ALA 175 CO -0.00 0.42 0.26 0.22 0.00 0.00 0.00 179.25 180.15 1rk6 h ASP 176 N 0.61 0.92 -0.73 0.00 1.82 -0.48 -0.94 116.42 117.61 1rk6 h ASP 176 Ca 0.11 -0.18 -0.05 0.00 -0.39 0.00 0.00 57.03 56.53 1rk6 h ASP 176 Cb 0.58 -0.24 -0.03 0.00 0.68 0.00 0.00 39.33 40.32 1rk6 h ASP 176 CO 0.03 0.85 0.27 0.44 -1.61 0.00 0.00 179.24 179.23 1rk6 h ASP 177 N 0.94 1.03 -0.21 2.28 3.32 -0.98 0.19 116.42 122.99 1rk6 h ASP 177 Ca 0.22 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1rk6 h ASP 177 Cb 0.22 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1rk6 h ASP 177 CO -0.02 0.93 0.13 0.00 -1.72 0.00 0.00 179.24 178.57 1rk6 h ALA 178 N 1.13 0.27 -0.62 3.45 0.00 -0.65 -0.80 119.26 122.05 1rk6 h ALA 178 Ca 0.24 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1rk6 h ALA 178 Cb 0.24 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1rk6 h ALA 178 CO -0.02 -0.23 0.28 -0.07 0.00 0.00 0.00 179.25 179.21 1rk6 h LEU 179 N 0.27 0.83 -1.55 0.00 3.38 -0.96 -0.56 115.31 116.72 1rk6 h LEU 179 Ca 0.08 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.88 1rk6 h LEU 179 Cb -0.00 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1rk6 h LEU 179 CO -0.02 0.74 0.08 0.00 0.09 0.00 0.00 178.44 179.34 1rk6 h ALA 180 N 1.12 1.65 0.00 1.53 0.00 -0.65 -1.89 119.26 121.02 1rk6 h ALA 180 Ca 0.21 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.02 1rk6 h ALA 180 Cb 0.15 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1rk6 h ALA 180 CO -0.02 0.27 0.00 0.43 0.00 0.00 0.00 179.25 179.93 1rk6 n SER 181 N -4.40 0.49 0.00 0.00 7.64 -0.33 -4.89 113.62 112.13 1rk6 n SER 181 Ca 0.01 0.56 0.00 0.00 1.01 0.00 0.00 58.87 60.45 1rk6 n SER 181 Cb 0.15 -0.69 0.00 0.00 -1.01 0.00 0.00 64.21 62.66 1rk6 n SER 181 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rk6 n GLY 182 N 0.99 0.55 3.74 0.23 0.00 -0.71 -4.98 105.19 105.01 1rk6 n GLY 182 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1rk6 n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk6 n ALA 183 N 0.00 1.63 1.12 4.61 0.00 -0.27 -4.68 120.51 122.92 1rk6 n ALA 183 Ca 0.00 0.17 0.12 0.00 0.00 0.00 0.00 53.44 53.73 1rk6 n ALA 183 Cb 0.00 -2.35 0.18 0.00 0.00 0.00 0.00 19.45 17.28 1rk6 n ALA 183 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 1rk6 n ILE 184 N -0.78 0.00 -1.94 0.00 -5.35 0.32 -4.54 119.36 107.06 1rk6 n ILE 184 Ca 0.09 -0.29 0.00 0.00 -0.27 0.00 0.00 62.75 62.28 1rk6 n ILE 184 Cb 0.43 1.03 0.00 0.00 -1.74 0.00 0.00 39.64 39.36 1rk6 n ILE 184 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1rk6 n GLY 185 N 1.35 -1.42 3.07 3.28 0.00 -1.26 -1.76 105.19 108.46 1rk6 n GLY 185 Ca 0.12 -0.99 -0.22 0.00 0.00 0.00 0.00 46.02 44.93 1rk6 n GLY 185 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rk6 s ILE 186 N -2.59 0.99 0.21 -0.61 1.01 -0.64 -1.58 121.20 118.00 1rk6 s ILE 186 Ca 0.00 -0.51 0.11 0.00 0.00 0.00 0.00 60.65 60.25 1rk6 s ILE 186 Cb 0.00 -0.85 -0.05 0.00 0.01 0.00 0.00 42.46 41.58 1rk6 s ILE 186 CO 0.00 0.29 -0.21 -0.94 0.00 0.00 0.00 174.94 174.08 1rk6 s SER 187 N -0.12 3.56 0.16 3.58 1.04 -0.45 -1.41 113.70 120.07 1rk6 s SER 187 Ca 0.02 -0.88 0.05 0.00 0.48 0.00 0.00 55.95 55.62 1rk6 s SER 187 Cb -0.07 -0.32 -0.04 0.00 0.10 0.00 0.00 66.02 65.69 1rk6 s SER 187 CO 0.00 0.10 -0.10 0.42 0.98 0.00 0.00 173.24 174.64 1rk6 s THR 188 N -1.88 1.23 -0.47 2.02 -4.23 -0.20 -0.41 115.64 111.69 1rk6 s THR 188 Ca 0.23 -2.08 0.06 0.00 -1.18 0.00 0.00 61.69 58.73 1rk6 s THR 188 Cb -0.07 -1.89 0.23 0.00 1.34 0.00 0.00 72.50 72.10 1rk6 s THR 188 CO 0.12 -0.71 0.74 0.61 -0.54 0.00 0.00 174.62 174.84 1rk6 n GLY 189 N -0.23 0.70 0.00 3.99 0.00 -1.15 -0.77 105.19 107.73 1rk6 n GLY 189 Ca -0.10 -0.28 0.09 0.00 0.00 0.00 0.00 46.02 45.72 1rk6 n GLY 189 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk6 n ALA 190 N 1.90 1.98 0.17 4.61 0.00 -1.24 -1.70 120.51 126.23 1rk6 n ALA 190 Ca 0.15 -0.09 0.02 0.00 0.00 0.00 0.00 53.44 53.52 1rk6 n ALA 190 Cb 0.58 -1.28 0.37 0.00 0.00 0.00 0.00 19.45 19.13 1rk6 n ALA 190 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1rk6 h PHE 191 N 0.00 0.08 -3.62 0.00 3.57 -1.73 -3.26 116.94 111.97 1rk6 h PHE 191 Ca 0.00 -0.01 -0.50 0.00 3.53 0.00 0.00 57.97 60.99 1rk6 h PHE 191 Cb 0.13 -0.02 0.01 0.00 2.79 0.00 0.00 35.95 38.86 1rk6 h PHE 191 CO 0.00 0.37 0.08 0.71 -2.23 0.00 0.00 178.31 177.24 1rk6 s TYR 192 N -4.35 3.48 0.26 0.41 2.02 -0.69 -4.84 117.35 113.65 1rk6 s TYR 192 Ca -0.04 0.97 -0.01 0.00 -0.37 0.00 0.00 57.07 57.62 1rk6 s TYR 192 Cb 0.15 -2.38 0.57 0.00 -0.40 0.00 0.00 41.96 39.89 1rk6 s TYR 192 CO 0.73 -0.09 1.70 -1.35 -1.57 0.00 0.00 175.55 174.97 1rk6 h PRO 193 N 1.19 0.37 0.00 -1.71 0.11 -1.88 -0.52 132.00 129.56 1rk6 h PRO 193 Ca -0.47 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.62 1rk6 h PRO 193 Cb 1.19 -0.08 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 1rk6 h PRO 193 CO 0.64 0.24 -0.00 -1.35 -0.21 0.00 0.00 178.00 177.32 1rk6 h PRO 194 N 0.38 0.00 0.00 1.05 0.11 -1.92 -3.06 132.00 128.56 1rk6 h PRO 194 Ca 0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.59 1rk6 h PRO 194 Cb 0.83 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.94 1rk6 h PRO 194 CO -0.49 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 177.30 1rk6 n ALA 195 N -2.11 1.67 0.29 -0.75 0.00 -0.67 -4.77 120.51 114.18 1rk6 n ALA 195 Ca -0.03 -0.61 0.14 0.00 0.00 0.00 0.00 53.44 52.95 1rk6 n ALA 195 Cb 0.09 0.00 0.88 0.00 0.00 0.00 0.00 19.45 20.41 1rk6 n ALA 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rk6 h ALA 196 N 0.00 1.53 -0.25 0.00 0.00 -1.02 -0.54 119.26 118.98 1rk6 h ALA 196 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rk6 h ALA 196 Cb 0.44 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.23 1rk6 h ALA 196 CO 0.00 0.02 0.00 0.72 0.00 0.00 0.00 179.25 179.99 1rk6 n HIS 197 N -3.87 0.32 -2.47 0.00 8.25 -1.26 -4.90 115.22 111.29 1rk6 n HIS 197 Ca -0.03 -0.16 -0.42 0.00 -0.26 0.00 0.00 57.72 56.85 1rk6 n HIS 197 Cb 0.10 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.18 1rk6 n HIS 197 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1rk6 s ALA 198 N -1.68 3.37 0.65 -1.41 0.00 -0.21 -3.13 121.76 119.35 1rk6 s ALA 198 Ca 0.35 0.82 -0.09 0.00 0.00 0.00 0.00 51.96 53.04 1rk6 s ALA 198 Cb 0.20 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.93 1rk6 s ALA 198 CO 0.29 -0.36 1.00 -1.54 0.00 0.00 0.00 175.76 175.16 1rk6 s SER 199 N 0.74 5.47 0.23 0.00 1.04 -1.26 -4.95 113.70 114.97 1rk6 s SER 199 Ca 0.56 0.90 -0.08 0.00 0.48 0.00 0.00 55.95 57.81 1rk6 s SER 199 Cb -0.29 -1.78 0.20 0.00 0.10 0.00 0.00 66.02 64.25 1rk6 s SER 199 CO 0.31 -1.23 1.86 0.74 0.98 0.00 0.00 173.24 175.90 1rk6 h THR 200 N -0.44 1.25 -0.79 2.02 2.02 -2.00 -2.37 112.91 112.60 1rk6 h THR 200 Ca -0.45 -0.57 -0.05 0.00 0.77 0.00 0.00 66.41 66.11 1rk6 h THR 200 Cb 1.26 0.05 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 1rk6 h THR 200 CO 0.62 0.27 0.30 -0.08 0.37 0.00 0.00 175.52 177.00 1rk6 h GLU 201 N 1.20 1.19 -0.31 6.66 4.57 -1.99 -1.23 114.58 124.68 1rk6 h GLU 201 Ca 0.31 -0.23 0.02 0.00 -1.18 0.00 0.00 59.36 58.28 1rk6 h GLU 201 Cb -0.02 -0.19 -0.02 0.00 -0.16 0.00 0.00 28.75 28.36 1rk6 h GLU 201 CO -0.05 0.97 0.16 1.49 -1.18 0.00 0.00 179.01 180.40 1rk6 h GLU 202 N 1.16 0.32 -0.34 1.92 4.81 -1.85 -0.31 114.58 120.29 1rk6 h GLU 202 Ca 0.26 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.48 1rk6 h GLU 202 Cb 0.24 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1rk6 h GLU 202 CO -0.02 0.21 0.22 0.82 -0.73 0.00 0.00 179.01 179.51 1rk6 h ILE 203 N 0.32 1.09 -0.22 2.32 2.04 -1.06 -1.35 117.51 120.67 1rk6 h ILE 203 Ca 0.13 -0.18 0.01 0.00 1.00 0.00 0.00 64.86 65.82 1rk6 h ILE 203 Cb 0.04 0.60 -0.01 0.00 -0.74 0.00 0.00 36.82 36.70 1rk6 h ILE 203 CO -0.08 0.09 0.12 0.40 0.00 0.00 0.00 178.15 178.68 1rk6 h ILE 204 N 0.46 1.02 -0.74 -0.67 2.04 -0.91 -1.67 117.51 117.04 1rk6 h ILE 204 Ca 0.13 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.86 1rk6 h ILE 204 Cb -0.05 0.74 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 1rk6 h ILE 204 CO -0.03 0.05 0.33 -0.33 0.00 0.00 0.00 178.15 178.17 1rk6 h GLU 205 N 0.26 1.08 -0.19 2.37 4.39 -0.80 -1.92 114.58 119.77 1rk6 h GLU 205 Ca 0.08 -0.17 -0.07 0.00 0.34 0.00 0.00 59.36 59.54 1rk6 h GLU 205 Cb -0.00 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.45 1rk6 h GLU 205 CO -0.04 0.86 -0.19 0.28 -1.16 0.00 0.00 179.01 178.76 1rk6 h VAL 206 N 1.05 1.23 -0.01 3.13 2.07 -1.07 -3.09 116.25 119.56 1rk6 h VAL 206 Ca 0.25 -1.04 0.00 0.00 0.82 0.00 0.00 66.70 66.73 1rk6 h VAL 206 Cb 0.16 1.30 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 1rk6 h VAL 206 CO -0.03 0.32 -0.12 0.00 0.02 0.00 0.00 177.57 177.76 1rk6 h ARG 208 N 1.42 0.23 0.00 0.00 2.47 -1.28 -1.29 114.38 115.93 1rk6 h ARG 208 Ca 0.00 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1rk6 h ARG 208 Cb 0.45 -0.05 0.00 0.00 -1.65 0.00 0.00 29.97 28.71 1rk6 h ARG 208 CO 0.00 0.15 0.00 -1.35 0.56 0.00 0.00 179.97 179.33 1rk6 h PRO 209 N 0.23 0.00 -0.81 0.04 0.11 -1.85 -3.02 132.00 126.70 1rk6 h PRO 209 Ca 0.68 0.00 0.08 0.00 0.11 0.00 0.00 66.00 66.87 1rk6 h PRO 209 Cb 1.52 0.00 -0.05 0.00 0.11 0.00 0.00 31.00 32.58 1rk6 h PRO 209 CO -0.66 0.00 0.53 -0.07 -0.21 0.00 0.00 178.00 177.59 1rk6 h LEU 210 N 0.00 0.73 -0.42 2.35 3.38 -1.58 -2.05 115.31 117.71 1rk6 h LEU 210 Ca 0.00 0.01 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 1rk6 h LEU 210 Cb 0.01 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 1rk6 h LEU 210 CO 0.00 0.45 0.09 -0.29 0.09 0.00 0.00 178.44 178.78 1rk6 h ILE 211 N 0.82 1.24 -0.83 1.22 6.09 -1.77 0.18 117.51 124.46 1rk6 h ILE 211 Ca 0.36 -0.84 -0.04 0.00 -1.37 0.00 0.00 64.86 62.98 1rk6 h ILE 211 Cb 0.34 0.98 -0.04 0.00 0.47 0.00 0.00 36.82 38.57 1rk6 h ILE 211 CO -0.14 0.29 0.38 0.74 -3.07 0.00 0.00 178.15 176.35 1rk6 h THR 212 N 0.55 1.26 -0.01 2.19 2.02 -1.63 -2.93 112.91 114.35 1rk6 h THR 212 Ca 0.13 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.56 1rk6 h THR 212 Cb 0.35 0.22 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 1rk6 h THR 212 CO 0.00 0.32 -0.21 1.41 0.37 0.00 0.00 175.52 177.41 1rk6 n HIS 213 N -4.30 0.00 -3.21 3.16 8.25 -0.82 -4.97 115.22 113.33 1rk6 n HIS 213 Ca 0.08 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.38 1rk6 n HIS 213 Cb 0.15 -0.04 0.05 0.00 1.12 0.00 0.00 29.99 31.27 1rk6 n HIS 213 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1rk6 n GLY 214 N 1.32 -0.03 4.02 -1.41 0.00 0.46 -5.02 105.19 104.53 1rk6 n GLY 214 Ca 0.13 -0.07 -0.20 0.00 0.00 0.00 0.00 46.02 45.89 1rk6 n GLY 214 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1rk6 s GLY 215 N -3.20 1.81 0.22 -0.02 0.00 -0.27 -4.97 107.32 100.89 1rk6 s GLY 215 Ca 0.38 -2.02 0.08 0.00 0.00 0.00 0.00 44.72 43.16 1rk6 s GLY 215 CO 0.47 -1.69 0.05 -1.34 0.00 0.00 0.00 173.10 170.59 1rk6 s VAL 216 N -2.65 3.82 -0.24 1.40 -7.23 -0.72 -4.48 120.40 110.30 1rk6 s VAL 216 Ca 0.59 -1.56 -0.06 0.00 -1.81 0.00 0.00 61.98 59.13 1rk6 s VAL 216 Cb -0.06 -2.99 -0.02 0.00 0.56 0.00 0.00 36.38 33.87 1rk6 s VAL 216 CO 0.37 -0.25 0.04 -0.47 -0.31 0.00 0.00 175.10 174.48 1rk6 s TYR 217 N -2.01 3.05 0.05 2.82 5.04 -0.30 -1.61 117.35 124.39 1rk6 s TYR 217 Ca 0.30 -0.64 0.07 0.00 -2.44 0.00 0.00 57.07 54.36 1rk6 s TYR 217 Cb -0.08 -2.20 -0.03 0.00 0.35 0.00 0.00 41.96 40.00 1rk6 s TYR 217 CO 0.21 -0.44 -0.15 0.00 -1.34 0.00 0.00 175.55 173.83 1rk6 s ALA 218 N 1.56 2.73 -0.11 3.97 0.00 -0.50 -0.26 121.76 129.15 1rk6 s ALA 218 Ca 0.06 -1.19 -0.09 0.00 0.00 0.00 0.00 51.96 50.74 1rk6 s ALA 218 Cb -0.15 -0.82 0.03 0.00 0.00 0.00 0.00 23.12 22.19 1rk6 s ALA 218 CO 0.01 0.59 0.28 -0.08 0.00 0.00 0.00 175.76 176.57 1rk6 s THR 219 N -1.01 -0.01 -0.50 0.00 -1.32 -0.21 -1.04 115.64 111.55 1rk6 s THR 219 Ca 0.16 0.04 -0.21 0.00 -1.21 0.00 0.00 61.69 60.48 1rk6 s THR 219 Cb -0.11 -0.41 0.05 0.00 -1.51 0.00 0.00 72.50 70.52 1rk6 s THR 219 CO 0.07 0.02 0.70 -2.28 -2.21 0.00 0.00 174.62 170.92 1rk6 s HIS 220 N 0.52 3.00 0.74 9.09 5.65 0.05 -0.87 115.29 133.47 1rk6 s HIS 220 Ca -0.03 -0.33 -0.16 0.00 0.25 0.00 0.00 55.06 54.80 1rk6 s HIS 220 Cb -0.05 -3.61 0.01 0.00 -1.18 0.00 0.00 32.58 27.75 1rk6 s HIS 220 CO -0.03 -1.07 0.89 -1.33 -0.65 0.00 0.00 174.74 172.56 1rk6 n MET 221 N 6.47 0.42 -0.04 2.88 0.00 -1.26 -3.72 117.12 121.87 1rk6 n MET 221 Ca -0.04 0.20 0.14 0.00 0.00 0.00 0.00 57.70 58.00 1rk6 n MET 221 Cb 0.46 -2.16 0.57 0.00 0.00 0.00 0.00 33.22 32.09 1rk6 n MET 221 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 1rk6 h ARG 222 N -0.37 0.25 -2.86 0.03 2.43 -1.89 -3.38 114.38 108.59 1rk6 h ARG 222 Ca -0.47 -0.01 -0.12 0.00 -0.81 0.00 0.00 59.98 58.57 1rk6 h ARG 222 Cb 1.33 -0.06 -0.22 0.00 -0.42 0.00 0.00 29.97 30.61 1rk6 h ARG 222 CO 0.46 0.16 -0.24 0.34 -1.51 0.00 0.00 179.97 179.18 1rk6 s ASP 223 N -6.28 -0.32 -0.10 -3.80 -1.08 -1.26 -3.98 116.67 99.84 1rk6 s ASP 223 Ca -0.07 0.46 0.14 0.00 -0.52 0.00 0.00 52.55 52.56 1rk6 s ASP 223 Cb 0.20 0.56 0.25 0.00 -1.46 0.00 0.00 42.92 42.46 1rk6 s ASP 223 CO 0.74 -0.31 1.13 -0.62 0.52 0.00 0.00 175.17 176.63 1rk6 n GLU 224 N 2.01 0.96 0.00 4.34 1.02 -1.26 -4.26 120.64 123.45 1rk6 n GLU 224 Ca -0.17 -2.29 0.00 0.00 -0.02 0.00 0.00 57.16 54.68 1rk6 n GLU 224 Cb 0.57 -1.21 0.00 0.00 -0.02 0.00 0.00 31.44 30.78 1rk6 n GLU 224 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1rk6 n GLY 225 N -0.97 2.73 0.37 0.62 0.00 -1.26 -1.56 105.19 105.12 1rk6 n GLY 225 Ca 0.12 -0.22 0.15 0.00 0.00 0.00 0.00 46.02 46.08 1rk6 n GLY 225 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1rk6 h GLU 226 N 0.00 0.65 -0.69 1.61 4.81 -1.95 -1.70 114.58 117.31 1rk6 h GLU 226 Ca 0.00 -0.04 -0.35 0.00 -0.13 0.00 0.00 59.36 58.85 1rk6 h GLU 226 Cb 0.00 -0.15 -0.21 0.00 0.63 0.00 0.00 28.75 29.03 1rk6 h GLU 226 CO 0.00 0.43 0.30 0.72 -0.73 0.00 0.00 179.01 179.73 1rk6 n HIS 227 N -4.72 2.13 0.18 0.92 8.25 -1.26 -4.64 115.22 116.08 1rk6 n HIS 227 Ca 0.23 -1.69 0.02 0.00 -0.26 0.00 0.00 57.72 56.02 1rk6 n HIS 227 Cb 0.63 -0.72 0.37 0.00 1.12 0.00 0.00 29.99 31.38 1rk6 n HIS 227 CO 0.00 0.00 0.00 0.97 0.64 0.00 0.00 176.34 177.95 1rk6 h ILE 228 N 1.11 1.25 -0.45 1.59 2.10 -1.48 -1.69 117.51 119.93 1rk6 h ILE 228 Ca 0.43 -1.19 -0.05 0.00 1.08 0.00 0.00 64.86 65.13 1rk6 h ILE 228 Cb 2.29 1.62 -0.02 0.00 -1.09 0.00 0.00 36.82 39.62 1rk6 h ILE 228 CO 0.76 0.34 0.09 0.58 -1.08 0.00 0.00 178.15 178.84 1rk6 h VAL 229 N 0.02 1.24 -0.53 2.19 2.07 -1.83 0.14 116.25 119.55 1rk6 h VAL 229 Ca 0.00 -0.86 -0.04 0.00 0.82 0.00 0.00 66.70 66.62 1rk6 h VAL 229 Cb 0.61 0.93 -0.02 0.00 -1.52 0.00 0.00 31.29 31.29 1rk6 h VAL 229 CO 0.05 0.30 0.15 1.56 0.02 0.00 0.00 177.57 179.64 1rk6 h GLN 230 N 0.61 0.79 -0.24 1.57 7.50 -1.81 0.14 115.11 123.68 1rk6 h GLN 230 Ca 0.14 -0.15 -0.15 0.00 0.50 0.00 0.00 58.65 58.99 1rk6 h GLN 230 Cb 0.35 -0.13 -0.01 0.00 0.05 0.00 0.00 27.48 27.75 1rk6 h GLN 230 CO 0.01 0.70 -0.47 0.00 -1.50 0.00 0.00 178.83 177.57 1rk6 h ALA 231 N 1.39 0.73 -0.26 3.87 0.00 -0.79 -0.69 119.26 123.51 1rk6 h ALA 231 Ca 0.17 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1rk6 h ALA 231 Cb 0.26 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1rk6 h ALA 231 CO -0.01 0.67 0.02 -0.07 0.00 0.00 0.00 179.25 179.86 1rk6 h LEU 232 N 0.50 0.44 -1.18 0.00 3.38 -0.36 -1.62 115.31 116.47 1rk6 h LEU 232 Ca 0.03 -0.29 -0.02 0.00 0.09 0.00 0.00 57.88 57.68 1rk6 h LEU 232 Cb 1.01 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.61 1rk6 h LEU 232 CO 0.09 0.62 0.27 -0.33 0.09 0.00 0.00 178.44 179.18 1rk6 h GLU 233 N 0.24 0.84 -0.44 1.13 4.39 -0.81 0.50 114.58 120.44 1rk6 h GLU 233 Ca 0.08 -0.11 -0.03 0.00 0.34 0.00 0.00 59.36 59.63 1rk6 h GLU 233 Cb 0.39 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.86 1rk6 h GLU 233 CO 0.01 0.67 0.17 1.49 -1.16 0.00 0.00 179.01 180.18 1rk6 h GLU 234 N 0.84 0.66 -0.55 2.33 4.81 -0.95 -1.00 114.58 120.73 1rk6 h GLU 234 Ca 0.21 -0.13 -0.02 0.00 -0.13 0.00 0.00 59.36 59.29 1rk6 h GLU 234 Cb 0.11 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.37 1rk6 h GLU 234 CO -0.02 0.62 0.27 1.15 -0.73 0.00 0.00 179.01 180.30 1rk6 h THR 235 N 0.57 1.20 -0.60 0.32 2.02 -0.47 -0.18 112.91 115.76 1rk6 h THR 235 Ca 0.14 -0.54 -0.08 0.00 0.77 0.00 0.00 66.41 66.70 1rk6 h THR 235 Cb 0.21 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.14 1rk6 h THR 235 CO -0.01 0.22 0.06 -0.26 0.37 0.00 0.00 175.52 175.90 1rk6 h PHE 236 N 0.74 1.07 -0.31 3.16 0.04 -0.73 -1.34 116.94 119.57 1rk6 h PHE 236 Ca 0.19 -0.15 -0.02 0.00 2.80 0.00 0.00 57.97 60.79 1rk6 h PHE 236 Cb 0.10 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 1rk6 h PHE 236 CO -0.01 0.92 0.13 -0.09 -0.60 0.00 0.00 178.31 178.67 1rk6 h ARG 237 N 0.94 0.46 -0.63 1.51 9.65 -0.82 -1.25 114.38 124.24 1rk6 h ARG 237 Ca 0.18 -0.08 0.04 0.00 -1.10 0.00 0.00 59.98 59.03 1rk6 h ARG 237 Cb 0.46 -0.08 -0.05 0.00 -1.39 0.00 0.00 29.97 28.91 1rk6 h ARG 237 CO 0.02 0.46 0.37 0.82 2.80 0.00 0.00 179.97 184.43 1rk6 h ILE 238 N 0.36 1.03 -0.82 1.20 2.04 -0.81 -0.58 117.51 119.94 1rk6 h ILE 238 Ca 0.11 -0.24 0.04 0.00 1.00 0.00 0.00 64.86 65.76 1rk6 h ILE 238 Cb 0.16 0.25 -0.05 0.00 -0.74 0.00 0.00 36.82 36.44 1rk6 h ILE 238 CO -0.01 0.13 0.52 1.23 0.00 0.00 0.00 178.15 180.01 1rk6 h GLY 239 N 0.71 1.20 1.17 5.37 0.00 -0.83 0.34 103.07 111.04 1rk6 h GLY 239 Ca 0.27 -0.38 -0.13 0.00 0.00 0.00 0.00 47.33 47.09 1rk6 h GLY 239 CO -0.14 0.30 -0.20 3.21 0.00 0.00 0.00 176.54 179.71 1rk6 h ARG 240 N 0.98 0.95 -0.26 4.80 3.08 -0.51 0.14 114.38 123.55 1rk6 h ARG 240 Ca 0.34 -0.39 -0.13 0.00 0.07 0.00 0.00 59.98 59.86 1rk6 h ARG 240 Cb 0.07 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1rk6 h ARG 240 CO -0.13 1.06 -0.39 0.93 -1.07 0.00 0.00 179.97 180.36 1rk6 h GLU 241 N 0.82 0.61 0.00 0.04 4.39 -0.67 -3.11 114.58 116.66 1rk6 h GLU 241 Ca 0.11 -0.31 -0.16 0.00 0.34 0.00 0.00 59.36 59.34 1rk6 h GLU 241 Cb 0.77 0.00 -0.02 0.00 -0.10 0.00 0.00 28.75 29.40 1rk6 h GLU 241 CO 0.06 0.90 -0.86 -0.07 -1.16 0.00 0.00 179.01 177.89 1rk6 h LEU 242 N 0.51 0.00 -1.18 1.33 3.38 -0.86 -3.48 115.31 115.01 1rk6 h LEU 242 Ca 0.05 0.00 -0.36 0.00 0.09 0.00 0.00 57.88 57.66 1rk6 h LEU 242 Cb 0.90 0.00 0.15 0.00 0.09 0.00 0.00 40.66 41.79 1rk6 h LEU 242 CO 0.08 0.74 -0.69 -0.67 0.09 0.00 0.00 178.44 177.98 1rk6 n ASP 243 N -3.23 -4.57 -4.20 -0.43 2.03 0.48 -4.59 116.55 102.04 1rk6 n ASP 243 Ca -0.01 -0.55 -0.12 0.00 0.52 0.00 0.00 54.79 54.63 1rk6 n ASP 243 Cb 0.85 -4.93 -0.10 0.00 -0.72 0.00 0.00 41.12 36.21 1rk6 n ASP 243 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1rk6 s VAL 244 N -3.33 0.36 0.33 5.18 -7.23 -1.22 -4.89 120.40 109.60 1rk6 s VAL 244 Ca 0.34 -1.95 -0.29 0.00 -1.81 0.00 0.00 61.98 58.28 1rk6 s VAL 244 Cb -0.15 -2.12 -0.10 0.00 0.56 0.00 0.00 36.38 34.57 1rk6 s VAL 244 CO 0.71 -0.43 1.31 -2.84 -0.31 0.00 0.00 175.10 173.54 1rk6 s PRO 245 N -4.00 4.35 0.03 4.82 0.02 -1.26 -4.80 135.00 134.17 1rk6 s PRO 245 Ca 0.25 2.22 0.04 0.00 0.02 0.00 0.00 61.00 63.53 1rk6 s PRO 245 Cb 0.07 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 31.48 1rk6 s PRO 245 CO 0.04 -0.20 -0.06 0.14 -0.33 0.00 0.00 177.00 176.59 1rk6 s VAL 246 N -1.08 3.70 -0.14 3.83 -7.23 -0.64 -1.15 120.40 117.69 1rk6 s VAL 246 Ca 0.49 -0.87 0.00 0.00 -1.81 0.00 0.00 61.98 59.79 1rk6 s VAL 246 Cb -0.40 -2.66 0.02 0.00 0.56 0.00 0.00 36.38 33.91 1rk6 s VAL 246 CO 0.52 0.30 -0.13 -0.69 -0.31 0.00 0.00 175.10 174.79 1rk6 s VAL 247 N -1.09 1.50 -0.32 1.32 1.01 0.64 -0.87 120.40 122.59 1rk6 s VAL 247 Ca 0.19 -0.59 -0.22 0.00 0.00 0.00 0.00 61.98 61.36 1rk6 s VAL 247 Cb -0.11 -1.42 -0.00 0.00 0.00 0.00 0.00 36.38 34.85 1rk6 s VAL 247 CO 0.10 0.45 0.72 -0.63 0.00 0.00 0.00 175.10 175.74 1rk6 s ILE 248 N 1.51 4.84 0.35 2.22 1.01 0.13 -1.04 121.20 130.21 1rk6 s ILE 248 Ca 0.05 0.94 -0.26 0.00 0.00 0.00 0.00 60.65 61.39 1rk6 s ILE 248 Cb -0.13 -4.11 -0.10 0.00 0.01 0.00 0.00 42.46 38.14 1rk6 s ILE 248 CO -0.10 -0.26 0.99 -0.44 0.00 0.00 0.00 174.94 175.13 1rk6 s SER 249 N 1.69 7.13 -0.76 3.58 0.01 -0.05 -1.67 113.70 123.63 1rk6 s SER 249 Ca 0.29 1.94 -0.18 0.00 1.31 0.00 0.00 55.95 59.31 1rk6 s SER 249 Cb -0.14 -2.59 0.03 0.00 0.21 0.00 0.00 66.02 63.53 1rk6 s SER 249 CO 0.13 -0.22 0.45 0.00 0.41 0.00 0.00 173.24 174.01 1rk6 n HIS 250 N 0.39 -1.04 -1.90 2.43 -0.00 -1.04 -4.77 115.22 109.28 1rk6 n HIS 250 Ca 0.03 0.16 -0.41 0.00 -0.00 0.00 0.00 57.72 57.50 1rk6 n HIS 250 Cb 0.49 -1.87 -0.01 0.00 -0.00 0.00 0.00 29.99 28.61 1rk6 n HIS 250 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 1rk6 s HIS 251 N -3.67 2.80 0.09 -1.40 2.46 0.15 -4.94 115.29 110.80 1rk6 s HIS 251 Ca 0.25 1.10 -0.27 0.00 0.47 0.00 0.00 55.06 56.62 1rk6 s HIS 251 Cb -0.14 -3.92 0.08 0.00 -0.13 0.00 0.00 32.58 28.46 1rk6 s HIS 251 CO 0.65 -2.83 0.99 -1.59 -2.47 0.00 0.00 174.74 169.49 1rk6 s LYS 252 N -1.33 1.01 -0.17 2.88 -2.85 -1.26 -4.83 119.74 113.18 1rk6 s LYS 252 Ca 0.56 -0.52 0.00 0.00 -1.00 0.00 0.00 55.97 55.01 1rk6 s LYS 252 Cb -0.44 0.36 0.03 0.00 -2.06 0.00 0.00 37.83 35.72 1rk6 s LYS 252 CO 0.54 -0.46 -0.11 0.14 0.10 0.00 0.00 175.35 175.56 1rk6 s VAL 253 N -3.13 1.49 -0.01 1.79 -7.23 -1.26 -4.85 120.40 107.19 1rk6 s VAL 253 Ca 0.11 -0.77 -0.00 0.00 -1.81 0.00 0.00 61.98 59.51 1rk6 s VAL 253 Cb -0.01 -1.52 -0.04 0.00 0.56 0.00 0.00 36.38 35.38 1rk6 s VAL 253 CO -0.01 0.27 0.06 0.00 -0.31 0.00 0.00 175.10 175.11 1rk6 s MET 254 N 1.49 3.00 0.00 4.82 0.23 -0.60 -4.66 119.30 123.57 1rk6 s MET 254 Ca 0.02 -0.50 0.00 0.00 -1.03 0.00 0.00 55.69 54.17 1rk6 s MET 254 Cb -0.15 -2.82 0.00 0.00 -1.53 0.00 0.00 34.83 30.34 1rk6 s MET 254 CO -0.09 0.65 0.00 0.41 -2.03 0.00 0.00 175.02 173.96 1rk6 n GLY 255 N 1.31 0.59 0.41 3.16 0.00 -0.04 -4.43 105.19 106.18 1rk6 n GLY 255 Ca -0.14 -1.47 0.20 0.00 0.00 0.00 0.00 46.02 44.61 1rk6 n GLY 255 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1rk6 h LYS 256 N 0.00 0.37 0.00 1.61 1.63 -1.94 0.95 116.57 119.18 1rk6 h LYS 256 Ca 0.00 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.78 1rk6 h LYS 256 Cb 0.00 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 31.55 1rk6 h LYS 256 CO 0.00 0.24 0.00 1.28 -3.45 0.00 0.00 179.45 177.52 1rk6 n LEU 257 N -4.50 0.00 -0.22 5.20 4.77 -1.26 -2.73 117.00 118.26 1rk6 n LEU 257 Ca 0.19 0.49 0.03 0.00 -0.03 0.00 0.00 56.01 56.69 1rk6 n LEU 257 Cb 0.72 -0.49 0.03 0.00 -2.33 0.00 0.00 43.42 41.35 1rk6 n LEU 257 CO 0.31 -0.22 0.36 0.59 -1.33 0.00 0.00 177.39 177.10 1rk6 n ASN 258 N -1.49 1.56 -4.76 -1.43 3.02 0.30 -5.00 115.26 107.47 1rk6 n ASN 258 Ca 0.04 -1.31 -0.41 0.00 -0.03 0.00 0.00 54.58 52.86 1rk6 n ASN 258 Cb 0.18 -0.01 -0.01 0.00 -0.61 0.00 0.00 39.78 39.33 1rk6 n ASN 258 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1rk6 s PHE 259 N -0.50 2.70 0.00 3.10 0.08 -1.06 -1.37 117.98 120.94 1rk6 s PHE 259 Ca 0.07 0.84 0.00 0.00 0.12 0.00 0.00 56.93 57.96 1rk6 s PHE 259 Cb 0.05 -4.07 0.00 0.00 -0.57 0.00 0.00 43.02 38.42 1rk6 s PHE 259 CO 0.07 -3.52 0.00 0.41 -0.10 0.00 0.00 175.22 172.07 1rk6 n GLY 260 N 1.82 2.00 0.00 4.36 0.00 -1.26 -4.92 105.19 107.19 1rk6 n GLY 260 Ca 0.07 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.19 1rk6 n GLY 260 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk6 n ARG 261 N -2.00 0.45 0.26 1.61 1.74 -0.47 -2.79 116.66 115.45 1rk6 n ARG 261 Ca 0.00 0.05 0.11 0.00 -0.77 0.00 0.00 57.85 57.24 1rk6 n ARG 261 Cb 0.00 -1.50 0.72 0.00 -1.02 0.00 0.00 32.46 30.66 1rk6 n ARG 261 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1rk6 h SER 262 N 0.00 0.00 -0.27 0.55 0.02 -1.91 -0.66 113.55 111.28 1rk6 h SER 262 Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1rk6 h SER 262 Cb 0.10 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 1rk6 h SER 262 CO 0.00 0.00 0.15 0.50 -1.14 0.00 0.00 176.83 176.34 1rk6 h LYS 263 N 0.00 0.37 -0.29 3.45 3.64 -1.93 -0.85 116.57 120.95 1rk6 h LYS 263 Ca 0.01 -0.04 -0.06 0.00 -1.27 0.00 0.00 60.65 59.30 1rk6 h LYS 263 Cb 0.06 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 1rk6 h LYS 263 CO -0.00 0.32 -0.04 1.49 -2.27 0.00 0.00 179.45 178.94 1rk6 h GLU 264 N 0.32 0.54 -0.47 1.90 4.81 -1.50 -2.29 114.58 117.89 1rk6 h GLU 264 Ca 0.09 -0.19 -0.11 0.00 -0.13 0.00 0.00 59.36 59.02 1rk6 h GLU 264 Cb 0.05 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.38 1rk6 h GLU 264 CO -0.02 0.72 -0.14 1.79 -0.73 0.00 0.00 179.01 180.63 1rk6 h THR 265 N 0.31 1.27 -0.15 0.32 1.35 -1.08 -1.79 112.91 113.14 1rk6 h THR 265 Ca 0.08 -1.28 -0.09 0.00 -0.55 0.00 0.00 66.41 64.57 1rk6 h THR 265 Cb 0.50 1.11 -0.01 0.00 -1.73 0.00 0.00 68.15 68.02 1rk6 h THR 265 CO 0.02 0.44 -0.29 -0.07 -0.25 0.00 0.00 175.52 175.38 1rk6 h LEU 266 N 0.78 0.28 -0.56 3.87 3.38 -1.19 -0.34 115.31 121.54 1rk6 h LEU 266 Ca 0.12 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 57.88 1rk6 h LEU 266 Cb 0.70 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 1rk6 h LEU 266 CO 0.05 0.57 -0.09 0.00 0.09 0.00 0.00 178.44 179.06 1rk6 h ALA 267 N 1.45 0.76 -0.55 1.53 0.00 -1.12 0.11 119.26 121.43 1rk6 h ALA 267 Ca 0.04 -0.35 -0.09 0.00 0.00 0.00 0.00 54.91 54.51 1rk6 h ALA 267 Cb 0.65 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.22 1rk6 h ALA 267 CO 0.05 0.67 0.01 -0.07 0.00 0.00 0.00 179.25 179.90 1rk6 h LEU 268 N 0.93 0.96 -0.36 0.00 3.38 -0.67 -1.56 115.31 117.98 1rk6 h LEU 268 Ca 0.15 -0.30 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 1rk6 h LEU 268 Cb 0.67 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1rk6 h LEU 268 CO 0.05 1.03 0.05 0.40 0.09 0.00 0.00 178.44 180.05 1rk6 h ILE 269 N 0.86 1.24 -0.83 1.22 2.04 -0.87 -1.32 117.51 119.84 1rk6 h ILE 269 Ca 0.16 -0.87 -0.01 0.00 1.00 0.00 0.00 64.86 65.14 1rk6 h ILE 269 Cb 0.53 1.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.68 1rk6 h ILE 269 CO 0.03 0.29 0.48 -0.08 0.00 0.00 0.00 178.15 178.87 1rk6 h GLU 270 N 0.44 1.14 -0.41 2.37 4.81 -0.70 -0.70 114.58 121.53 1rk6 h GLU 270 Ca 0.11 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 1rk6 h GLU 270 Cb 0.38 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.51 1rk6 h GLU 270 CO 0.01 0.82 0.16 0.00 -0.73 0.00 0.00 179.01 179.27 1rk6 h ALA 271 N 1.26 0.54 -0.70 2.92 0.00 -1.12 -2.75 119.26 119.41 1rk6 h ALA 271 Ca 0.30 -0.15 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1rk6 h ALA 271 Cb -0.01 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1rk6 h ALA 271 CO -0.05 0.16 0.33 0.00 0.00 0.00 0.00 179.25 179.68 1rk6 h ALA 272 N 1.00 1.27 0.00 0.00 0.00 -0.78 -2.24 119.26 118.51 1rk6 h ALA 272 Ca 0.14 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 1rk6 h ALA 272 Cb 0.21 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.72 1rk6 h ALA 272 CO -0.01 0.56 -0.01 0.52 0.00 0.00 0.00 179.25 180.32 1rk6 h MET 273 N 0.99 0.00 0.00 0.00 2.07 -0.84 0.03 114.93 117.18 1rk6 h MET 273 Ca 0.24 0.00 -0.05 0.00 -2.07 0.00 0.00 59.70 57.82 1rk6 h MET 273 Cb 0.11 0.00 -0.01 0.00 -1.87 0.00 0.00 31.60 29.83 1rk6 h MET 273 CO -0.03 0.01 -0.24 0.00 1.07 0.00 0.00 176.91 177.72 1rk6 h ALA 274 N 1.99 0.97 0.00 6.32 0.00 -1.29 -3.34 119.26 123.91 1rk6 h ALA 274 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1rk6 h ALA 274 Cb 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1rk6 h ALA 274 CO 0.00 0.30 -0.41 -1.13 0.00 0.00 0.00 179.25 178.01 1rk6 n SER 275 N -3.34 1.54 -3.99 0.00 3.41 -0.46 -5.08 113.62 105.71 1rk6 n SER 275 Ca 0.01 -0.37 -0.10 0.00 -0.26 0.00 0.00 58.87 58.15 1rk6 n SER 275 Cb 0.47 1.03 -0.06 0.00 -0.26 0.00 0.00 64.21 65.39 1rk6 n SER 275 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1rk6 s GLN 276 N -1.49 1.42 -0.55 4.33 -2.07 -0.13 -5.12 119.66 116.06 1rk6 s GLN 276 Ca 0.00 -1.25 -0.25 0.00 -1.82 0.00 0.00 55.36 52.04 1rk6 s GLN 276 Cb 0.01 0.43 0.04 0.00 -1.09 0.00 0.00 33.01 32.40 1rk6 s GLN 276 CO 0.08 -0.57 0.99 0.34 -1.32 0.00 0.00 175.29 174.81 1rk6 s ASP 277 N -3.01 6.38 -0.01 12.60 -1.08 -1.26 -4.11 116.67 126.18 1rk6 s ASP 277 Ca 0.22 -0.19 0.03 0.00 -0.52 0.00 0.00 52.55 52.09 1rk6 s ASP 277 Cb 0.01 -2.46 -0.01 0.00 -1.46 0.00 0.00 42.92 39.00 1rk6 s ASP 277 CO 0.07 -1.26 -0.11 -0.69 0.52 0.00 0.00 175.17 173.70 1rk6 s VAL 278 N 4.14 0.85 0.22 1.11 1.01 -1.26 -1.62 120.40 124.84 1rk6 s VAL 278 Ca 0.34 -0.46 0.01 0.00 0.00 0.00 0.00 61.98 61.87 1rk6 s VAL 278 Cb -0.11 -0.71 -0.05 0.00 0.00 0.00 0.00 36.38 35.51 1rk6 s VAL 278 CO 0.21 0.24 0.07 -0.44 0.00 0.00 0.00 175.10 175.18 1rk6 s SER 279 N -0.26 0.97 0.07 3.32 0.01 -0.05 -4.91 113.70 112.86 1rk6 s SER 279 Ca 0.04 -1.31 -0.24 0.00 1.31 0.00 0.00 55.95 55.75 1rk6 s SER 279 Cb -0.04 0.19 0.06 0.00 0.21 0.00 0.00 66.02 66.44 1rk6 s SER 279 CO -0.00 -0.70 0.57 -1.48 0.41 0.00 0.00 173.24 172.03 1rk6 s LEU 280 N -3.23 -0.31 0.24 2.44 2.34 -1.26 -0.69 118.68 118.22 1rk6 s LEU 280 Ca 0.33 0.17 0.01 0.00 0.06 0.00 0.00 54.13 54.71 1rk6 s LEU 280 Cb 0.07 2.34 -0.05 0.00 -0.56 0.00 0.00 46.19 47.99 1rk6 s LEU 280 CO 0.10 -0.79 0.08 1.51 -1.06 0.00 0.00 176.35 176.18 1rk6 s ASP 281 N -2.16 1.19 0.13 1.48 1.47 -0.67 -1.26 116.67 116.84 1rk6 s ASP 281 Ca -0.04 -1.35 -0.21 0.00 1.18 0.00 0.00 52.55 52.14 1rk6 s ASP 281 Cb -0.00 0.15 0.06 0.00 -0.34 0.00 0.00 42.92 42.79 1rk6 s ASP 281 CO -0.04 -0.70 0.54 0.00 0.68 0.00 0.00 175.17 175.65 1rk6 s ALA 282 N -3.74 -1.39 0.12 2.11 0.00 -0.46 -0.67 121.76 117.73 1rk6 s ALA 282 Ca 0.35 0.39 0.05 0.00 0.00 0.00 0.00 51.96 52.76 1rk6 s ALA 282 Cb 0.07 0.73 -0.04 0.00 0.00 0.00 0.00 23.12 23.89 1rk6 s ALA 282 CO 0.12 -0.68 0.04 1.52 0.00 0.00 0.00 175.76 176.75 1rk6 s TYR 283 N -3.49 3.02 -0.22 0.00 -0.85 -1.21 -1.72 117.35 112.88 1rk6 s TYR 283 Ca 0.00 -0.03 -0.04 0.00 -0.52 0.00 0.00 57.07 56.48 1rk6 s TYR 283 Cb -0.00 -1.52 -0.08 0.00 0.38 0.00 0.00 41.96 40.74 1rk6 s TYR 283 CO -0.10 0.50 3.06 -0.35 -1.52 0.00 0.00 175.55 177.14 1rk6 n PRO 284 N 0.26 2.11 -4.06 -3.49 -0.04 -1.26 -4.90 135.00 123.62 1rk6 n PRO 284 Ca -0.10 -1.57 -0.08 0.00 -0.04 0.00 0.00 63.50 61.71 1rk6 n PRO 284 Cb 0.53 -1.98 -0.09 0.00 -0.04 0.00 0.00 33.50 31.91 1rk6 n PRO 284 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1rk6 s TYR 285 N -0.42 0.53 -2.13 0.54 1.51 -1.26 -5.02 117.35 111.09 1rk6 s TYR 285 Ca 0.58 -1.02 0.21 0.00 -1.01 0.00 0.00 57.07 55.82 1rk6 s TYR 285 Cb 0.33 -0.35 0.55 0.00 -0.11 0.00 0.00 41.96 42.38 1rk6 s TYR 285 CO -0.10 -0.45 1.46 1.33 -1.11 0.00 0.00 175.55 176.69 1rk6 n VAL 286 N 0.03 0.74 -4.58 0.71 0.24 -1.26 -4.89 118.33 109.32 1rk6 n VAL 286 Ca -0.12 -0.80 -0.23 0.00 -2.04 0.00 0.00 64.34 61.14 1rk6 n VAL 286 Cb 0.62 0.55 -0.14 0.00 -1.47 0.00 0.00 33.84 33.40 1rk6 n VAL 286 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1rk6 s ALA 287 N -1.26 1.45 0.54 2.33 0.00 -1.26 -2.03 121.76 121.53 1rk6 s ALA 287 Ca 0.42 -0.88 0.09 0.00 0.00 0.00 0.00 51.96 51.58 1rk6 s ALA 287 Cb 0.22 -0.29 0.09 0.00 0.00 0.00 0.00 23.12 23.14 1rk6 s ALA 287 CO 0.30 0.32 0.73 0.41 0.00 0.00 0.00 175.76 177.51 1rk6 n GLY 288 N 2.10 2.02 3.63 0.00 0.00 0.39 -4.88 105.19 108.46 1rk6 n GLY 288 Ca -0.17 -2.23 -0.11 0.00 0.00 0.00 0.00 46.02 43.52 1rk6 n GLY 288 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1rk6 s SER 289 N -4.36 -0.76 0.00 1.61 0.15 -1.26 -0.72 113.70 108.35 1rk6 s SER 289 Ca 0.55 1.38 0.00 0.00 0.70 0.00 0.00 55.95 58.58 1rk6 s SER 289 Cb -0.04 1.37 0.00 0.00 -1.71 0.00 0.00 66.02 65.64 1rk6 s SER 289 CO 0.35 -0.23 0.00 1.07 1.20 0.00 0.00 173.24 175.63 1rk6 n THR 290 N 3.14 0.00 -1.32 6.45 5.66 -0.84 -5.01 114.28 122.35 1rk6 n THR 290 Ca -0.16 0.00 -0.35 0.00 -3.05 0.00 0.00 64.05 60.49 1rk6 n THR 290 Cb 0.56 0.00 0.10 0.00 -1.55 0.00 0.00 70.33 69.44 1rk6 n THR 290 CO 0.00 0.00 0.00 1.15 -3.05 0.00 0.00 175.07 173.17 1rk6 n MET 291 N 0.00 0.49 -2.42 1.09 0.00 -1.26 -1.01 117.12 114.00 1rk6 n MET 291 Ca 0.00 0.23 -0.42 0.00 0.00 0.00 0.00 57.70 57.51 1rk6 n MET 291 Cb 0.00 -2.38 -0.03 0.00 0.00 0.00 0.00 33.22 30.81 1rk6 n MET 291 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 175.97 174.80 1rk6 s LEU 292 N -4.46 4.28 0.01 3.17 2.96 0.26 -4.48 118.68 120.42 1rk6 s LEU 292 Ca 0.75 1.86 0.02 0.00 -0.22 0.00 0.00 54.13 56.54 1rk6 s LEU 292 Cb -0.33 -3.56 -0.01 0.00 0.50 0.00 0.00 46.19 42.79 1rk6 s LEU 292 CO 0.48 -0.60 -0.07 -0.75 -1.32 0.00 0.00 176.35 174.09 1rk6 s LYS 293 N 2.24 0.50 -0.96 1.98 2.36 -1.26 -4.74 119.74 119.86 1rk6 s LYS 293 Ca 0.57 -0.41 -0.24 0.00 -2.55 0.00 0.00 55.97 53.35 1rk6 s LYS 293 Cb -0.26 -0.42 0.04 0.00 -1.05 0.00 0.00 37.83 36.14 1rk6 s LYS 293 CO 0.23 0.10 1.49 -0.65 1.55 0.00 0.00 175.35 178.07 1rk6 s GLN 294 N -0.65 3.41 -0.05 4.03 -0.21 -1.26 -4.85 119.66 120.07 1rk6 s GLN 294 Ca -0.02 -0.88 -0.02 0.00 0.02 0.00 0.00 55.36 54.46 1rk6 s GLN 294 Cb -0.05 -5.15 0.04 0.00 1.00 0.00 0.00 33.01 28.84 1rk6 s GLN 294 CO 0.00 -2.34 0.09 0.34 -2.12 0.00 0.00 175.29 171.27 1rk6 s ASP 295 N 5.21 0.92 0.40 5.90 -1.08 -1.26 -5.04 116.67 121.71 1rk6 s ASP 295 Ca 0.48 0.17 0.10 0.00 -0.52 0.00 0.00 52.55 52.78 1rk6 s ASP 295 Cb -0.02 0.01 0.91 0.00 -1.46 0.00 0.00 42.92 42.36 1rk6 s ASP 295 CO -0.05 -0.24 1.97 0.03 0.52 0.00 0.00 175.17 177.40 1rk6 h ARG 296 N 8.32 0.54 0.06 4.34 2.47 -1.96 -1.78 114.38 126.36 1rk6 h ARG 296 Ca -0.15 -0.03 -0.13 0.00 -1.26 0.00 0.00 59.98 58.41 1rk6 h ARG 296 Cb 1.12 -0.12 0.00 0.00 -1.65 0.00 0.00 29.97 29.32 1rk6 h ARG 296 CO 0.17 0.35 -0.62 0.28 0.56 0.00 0.00 179.97 180.71 1rk6 h VAL 297 N 0.55 1.49 -0.70 2.04 2.07 -1.99 -2.87 116.25 116.85 1rk6 h VAL 297 Ca 0.29 -2.40 0.06 0.00 0.82 0.00 0.00 66.70 65.48 1rk6 h VAL 297 Cb 0.43 3.09 -0.04 0.00 -1.52 0.00 0.00 31.29 33.25 1rk6 h VAL 297 CO -0.09 0.62 0.46 -0.07 0.02 0.00 0.00 177.57 178.51 1rk6 h LEU 298 N -0.70 0.63 -1.50 2.57 3.38 -1.92 -2.44 115.31 115.33 1rk6 h LEU 298 Ca -0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.84 1rk6 h LEU 298 Cb 1.35 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1rk6 h LEU 298 CO 0.03 0.41 0.00 0.18 0.09 0.00 0.00 178.44 179.15 1rk6 n LEU 299 N -4.48 2.25 -0.16 1.67 4.77 -0.68 -4.30 117.00 116.07 1rk6 n LEU 299 Ca 0.10 -0.95 -0.05 0.00 -0.03 0.00 0.00 56.01 55.09 1rk6 n LEU 299 Cb 0.23 -0.15 0.13 0.00 -2.33 0.00 0.00 43.42 41.31 1rk6 n LEU 299 CO 0.34 0.47 0.93 0.00 -1.33 0.00 0.00 177.39 177.80 1rk6 h ALA 300 N 4.21 1.09 -3.04 -1.18 0.00 -1.19 -3.46 119.26 115.68 1rk6 h ALA 300 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1rk6 h ALA 300 Cb 0.65 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.21 1rk6 h ALA 300 CO 0.00 0.59 0.00 0.41 0.00 0.00 0.00 179.25 180.25 1rk6 n GLY 301 N -0.72 4.90 3.71 0.00 0.00 -1.26 -5.05 105.19 106.76 1rk6 n GLY 301 Ca 0.04 -2.04 -0.43 0.00 0.00 0.00 0.00 46.02 43.59 1rk6 n GLY 301 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1rk6 n ARG 302 N -0.02 2.66 -4.17 1.61 0.63 -1.26 -4.81 116.66 111.30 1rk6 n ARG 302 Ca 0.00 0.96 -0.20 0.00 -0.92 0.00 0.00 57.85 57.69 1rk6 n ARG 302 Cb 0.00 -2.79 -0.16 0.00 0.45 0.00 0.00 32.46 29.95 1rk6 n ARG 302 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 1rk6 s THR 303 N 1.16 0.52 0.02 5.15 2.01 -1.26 -0.97 115.64 122.26 1rk6 s THR 303 Ca 0.76 -0.12 0.06 0.00 0.31 0.00 0.00 61.69 62.70 1rk6 s THR 303 Cb -0.54 -0.55 -0.03 0.00 0.01 0.00 0.00 72.50 71.40 1rk6 s THR 303 CO 0.33 0.22 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.54 1rk6 s LEU 304 N 0.88 2.59 -0.03 4.42 1.43 -0.33 -0.53 118.68 127.12 1rk6 s LEU 304 Ca -0.12 -0.38 -0.24 0.00 -1.03 0.00 0.00 54.13 52.37 1rk6 s LEU 304 Cb -0.14 -1.51 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 1rk6 s LEU 304 CO 0.00 0.28 0.72 -0.63 0.23 0.00 0.00 176.35 176.96 1rk6 s ILE 305 N -0.86 4.94 -0.12 -0.59 -1.09 0.02 -0.44 121.20 123.06 1rk6 s ILE 305 Ca 0.14 1.51 0.17 0.00 -2.23 0.00 0.00 60.65 60.24 1rk6 s ILE 305 Cb -0.10 -4.07 -0.22 0.00 -1.58 0.00 0.00 42.46 36.49 1rk6 s ILE 305 CO 0.04 0.29 0.51 0.35 -1.23 0.00 0.00 174.94 174.90 1rk6 n THR 306 N 3.43 1.19 -3.56 2.92 -2.24 -0.21 0.27 114.28 116.07 1rk6 n THR 306 Ca -0.02 -0.74 -0.06 0.00 -2.27 0.00 0.00 64.05 60.96 1rk6 n THR 306 Cb 0.51 -0.61 -0.02 0.00 -2.10 0.00 0.00 70.33 68.10 1rk6 n THR 306 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1rk6 s TRP 307 N -2.80 -0.21 -0.26 4.78 1.48 -1.25 -1.49 118.94 119.20 1rk6 s TRP 307 Ca -0.06 0.14 -0.09 0.00 -1.06 0.00 0.00 56.10 55.02 1rk6 s TRP 307 Cb 0.08 0.52 0.11 0.00 -1.16 0.00 0.00 33.47 33.03 1rk6 s TRP 307 CO 0.83 -0.32 0.57 0.00 -4.06 0.00 0.00 176.95 173.98 1rk6 h LYS 309 N 7.98 -0.40 0.00 0.00 3.64 -1.30 -2.51 116.57 123.98 1rk6 h LYS 309 Ca -0.18 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.18 1rk6 h LYS 309 Cb 1.11 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.02 1rk6 h LYS 309 CO 0.11 -0.07 -0.22 -1.00 -2.27 0.00 0.00 179.45 176.00 1rk6 h PRO 310 N -0.77 0.00 -2.35 1.90 0.13 -1.79 -3.35 132.00 125.77 1rk6 h PRO 310 Ca -0.04 0.00 -0.59 0.00 -0.87 0.00 0.00 66.00 64.50 1rk6 h PRO 310 Cb 0.51 0.00 -0.39 0.00 0.13 0.00 0.00 31.00 31.25 1rk6 h PRO 310 CO 0.07 0.22 -0.96 0.66 -0.23 0.00 0.00 178.00 177.75 1rk6 n TYR 311 N -3.69 -0.43 -0.01 1.56 4.01 -1.24 -4.99 117.16 112.38 1rk6 n TYR 311 Ca -0.01 -3.44 0.22 0.00 -0.16 0.00 0.00 57.90 54.50 1rk6 n TYR 311 Cb 0.34 0.08 0.71 0.00 -0.31 0.00 0.00 39.34 40.15 1rk6 n TYR 311 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1rk6 h PRO 312 N 5.31 0.00 0.00 -0.72 0.11 -1.59 -0.91 132.00 134.19 1rk6 h PRO 312 Ca 0.23 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.34 1rk6 h PRO 312 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1rk6 h PRO 312 CO 0.42 0.00 0.00 1.05 -0.21 0.00 0.00 178.00 179.26 1rk6 h GLU 313 N 0.00 0.00 0.00 1.05 9.09 -1.94 -2.49 114.58 120.29 1rk6 h GLU 313 Ca 0.27 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.68 1rk6 h GLU 313 Cb 1.12 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.22 1rk6 h GLU 313 CO -0.00 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.34 1rk6 n LEU 314 N -2.31 0.00 -4.67 3.06 4.77 -0.35 -4.86 117.00 112.64 1rk6 n LEU 314 Ca -0.00 0.47 -0.47 0.00 -0.03 0.00 0.00 56.01 55.98 1rk6 n LEU 314 Cb 0.11 -0.47 -0.05 0.00 -2.33 0.00 0.00 43.42 40.68 1rk6 n LEU 314 CO 0.14 -0.03 1.28 -1.20 -1.33 0.00 0.00 177.39 176.25 1rk6 n SER 315 N -1.47 3.10 0.00 -1.43 7.64 -0.94 -1.23 113.62 119.29 1rk6 n SER 315 Ca 0.07 1.05 0.00 0.00 1.01 0.00 0.00 58.87 61.00 1rk6 n SER 315 Cb 0.31 -1.39 0.00 0.00 -1.01 0.00 0.00 64.21 62.12 1rk6 n SER 315 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1rk6 n GLY 316 N 3.70 2.31 3.84 0.23 0.00 0.14 -5.00 105.19 110.42 1rk6 n GLY 316 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1rk6 n GLY 316 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1rk6 s ARG 317 N -0.68 3.26 -0.14 1.61 0.52 -0.37 -4.66 118.95 118.49 1rk6 s ARG 317 Ca 0.00 0.87 -0.27 0.00 -0.52 0.00 0.00 55.73 55.81 1rk6 s ARG 317 Cb 0.00 -2.03 -0.01 0.00 0.52 0.00 0.00 34.95 33.42 1rk6 s ARG 317 CO 0.00 -0.84 0.90 0.34 0.02 0.00 0.00 175.30 175.72 1rk6 s ASP 318 N -3.95 7.08 0.37 0.23 -1.08 -1.26 -0.80 116.67 117.26 1rk6 s ASP 318 Ca 0.57 1.33 0.09 0.00 -0.52 0.00 0.00 52.55 54.02 1rk6 s ASP 318 Cb -0.13 -2.50 0.73 0.00 -1.46 0.00 0.00 42.92 39.57 1rk6 s ASP 318 CO 0.54 -0.41 1.88 0.25 0.52 0.00 0.00 175.17 177.95 1rk6 h LEU 319 N 8.13 0.22 -0.77 -1.34 5.85 -1.16 -2.40 115.31 123.83 1rk6 h LEU 319 Ca -0.30 -0.05 -0.01 0.00 0.84 0.00 0.00 57.88 58.35 1rk6 h LEU 319 Cb 1.14 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.07 1rk6 h LEU 319 CO 0.84 0.42 0.43 -0.08 -0.34 0.00 0.00 178.44 179.71 1rk6 h GLU 320 N 0.22 1.07 -0.32 1.25 4.57 -1.93 0.17 114.58 119.61 1rk6 h GLU 320 Ca 0.04 -0.12 -0.03 0.00 -1.18 0.00 0.00 59.36 58.07 1rk6 h GLU 320 Cb 0.44 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 1rk6 h GLU 320 CO 0.03 0.79 0.10 1.49 -1.18 0.00 0.00 179.01 180.23 1rk6 h GLU 321 N 1.07 0.50 -0.21 1.92 4.81 -1.85 0.22 114.58 121.03 1rk6 h GLU 321 Ca 0.27 -0.11 0.01 0.00 -0.13 0.00 0.00 59.36 59.41 1rk6 h GLU 321 Cb 0.02 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 1rk6 h GLU 321 CO -0.05 0.55 0.10 0.82 -0.73 0.00 0.00 179.01 179.70 1rk6 h ILE 322 N 0.36 1.00 0.06 2.32 2.04 -1.07 -0.25 117.51 121.98 1rk6 h ILE 322 Ca 0.10 -0.08 -0.00 0.00 1.00 0.00 0.00 64.86 65.88 1rk6 h ILE 322 Cb 0.26 0.75 0.00 0.00 -0.74 0.00 0.00 36.82 37.09 1rk6 h ILE 322 CO -0.00 0.04 -0.03 0.00 0.00 0.00 0.00 178.15 178.16 1rk6 h ALA 323 N 1.11 -0.08 -0.98 1.87 0.00 -0.48 -2.02 119.26 118.68 1rk6 h ALA 323 Ca 0.09 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 54.92 1rk6 h ALA 323 Cb 0.02 0.03 -0.05 0.00 0.00 0.00 0.00 17.79 17.79 1rk6 h ALA 323 CO -0.06 -0.45 0.64 0.00 0.00 0.00 0.00 179.25 179.38 1rk6 h ALA 324 N 0.66 1.28 0.00 0.00 0.00 -0.48 0.32 119.26 121.03 1rk6 h ALA 324 Ca -0.01 -0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1rk6 h ALA 324 Cb 0.24 -0.36 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1rk6 h ALA 324 CO 0.01 0.56 -0.08 0.93 0.00 0.00 0.00 179.25 180.67 1rk6 h GLU 325 N 1.27 0.00 -0.25 0.00 5.08 -0.89 -0.24 114.58 119.54 1rk6 h GLU 325 Ca 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.74 1rk6 h GLU 325 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1rk6 h GLU 325 CO -0.11 0.08 0.00 0.54 -1.00 0.00 0.00 179.01 178.53 1rk6 n ARG 326 N -3.27 2.04 -1.60 2.33 1.74 -0.07 -4.94 116.66 112.89 1rk6 n ARG 326 Ca -0.00 -1.57 -0.07 0.00 -0.77 0.00 0.00 57.85 55.44 1rk6 n ARG 326 Cb 0.31 -1.44 -0.02 0.00 -1.02 0.00 0.00 32.46 30.29 1rk6 n ARG 326 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1rk6 n GLY 327 N 1.28 0.56 3.25 -0.13 0.00 -0.10 -5.03 105.19 105.01 1rk6 n GLY 327 Ca 0.17 -0.67 -0.14 0.00 0.00 0.00 0.00 46.02 45.39 1rk6 n GLY 327 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1rk6 s LYS 328 N -3.35 1.14 0.74 1.61 1.02 -0.23 -4.99 119.74 115.68 1rk6 s LYS 328 Ca 0.00 -1.56 -0.11 0.00 0.02 0.00 0.00 55.97 54.32 1rk6 s LYS 328 Cb 0.00 -0.28 0.03 0.00 -0.52 0.00 0.00 37.83 37.06 1rk6 s LYS 328 CO 0.00 -0.14 1.09 -1.54 -0.92 0.00 0.00 175.35 173.84 1rk6 s SER 329 N -3.19 5.11 0.21 2.83 1.04 -1.26 -3.13 113.70 115.30 1rk6 s SER 329 Ca 0.25 1.28 -0.09 0.00 0.48 0.00 0.00 55.95 57.87 1rk6 s SER 329 Cb 0.06 -2.08 0.25 0.00 0.10 0.00 0.00 66.02 64.35 1rk6 s SER 329 CO 0.05 -1.58 1.79 0.11 0.98 0.00 0.00 173.24 174.59 1rk6 h LYS 330 N -0.82 0.59 -0.59 4.02 1.57 -1.90 -1.56 116.57 117.88 1rk6 h LYS 330 Ca -0.46 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 58.32 1rk6 h LYS 330 Cb 1.25 -0.13 -0.04 0.00 0.08 0.00 0.00 32.23 33.39 1rk6 h LYS 330 CO 0.61 0.39 0.35 -0.92 -0.57 0.00 0.00 179.45 179.31 1rk6 h TYR 331 N 0.60 0.65 0.00 -1.35 5.03 -1.92 -2.54 116.97 117.45 1rk6 h TYR 331 Ca 0.30 0.02 -0.08 0.00 2.58 0.00 0.00 58.73 61.55 1rk6 h TYR 331 Cb 0.24 -0.21 -0.01 0.00 1.55 0.00 0.00 36.73 38.30 1rk6 h TYR 331 CO -0.10 0.36 -0.36 -0.44 -1.32 0.00 0.00 178.16 176.29 1rk6 h ASP 332 N 0.68 0.00 1.42 -2.11 3.32 -1.81 -3.16 116.42 114.76 1rk6 h ASP 332 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1rk6 h ASP 332 Cb 0.06 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.61 1rk6 h ASP 332 CO -0.12 0.36 -0.21 1.62 -1.72 0.00 0.00 179.24 179.18 1rk6 h VAL 333 N 0.00 0.00 -0.40 -1.35 3.04 -0.94 -3.38 116.25 113.22 1rk6 h VAL 333 Ca -0.00 -0.63 0.06 0.00 -1.01 0.00 0.00 66.70 65.12 1rk6 h VAL 333 Cb 1.03 1.50 -0.06 0.00 -2.01 0.00 0.00 31.29 31.76 1rk6 h VAL 333 CO 0.05 0.00 0.07 0.58 -1.01 0.00 0.00 177.57 177.25 1rk6 h VAL 334 N 0.00 0.78 -0.88 1.51 2.07 -1.43 -2.88 116.25 115.42 1rk6 h VAL 334 Ca 0.00 -0.06 0.13 0.00 0.82 0.00 0.00 66.70 67.59 1rk6 h VAL 334 Cb 0.82 0.57 -0.09 0.00 -1.52 0.00 0.00 31.29 31.07 1rk6 h VAL 334 CO 0.00 0.03 0.50 -0.65 0.02 0.00 0.00 177.57 177.47 1rk6 h PRO 335 N 0.19 0.72 0.00 1.57 0.11 -1.80 -0.80 132.00 131.98 1rk6 h PRO 335 Ca 0.19 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.26 1rk6 h PRO 335 Cb 0.24 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 31.19 1rk6 h PRO 335 CO -0.26 0.47 0.00 -0.85 -0.21 0.00 0.00 178.00 177.15 1rk6 n GLU 336 N -4.79 0.09 0.00 1.05 0.28 -1.09 -2.58 120.64 113.61 1rk6 n GLU 336 Ca 0.17 0.31 0.10 0.00 -0.16 0.00 0.00 57.16 57.58 1rk6 n GLU 336 Cb 0.40 -1.67 -0.04 0.00 1.43 0.00 0.00 31.44 31.56 1rk6 n GLU 336 CO 0.00 0.00 0.00 1.28 -0.16 0.00 0.00 177.13 178.25 1rk6 n LEU 337 N -1.84 1.62 -4.80 -1.84 4.77 -0.33 -4.95 117.00 109.64 1rk6 n LEU 337 Ca 0.03 -0.67 -0.35 0.00 -0.03 0.00 0.00 56.01 54.99 1rk6 n LEU 337 Cb 0.21 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.24 1rk6 n LEU 337 CO 0.17 0.32 0.67 -1.10 -1.33 0.00 0.00 177.39 176.12 1rk6 s GLN 338 N -2.54 4.30 0.36 3.23 -0.21 -1.06 -4.02 119.66 119.71 1rk6 s GLN 338 Ca 0.14 1.26 -0.21 0.00 0.02 0.00 0.00 55.36 56.58 1rk6 s GLN 338 Cb 0.16 -2.43 -0.10 0.00 1.00 0.00 0.00 33.01 31.65 1rk6 s GLN 338 CO 0.63 0.02 0.88 -1.25 -2.12 0.00 0.00 175.29 173.46 1rk6 s PRO 339 N -2.72 4.27 0.33 2.91 0.04 -1.26 -4.63 135.00 133.94 1rk6 s PRO 339 Ca 0.58 1.05 -0.18 0.00 0.04 0.00 0.00 61.00 62.49 1rk6 s PRO 339 Cb -0.15 -2.45 0.04 0.00 0.04 0.00 0.00 34.50 31.98 1rk6 s PRO 339 CO 0.19 0.12 0.74 0.00 0.04 0.00 0.00 177.00 178.10 1rk6 s ALA 340 N -1.94 -0.95 0.21 8.56 0.00 -1.26 -1.00 121.76 125.39 1rk6 s ALA 340 Ca 0.56 -0.54 0.09 0.00 0.00 0.00 0.00 51.96 52.06 1rk6 s ALA 340 Cb -0.12 0.78 -0.05 0.00 0.00 0.00 0.00 23.12 23.73 1rk6 s ALA 340 CO 0.17 -1.01 -0.16 0.20 0.00 0.00 0.00 175.76 174.97 1rk6 s GLY 341 N -3.00 1.50 0.18 0.00 0.00 -0.26 -0.58 107.32 105.17 1rk6 s GLY 341 Ca 0.14 -1.67 -0.13 0.00 0.00 0.00 0.00 44.72 43.06 1rk6 s GLY 341 CO 0.09 -1.76 0.39 0.00 0.00 0.00 0.00 173.10 171.82 1rk6 s ALA 342 N -2.77 -0.38 -0.10 3.20 0.00 -0.18 -1.05 121.76 120.48 1rk6 s ALA 342 Ca 0.23 -0.63 0.02 0.00 0.00 0.00 0.00 51.96 51.58 1rk6 s ALA 342 Cb -0.02 0.87 -0.01 0.00 0.00 0.00 0.00 23.12 23.96 1rk6 s ALA 342 CO 0.08 -0.73 -0.17 0.42 0.00 0.00 0.00 175.76 175.36 1rk6 s ILE 343 N -3.94 2.70 -0.20 0.00 1.01 0.42 -1.99 121.20 119.20 1rk6 s ILE 343 Ca 0.15 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 60.00 1rk6 s ILE 343 Cb 0.01 -2.08 0.04 0.00 0.01 0.00 0.00 42.46 40.44 1rk6 s ILE 343 CO -0.00 0.55 -0.13 -0.31 0.00 0.00 0.00 174.94 175.04 1rk6 s TYR 344 N 0.09 2.65 -1.15 3.97 2.02 0.10 -1.18 117.35 123.85 1rk6 s TYR 344 Ca -0.08 -1.71 -0.17 0.00 -0.37 0.00 0.00 57.07 54.74 1rk6 s TYR 344 Cb -0.15 -1.76 0.11 0.00 -0.40 0.00 0.00 41.96 39.76 1rk6 s TYR 344 CO 0.05 -0.78 1.46 -0.06 -1.57 0.00 0.00 175.55 174.65 1rk6 s PHE 345 N 1.32 3.06 -0.05 2.71 0.40 -0.14 -0.46 117.98 124.82 1rk6 s PHE 345 Ca -0.00 -1.63 0.07 0.00 -0.60 0.00 0.00 56.93 54.76 1rk6 s PHE 345 Cb -0.16 -4.50 0.10 0.00 0.51 0.00 0.00 43.02 38.98 1rk6 s PHE 345 CO -0.09 -1.62 0.98 0.00 0.70 0.00 0.00 175.22 175.19 1rk6 n MET 346 N 7.14 1.38 -4.57 0.44 0.00 -1.20 -4.26 117.12 116.04 1rk6 n MET 346 Ca 0.37 -1.64 -0.28 0.00 0.00 0.00 0.00 57.70 56.14 1rk6 n MET 346 Cb 0.46 -1.01 -0.10 0.00 0.00 0.00 0.00 33.22 32.57 1rk6 n MET 346 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 1rk6 s MET 347 N -1.34 2.01 -0.05 3.17 -1.94 -0.86 -0.86 119.30 119.43 1rk6 s MET 347 Ca 0.12 -2.11 0.05 0.00 -1.71 0.00 0.00 55.69 52.04 1rk6 s MET 347 Cb 0.10 -1.67 -0.01 0.00 2.01 0.00 0.00 34.83 35.26 1rk6 s MET 347 CO 0.01 -0.09 -0.21 0.34 -0.01 0.00 0.00 175.02 175.06 1rk6 s ASP 348 N -3.75 2.61 0.27 3.03 2.15 -1.26 -4.86 116.67 114.86 1rk6 s ASP 348 Ca 0.33 -0.43 0.00 0.00 0.43 0.00 0.00 52.55 52.88 1rk6 s ASP 348 Cb 0.08 -0.71 0.61 0.00 -0.30 0.00 0.00 42.92 42.61 1rk6 s ASP 348 CO 0.17 0.20 1.71 -0.08 -0.17 0.00 0.00 175.17 177.00 1rk6 h GLU 349 N 6.14 0.39 -0.77 4.34 4.57 -1.96 -1.67 114.58 125.62 1rk6 h GLU 349 Ca -0.32 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 57.86 1rk6 h GLU 349 Cb 1.17 -0.09 -0.04 0.00 -0.16 0.00 0.00 28.75 29.63 1rk6 h GLU 349 CO 0.47 0.26 0.51 -1.35 -1.18 0.00 0.00 179.01 177.72 1rk6 h PRO 350 N 0.40 0.95 -0.31 0.92 0.11 -1.99 -0.52 132.00 131.56 1rk6 h PRO 350 Ca 0.50 -0.06 -0.08 0.00 0.11 0.00 0.00 66.00 66.47 1rk6 h PRO 350 Cb 0.88 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 31.77 1rk6 h PRO 350 CO -0.49 0.63 -0.13 -0.44 -0.21 0.00 0.00 178.00 177.36 1rk6 h ASP 351 N 0.98 0.66 -0.44 -2.05 3.32 -1.73 -1.31 116.42 115.85 1rk6 h ASP 351 Ca 0.30 -0.40 0.01 0.00 0.02 0.00 0.00 57.03 56.96 1rk6 h ASP 351 Cb -0.01 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.33 1rk6 h ASP 351 CO -0.08 0.91 0.29 0.58 -1.72 0.00 0.00 179.24 179.22 1rk6 h VAL 352 N 0.40 1.11 -0.48 -1.35 2.07 -1.06 -0.29 116.25 116.65 1rk6 h VAL 352 Ca 0.07 -0.20 -0.03 0.00 0.82 0.00 0.00 66.70 67.36 1rk6 h VAL 352 Cb 0.65 0.46 -0.02 0.00 -1.52 0.00 0.00 31.29 30.86 1rk6 h VAL 352 CO 0.04 0.11 0.18 1.56 0.02 0.00 0.00 177.57 179.48 1rk6 h GLN 353 N 0.59 0.72 -0.77 1.57 4.20 -1.05 -0.14 115.11 120.24 1rk6 h GLN 353 Ca 0.16 -0.14 0.00 0.00 0.06 0.00 0.00 58.65 58.74 1rk6 h GLN 353 Cb -0.06 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.57 1rk6 h GLN 353 CO -0.04 0.66 0.49 -0.09 -0.67 0.00 0.00 178.83 179.18 1rk6 h ARG 354 N 0.63 1.03 -0.36 1.46 2.43 -0.88 -0.39 114.38 118.30 1rk6 h ARG 354 Ca 0.16 -0.08 -0.09 0.00 -0.81 0.00 0.00 59.98 59.16 1rk6 h ARG 354 Cb 0.21 -0.22 -0.01 0.00 -0.42 0.00 0.00 29.97 29.53 1rk6 h ARG 354 CO -0.01 0.70 -0.15 0.82 -1.51 0.00 0.00 179.97 179.82 1rk6 h ILE 355 N 1.05 1.28 -0.76 1.20 2.04 -0.82 -0.80 117.51 120.70 1rk6 h ILE 355 Ca 0.28 -1.25 -0.02 0.00 1.00 0.00 0.00 64.86 64.86 1rk6 h ILE 355 Cb -0.09 1.34 -0.04 0.00 -0.74 0.00 0.00 36.82 37.30 1rk6 h ILE 355 CO -0.06 0.41 0.39 -0.07 0.00 0.00 0.00 178.15 178.82 1rk6 h LEU 356 N 0.52 0.98 -0.47 1.44 3.38 -0.80 -2.98 115.31 117.37 1rk6 h LEU 356 Ca 0.08 -0.12 -0.11 0.00 0.09 0.00 0.00 57.88 57.83 1rk6 h LEU 356 Cb 0.68 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1rk6 h LEU 356 CO 0.05 0.82 -0.51 0.00 0.09 0.00 0.00 178.44 178.88 1rk6 h ALA 357 N 1.20 0.79 -1.73 1.53 0.00 -0.93 -3.44 119.26 116.68 1rk6 h ALA 357 Ca 0.26 -0.47 -0.68 0.00 0.00 0.00 0.00 54.91 54.02 1rk6 h ALA 357 Cb 0.08 -0.08 0.03 0.00 0.00 0.00 0.00 17.79 17.82 1rk6 h ALA 357 CO -0.04 0.64 0.75 0.34 0.00 0.00 0.00 179.25 180.95 1rk6 n PHE 358 N -3.41 1.92 -0.25 0.00 7.35 -0.32 -4.82 117.46 117.93 1rk6 n PHE 358 Ca 0.01 0.47 -0.06 0.00 -0.76 0.00 0.00 57.45 57.11 1rk6 n PHE 358 Cb 0.65 -2.45 -0.06 0.00 0.35 0.00 0.00 39.48 37.97 1rk6 n PHE 358 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1rk6 n GLY 359 N 3.53 -2.31 0.00 7.13 0.00 -1.26 -1.60 105.19 110.68 1rk6 n GLY 359 Ca 0.22 0.84 0.05 0.00 0.00 0.00 0.00 46.02 47.14 1rk6 n GLY 359 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1rk6 n PRO 360 N -4.38 0.06 -2.07 1.61 -0.02 -1.26 -4.84 135.00 124.11 1rk6 n PRO 360 Ca 0.01 0.27 -0.42 0.00 -2.02 0.00 0.00 63.50 61.33 1rk6 n PRO 360 Cb 0.15 -1.50 -0.03 0.00 -0.02 0.00 0.00 33.50 32.11 1rk6 n PRO 360 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1rk6 s THR 361 N -2.82 3.62 0.43 3.45 2.01 -0.63 -4.45 115.64 117.25 1rk6 s THR 361 Ca 0.07 0.82 -0.04 0.00 0.31 0.00 0.00 61.69 62.85 1rk6 s THR 361 Cb 0.07 -3.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.02 1rk6 s THR 361 CO 0.18 -0.06 0.70 -0.04 -0.69 0.00 0.00 174.62 174.71 1rk6 s MET 362 N 3.66 3.53 -0.17 4.92 -1.94 -0.39 -4.84 119.30 124.06 1rk6 s MET 362 Ca 0.70 0.03 -0.12 0.00 -1.71 0.00 0.00 55.69 54.59 1rk6 s MET 362 Cb -0.32 -2.47 -0.05 0.00 2.01 0.00 0.00 34.83 33.99 1rk6 s MET 362 CO 0.28 -0.08 0.23 0.42 -0.01 0.00 0.00 175.02 175.87 1rk6 s ILE 363 N -2.58 5.34 -0.02 2.53 -1.09 -0.65 -1.35 121.20 123.38 1rk6 s ILE 363 Ca 0.45 0.42 0.01 0.00 -2.23 0.00 0.00 60.65 59.30 1rk6 s ILE 363 Cb -0.10 -3.57 0.01 0.00 -1.58 0.00 0.00 42.46 37.22 1rk6 s ILE 363 CO 0.41 0.41 -0.03 -0.83 -1.23 0.00 0.00 174.94 173.67 1rk6 s GLY 364 N 0.43 0.28 0.15 6.18 0.00 -0.70 -3.51 107.32 110.16 1rk6 s GLY 364 Ca 0.13 -0.05 0.05 0.00 0.00 0.00 0.00 44.72 44.85 1rk6 s GLY 364 CO 0.02 0.20 1.35 1.76 0.00 0.00 0.00 173.10 176.43 1rk6 h SER 365 N 6.66 0.14 -3.92 1.64 0.02 -1.84 -3.21 113.55 113.05 1rk6 h SER 365 Ca -0.35 -0.13 -0.38 0.00 -0.84 0.00 0.00 61.79 60.09 1rk6 h SER 365 Cb 1.17 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 63.66 1rk6 h SER 365 CO 0.49 0.99 -0.52 -0.67 -1.14 0.00 0.00 176.83 175.97 1rk6 n ASP 366 N -3.56 -5.39 -4.77 3.07 2.03 0.47 -4.60 116.55 103.80 1rk6 n ASP 366 Ca -0.02 -0.11 -0.38 0.00 0.52 0.00 0.00 54.79 54.80 1rk6 n ASP 366 Cb 0.85 -4.45 0.00 0.00 -0.72 0.00 0.00 41.12 36.80 1rk6 n ASP 366 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1rk6 s GLY 367 N -2.34 2.82 -0.54 0.27 0.00 -1.26 -4.86 107.32 101.41 1rk6 s GLY 367 Ca 0.15 1.06 0.01 0.00 0.00 0.00 0.00 44.72 45.93 1rk6 s GLY 367 CO 0.18 1.54 0.32 1.08 0.00 0.00 0.00 173.10 176.22 1rk6 s LEU 368 N -3.04 4.82 0.44 0.66 1.43 -1.26 -3.73 118.68 118.00 1rk6 s LEU 368 Ca 0.64 -2.81 0.30 0.00 -1.03 0.00 0.00 54.13 51.24 1rk6 s LEU 368 Cb -0.32 -1.75 1.42 0.00 0.03 0.00 0.00 46.19 45.57 1rk6 s LEU 368 CO 0.39 -0.33 1.91 1.55 0.23 0.00 0.00 176.35 180.11 1rk6 h PRO 369 N 6.93 0.00 -0.01 1.29 0.13 -1.88 -2.75 132.00 135.71 1rk6 h PRO 369 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 1rk6 h PRO 369 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1rk6 h PRO 369 CO 0.69 0.00 -0.31 0.72 -0.23 0.00 0.00 178.00 178.87 1rk6 n HIS 370 N -2.66 0.00 -2.10 1.56 8.25 -1.26 -4.95 115.22 114.06 1rk6 n HIS 370 Ca -0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 1rk6 n HIS 370 Cb 0.19 -0.10 -0.02 0.00 1.12 0.00 0.00 29.99 31.18 1rk6 n HIS 370 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1rk6 s ASP 371 N -2.50 6.75 0.10 0.41 1.11 -1.04 -4.95 116.67 116.55 1rk6 s ASP 371 Ca 0.23 2.60 -0.19 0.00 0.18 0.00 0.00 52.55 55.38 1rk6 s ASP 371 Cb 0.19 -2.63 -0.06 0.00 1.07 0.00 0.00 42.92 41.49 1rk6 s ASP 371 CO 0.53 -0.61 1.63 -0.08 1.18 0.00 0.00 175.17 177.83 1rk6 h GLU 372 N 4.64 0.40 -3.00 8.23 4.57 -1.88 -3.32 114.58 124.21 1rk6 h GLU 372 Ca -0.46 -0.08 -0.62 0.00 -1.18 0.00 0.00 59.36 57.02 1rk6 h GLU 372 Cb 1.22 -0.06 -0.41 0.00 -0.16 0.00 0.00 28.75 29.34 1rk6 h GLU 372 CO 0.74 0.45 -0.69 1.03 -1.18 0.00 0.00 179.01 179.36 1rk6 s ARG 373 N -5.46 1.78 0.70 1.92 1.81 -0.55 -5.06 118.95 114.08 1rk6 s ARG 373 Ca -0.13 -2.62 -0.11 0.00 -1.72 0.00 0.00 55.73 51.15 1rk6 s ARG 373 Cb 0.08 -2.77 0.01 0.00 -0.45 0.00 0.00 34.95 31.82 1rk6 s ARG 373 CO 0.73 -1.23 1.07 -1.25 -0.68 0.00 0.00 175.30 173.93 1rk6 s PRO 374 N -0.46 2.87 0.22 3.54 0.04 -1.25 -4.46 135.00 135.50 1rk6 s PRO 374 Ca 0.22 0.75 -0.30 0.00 0.04 0.00 0.00 61.00 61.71 1rk6 s PRO 374 Cb -0.13 -2.00 -0.10 0.00 0.04 0.00 0.00 34.50 32.31 1rk6 s PRO 374 CO -0.09 -1.09 1.41 -1.58 0.04 0.00 0.00 177.00 175.70 1rk6 s HIS 375 N -3.15 3.09 0.12 0.56 5.65 -1.26 -4.70 115.29 115.60 1rk6 s HIS 375 Ca 0.58 1.04 0.28 0.00 0.25 0.00 0.00 55.06 57.22 1rk6 s HIS 375 Cb -0.13 -3.77 1.54 0.00 -1.18 0.00 0.00 32.58 29.05 1rk6 s HIS 375 CO 0.54 -2.51 1.86 -1.00 -0.65 0.00 0.00 174.74 172.98 1rk6 h PRO 376 N 5.32 0.00 -0.21 2.88 0.13 -1.80 -2.27 132.00 136.05 1rk6 h PRO 376 Ca -0.45 0.00 0.06 0.00 -0.87 0.00 0.00 66.00 64.74 1rk6 h PRO 376 Cb 1.22 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.34 1rk6 h PRO 376 CO 0.79 0.00 0.22 0.07 -0.23 0.00 0.00 178.00 178.85 1rk6 h ARG 377 N 0.00 0.00 -0.58 0.86 0.11 -1.88 0.13 114.38 113.03 1rk6 h ARG 377 Ca 0.00 0.00 0.07 0.00 0.10 0.00 0.00 59.98 60.15 1rk6 h ARG 377 Cb 0.08 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.12 1rk6 h ARG 377 CO 0.00 0.00 0.39 1.25 0.10 0.00 0.00 179.97 181.71 1rk6 h LEU 378 N 0.00 0.45 0.00 0.08 5.85 -1.66 -3.01 115.31 117.02 1rk6 h LEU 378 Ca 0.10 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.82 1rk6 h LEU 378 Cb 0.54 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.48 1rk6 h LEU 378 CO -0.00 0.29 -0.44 0.79 -0.34 0.00 0.00 178.44 178.74 1rk6 n TRP 379 N -4.48 0.00 -0.22 1.25 7.02 -0.14 -4.53 117.44 116.34 1rk6 n TRP 379 Ca 0.08 0.00 0.00 0.00 -1.02 0.00 0.00 57.50 56.56 1rk6 n TRP 379 Cb 0.27 -0.02 0.00 0.00 -2.42 0.00 0.00 31.31 29.14 1rk6 n TRP 379 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1rk6 n GLY 380 N 1.30 -0.43 0.40 6.99 0.00 -0.19 -4.40 105.19 108.85 1rk6 n GLY 380 Ca 0.01 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.91 1rk6 n GLY 380 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1rk6 h THR 381 N 0.22 0.13 -0.18 2.61 2.02 -1.74 -0.94 112.91 115.04 1rk6 h THR 381 Ca 0.00 0.00 -0.04 0.00 0.77 0.00 0.00 66.41 67.14 1rk6 h THR 381 Cb 0.11 0.13 -0.01 0.00 -1.74 0.00 0.00 68.15 66.64 1rk6 h THR 381 CO 0.00 0.00 -0.06 -0.26 0.37 0.00 0.00 175.52 175.57 1rk6 h PHE 382 N -0.43 0.41 0.00 3.16 0.04 -1.88 -2.49 116.94 115.74 1rk6 h PHE 382 Ca 0.10 -0.09 -0.04 0.00 2.80 0.00 0.00 57.97 60.73 1rk6 h PHE 382 Cb 0.61 -0.10 -0.01 0.00 2.20 0.00 0.00 35.95 38.66 1rk6 h PHE 382 CO -0.54 0.64 -0.20 -1.35 -0.60 0.00 0.00 178.31 176.26 1rk6 h PRO 383 N 0.06 0.00 -0.50 1.51 0.11 -1.78 -1.86 132.00 129.54 1rk6 h PRO 383 Ca 0.04 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.09 1rk6 h PRO 383 Cb 0.52 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.61 1rk6 h PRO 383 CO 0.02 0.20 0.06 -0.09 -0.21 0.00 0.00 178.00 177.98 1rk6 h ARG 384 N 0.00 0.79 -0.15 1.05 2.43 -0.85 0.18 114.38 117.83 1rk6 h ARG 384 Ca -0.00 -0.18 -0.11 0.00 -0.81 0.00 0.00 59.98 58.87 1rk6 h ARG 384 Cb 0.44 -0.11 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1rk6 h ARG 384 CO 0.03 0.76 -0.34 0.28 -1.51 0.00 0.00 179.97 179.19 1rk6 h VAL 385 N 0.75 1.36 -0.20 0.20 2.07 -0.94 -1.34 116.25 118.15 1rk6 h VAL 385 Ca 0.16 -1.61 -0.16 0.00 0.82 0.00 0.00 66.70 65.91 1rk6 h VAL 385 Cb 0.37 2.01 -0.01 0.00 -1.52 0.00 0.00 31.29 32.14 1rk6 h VAL 385 CO 0.01 0.48 -0.55 -0.07 0.02 0.00 0.00 177.57 177.46 1rk6 h LEU 386 N 0.11 0.68 0.00 2.57 3.38 -1.19 -0.45 115.31 120.41 1rk6 h LEU 386 Ca -0.00 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.61 1rk6 h LEU 386 Cb 0.94 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1rk6 h LEU 386 CO 0.07 1.09 0.00 0.61 0.09 0.00 0.00 178.44 180.30 1rk6 n GLY 387 N 0.27 0.08 0.34 0.83 0.00 0.61 -2.95 105.19 104.37 1rk6 n GLY 387 Ca -0.03 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.88 1rk6 n GLY 387 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1rk6 h HIS 388 N 0.00 -0.89 0.00 1.61 -0.00 -1.62 0.06 115.15 114.31 1rk6 h HIS 388 Ca 0.00 0.04 -0.04 0.00 -0.00 0.00 0.00 60.37 60.37 1rk6 h HIS 388 Cb 0.00 0.41 0.00 0.00 -0.00 0.00 0.00 27.41 27.82 1rk6 h HIS 388 CO 0.00 -0.40 -0.15 1.88 -0.00 0.00 0.00 177.93 179.26 1rk6 h TYR 389 N -0.41 0.14 0.27 5.26 0.05 -1.30 -0.81 116.97 120.16 1rk6 h TYR 389 Ca 0.09 -0.08 -0.01 0.00 0.05 0.00 0.00 58.73 58.78 1rk6 h TYR 389 Cb 0.55 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 38.28 1rk6 h TYR 389 CO -0.39 0.90 -0.13 1.03 -1.05 0.00 0.00 178.16 178.52 1rk6 h SER 390 N -0.67 -0.31 0.15 3.88 0.87 -1.14 -0.74 113.55 115.60 1rk6 h SER 390 Ca -0.02 -0.02 -0.01 0.00 -1.23 0.00 0.00 61.79 60.52 1rk6 h SER 390 Cb 0.95 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.99 1rk6 h SER 390 CO 0.03 0.16 -0.07 -0.09 -0.53 0.00 0.00 176.83 176.33 1rk6 h ARG 391 N -1.09 -0.19 0.05 2.24 2.43 -1.19 -2.01 114.38 114.63 1rk6 h ARG 391 Ca -0.04 0.01 -0.26 0.00 -0.81 0.00 0.00 59.98 58.88 1rk6 h ARG 391 Cb 0.30 0.04 0.02 0.00 -0.42 0.00 0.00 29.97 29.91 1rk6 h ARG 391 CO 0.06 0.26 -1.09 -0.44 -1.51 0.00 0.00 179.97 177.25 1rk6 h ASP 392 N -0.76 0.71 0.03 -3.80 3.32 -0.90 -3.33 116.42 111.68 1rk6 h ASP 392 Ca -0.02 -0.62 0.00 0.00 0.02 0.00 0.00 57.03 56.41 1rk6 h ASP 392 Cb 0.53 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.86 1rk6 h ASP 392 CO 0.03 1.43 -1.38 0.18 -1.72 0.00 0.00 179.24 177.78 1rk6 n LEU 393 N -3.76 0.59 -1.88 1.55 4.77 -0.32 -5.00 117.00 112.96 1rk6 n LEU 393 Ca -0.10 -0.28 -0.15 0.00 -0.03 0.00 0.00 56.01 55.45 1rk6 n LEU 393 Cb 0.91 -0.01 0.01 0.00 -2.33 0.00 0.00 43.42 42.00 1rk6 n LEU 393 CO 0.55 0.14 -0.10 0.61 -1.33 0.00 0.00 177.39 177.26 1rk6 n GLY 394 N 1.40 -0.19 0.21 -0.72 0.00 -0.75 -4.91 105.19 100.22 1rk6 n GLY 394 Ca 0.01 -0.22 0.04 0.00 0.00 0.00 0.00 46.02 45.85 1rk6 n GLY 394 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1rk6 h LEU 395 N -0.44 0.00 -7.00 0.99 5.85 -1.29 -3.45 115.31 109.96 1rk6 h LEU 395 Ca -0.35 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.37 1rk6 h LEU 395 Cb 1.25 0.00 -0.15 0.00 0.37 0.00 0.00 40.66 42.13 1rk6 h LEU 395 CO 0.40 0.27 0.29 0.72 -0.34 0.00 0.00 178.44 179.78 1rk6 s PHE 396 N -4.41 -0.52 0.78 1.25 -0.12 -1.26 -4.91 117.98 108.79 1rk6 s PHE 396 Ca -0.03 0.55 -0.11 0.00 -0.05 0.00 0.00 56.93 57.29 1rk6 s PHE 396 Cb 0.15 0.51 0.06 0.00 -0.63 0.00 0.00 43.02 43.11 1rk6 s PHE 396 CO 0.71 -0.68 1.09 -1.25 -0.05 0.00 0.00 175.22 175.03 1rk6 s PRO 397 N -2.71 2.18 0.27 1.99 0.04 -1.26 -4.53 135.00 130.98 1rk6 s PRO 397 Ca -0.02 1.08 -0.01 0.00 0.04 0.00 0.00 61.00 62.10 1rk6 s PRO 397 Cb -0.01 -1.89 0.46 0.00 0.04 0.00 0.00 34.50 33.10 1rk6 s PRO 397 CO -0.05 -1.67 1.87 1.25 0.04 0.00 0.00 177.00 178.43 1rk6 h LEU 398 N -1.15 1.00 -1.52 -3.56 5.85 -1.94 -0.82 115.31 113.17 1rk6 h LEU 398 Ca -0.44 0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.25 1rk6 h LEU 398 Cb 1.24 -0.19 -0.01 0.00 0.37 0.00 0.00 40.66 42.07 1rk6 h LEU 398 CO 0.53 0.60 -0.25 1.05 -0.34 0.00 0.00 178.44 180.03 1rk6 h GLU 399 N 1.11 0.00 0.03 1.25 9.09 -1.91 0.28 114.58 124.43 1rk6 h GLU 399 Ca 0.46 0.00 -0.25 0.00 0.05 0.00 0.00 59.36 59.62 1rk6 h GLU 399 Cb 0.29 0.00 0.02 0.00 -1.65 0.00 0.00 28.75 27.41 1rk6 h GLU 399 CO -0.21 0.25 -1.00 1.15 0.05 0.00 0.00 179.01 179.25 1rk6 h THR 400 N 0.00 1.31 -0.61 -1.06 2.02 -1.55 -1.17 112.91 111.86 1rk6 h THR 400 Ca -0.00 -2.26 0.01 0.00 0.77 0.00 0.00 66.41 64.93 1rk6 h THR 400 Cb 0.46 2.51 -0.03 0.00 -1.74 0.00 0.00 68.15 69.35 1rk6 h THR 400 CO 0.03 0.69 0.39 0.00 0.37 0.00 0.00 175.52 177.00 1rk6 h ALA 401 N 0.35 0.77 -0.46 6.16 0.00 -0.82 -0.70 119.26 124.57 1rk6 h ALA 401 Ca -0.13 -0.03 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 1rk6 h ALA 401 Cb 1.67 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 19.22 1rk6 h ALA 401 CO 0.19 0.17 0.08 0.28 0.00 0.00 0.00 179.25 179.97 1rk6 h VAL 402 N 0.79 1.24 -1.00 0.00 2.07 -0.96 -2.80 116.25 115.59 1rk6 h VAL 402 Ca 0.23 -0.88 0.04 0.00 0.82 0.00 0.00 66.70 66.91 1rk6 h VAL 402 Cb -0.05 0.93 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 1rk6 h VAL 402 CO -0.07 0.31 0.65 -0.25 0.02 0.00 0.00 177.57 178.24 1rk6 h TRP 403 N 0.62 1.23 0.00 1.57 7.01 -0.83 -0.95 115.95 124.60 1rk6 h TRP 403 Ca 0.14 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.17 1rk6 h TRP 403 Cb 0.37 -0.41 0.00 0.00 -2.10 0.00 0.00 29.16 27.02 1rk6 h TRP 403 CO 0.03 0.70 0.00 1.63 -2.79 0.00 0.00 178.44 178.00 1rk6 n LYS 404 N -4.45 0.06 -0.03 2.65 5.02 -0.30 -1.66 118.16 119.45 1rk6 n LYS 404 Ca 0.14 0.46 0.01 0.00 -2.02 0.00 0.00 58.31 56.90 1rk6 n LYS 404 Cb 0.10 -1.67 0.02 0.00 -0.02 0.00 0.00 35.03 33.47 1rk6 n LYS 404 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1rk6 n MET 405 N -1.79 2.15 0.00 1.97 0.00 -0.45 -1.64 117.12 117.36 1rk6 n MET 405 Ca 0.01 -1.46 0.00 0.00 0.00 0.00 0.00 57.70 56.25 1rk6 n MET 405 Cb 0.09 -0.96 0.00 0.00 0.00 0.00 0.00 33.22 32.34 1rk6 n MET 405 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 175.97 176.22 1rk6 n THR 406 N -0.52 0.00 -0.34 3.17 -2.24 -0.68 -0.65 114.28 113.01 1rk6 n THR 406 Ca 0.02 0.00 -0.03 0.00 -2.27 0.00 0.00 64.05 61.78 1rk6 n THR 406 Cb 0.36 -0.01 0.11 0.00 -2.10 0.00 0.00 70.33 68.70 1rk6 n THR 406 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1rk6 h GLY 407 N 0.00 1.35 0.87 3.38 0.00 -1.25 -0.22 103.07 107.20 1rk6 h GLY 407 Ca 0.00 -0.56 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 1rk6 h GLY 407 CO 0.00 0.54 -0.06 -2.00 0.00 0.00 0.00 176.54 175.02 1rk6 h LEU 408 N 1.28 -0.15 -0.68 3.11 5.85 -1.54 -2.02 115.31 121.17 1rk6 h LEU 408 Ca 0.33 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.92 1rk6 h LEU 408 Cb -0.06 0.04 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 1rk6 h LEU 408 CO -0.06 0.01 0.32 0.74 -0.34 0.00 0.00 178.44 179.11 1rk6 h THR 409 N -0.30 1.23 -0.73 1.05 2.02 -1.67 -0.75 112.91 113.75 1rk6 h THR 409 Ca -0.02 -0.65 -0.03 0.00 0.77 0.00 0.00 66.41 66.48 1rk6 h THR 409 Cb 0.24 0.40 -0.03 0.00 -1.74 0.00 0.00 68.15 67.02 1rk6 h THR 409 CO 0.03 0.27 0.33 0.00 0.37 0.00 0.00 175.52 176.51 1rk6 h ALA 410 N 1.15 1.19 -0.31 6.16 0.00 -1.03 -1.54 119.26 124.89 1rk6 h ALA 410 Ca 0.23 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.94 1rk6 h ALA 410 Cb 0.13 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 1rk6 h ALA 410 CO -0.03 0.60 0.02 0.00 0.00 0.00 0.00 179.25 179.84 1rk6 h ALA 411 N 1.31 0.41 -0.02 0.00 0.00 -0.70 -0.09 119.26 120.17 1rk6 h ALA 411 Ca 0.25 -0.22 -0.11 0.00 0.00 0.00 0.00 54.91 54.83 1rk6 h ALA 411 Cb 0.15 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1rk6 h ALA 411 CO -0.03 0.14 -0.50 0.87 0.00 0.00 0.00 179.25 179.73 1rk6 h LYS 412 N 0.33 0.06 -0.02 0.00 1.79 -0.84 -2.80 116.57 115.09 1rk6 h LYS 412 Ca 0.09 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1rk6 h LYS 412 Cb 0.41 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.06 1rk6 h LYS 412 CO 0.01 0.55 -0.14 1.19 -1.08 0.00 0.00 179.45 179.98 1rk6 n PHE 413 N -3.94 0.00 -3.00 -1.35 3.72 -0.61 -4.97 117.46 107.31 1rk6 n PHE 413 Ca -0.02 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.26 1rk6 n PHE 413 Cb 0.52 -0.02 0.04 0.00 -0.94 0.00 0.00 39.48 39.08 1rk6 n PHE 413 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1rk6 n GLY 414 N 1.31 0.11 3.41 1.37 0.00 -0.37 -4.77 105.19 106.25 1rk6 n GLY 414 Ca 0.14 -0.19 -0.45 0.00 0.00 0.00 0.00 46.02 45.52 1rk6 n GLY 414 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1rk6 s LEU 415 N -4.32 5.57 0.38 0.99 1.43 -0.19 -4.43 118.68 118.12 1rk6 s LEU 415 Ca 0.29 -2.25 -0.28 0.00 -1.03 0.00 0.00 54.13 50.86 1rk6 s LEU 415 Cb -0.13 -2.34 -0.11 0.00 0.03 0.00 0.00 46.19 43.64 1rk6 s LEU 415 CO 0.36 -0.91 1.49 0.00 0.23 0.00 0.00 176.35 177.51 1rk6 s ALA 416 N 1.90 3.55 -1.88 4.21 0.00 -1.26 -2.91 121.76 125.37 1rk6 s ALA 416 Ca 0.28 1.58 0.00 0.00 0.00 0.00 0.00 51.96 53.82 1rk6 s ALA 416 Cb -0.06 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.44 1rk6 s ALA 416 CO -0.09 -1.08 0.00 0.39 0.00 0.00 0.00 175.76 174.98 1rk6 n GLU 417 N 0.41 -1.43 -4.33 0.00 1.02 -1.26 -4.92 120.64 110.12 1rk6 n GLU 417 Ca 0.01 1.08 -0.17 0.00 -0.02 0.00 0.00 57.16 58.06 1rk6 n GLU 417 Cb 0.39 -5.51 -0.10 0.00 -0.02 0.00 0.00 31.44 26.20 1rk6 n GLU 417 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1rk6 s ARG 418 N -4.22 1.34 0.00 3.49 0.52 -1.15 -0.57 118.95 118.37 1rk6 s ARG 418 Ca 0.00 -1.69 0.00 0.00 -0.52 0.00 0.00 55.73 53.52 1rk6 s ARG 418 Cb 0.00 -0.57 0.00 0.00 0.52 0.00 0.00 34.95 34.90 1rk6 s ARG 418 CO 0.00 -0.12 0.00 0.41 0.02 0.00 0.00 175.30 175.61 1rk6 n GLY 419 N -0.42 0.84 3.05 -3.53 0.00 -1.26 -4.82 105.19 99.03 1rk6 n GLY 419 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.87 1rk6 n GLY 419 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rk6 s GLN 420 N -0.30 0.38 -0.91 1.61 -0.21 -1.26 -1.82 119.66 117.14 1rk6 s GLN 420 Ca 0.00 -0.40 -0.17 0.00 0.02 0.00 0.00 55.36 54.81 1rk6 s GLN 420 Cb 0.00 0.15 0.17 0.00 1.00 0.00 0.00 33.01 34.33 1rk6 s GLN 420 CO 0.00 -0.08 1.02 0.08 -2.12 0.00 0.00 175.29 174.19 1rk6 s VAL 421 N -1.23 5.08 0.01 1.09 1.01 0.09 -4.86 120.40 121.60 1rk6 s VAL 421 Ca -0.13 -1.99 0.01 0.00 0.00 0.00 0.00 61.98 59.87 1rk6 s VAL 421 Cb -0.08 -4.67 -0.01 0.00 0.00 0.00 0.00 36.38 31.62 1rk6 s VAL 421 CO 0.00 -1.34 -0.05 -1.10 0.00 0.00 0.00 175.10 172.62 1rk6 s GLN 422 N 1.65 0.37 0.34 2.72 -1.52 -1.26 -4.85 119.66 117.10 1rk6 s GLN 422 Ca 0.28 -0.37 -0.29 0.00 -1.95 0.00 0.00 55.36 53.03 1rk6 s GLN 422 Cb -0.07 -0.24 -0.11 0.00 -0.22 0.00 0.00 33.01 32.37 1rk6 s GLN 422 CO -0.09 0.05 1.55 -2.30 -0.25 0.00 0.00 175.29 174.25 1rk6 n PRO 423 N 2.38 2.71 0.00 2.91 -0.02 -1.26 -1.74 135.00 139.98 1rk6 n PRO 423 Ca -0.17 0.96 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1rk6 n PRO 423 Cb 0.57 -2.72 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1rk6 n PRO 423 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1rk6 n GLY 424 N 1.26 3.24 3.88 -1.23 0.00 0.49 -5.01 105.19 107.82 1rk6 n GLY 424 Ca 0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1rk6 n GLY 424 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1rk6 s TYR 425 N -2.41 3.44 0.43 1.61 1.51 -0.71 -4.78 117.35 116.44 1rk6 s TYR 425 Ca 0.00 1.10 -0.24 0.00 -1.01 0.00 0.00 57.07 56.92 1rk6 s TYR 425 Cb 0.00 -2.90 -0.08 0.00 -0.11 0.00 0.00 41.96 38.88 1rk6 s TYR 425 CO 0.00 -0.95 1.22 0.71 -1.11 0.00 0.00 175.55 175.42 1rk6 s TYR 426 N -3.25 2.87 -1.50 2.71 2.02 0.26 -0.68 117.35 119.78 1rk6 s TYR 426 Ca 0.56 1.50 -0.11 0.00 -0.37 0.00 0.00 57.07 58.65 1rk6 s TYR 426 Cb -0.11 -3.49 0.00 0.00 -0.40 0.00 0.00 41.96 37.96 1rk6 s TYR 426 CO 0.52 -1.71 2.56 0.00 -1.57 0.00 0.00 175.55 175.35 1rk6 n ALA 427 N -0.20 6.64 -2.53 3.71 0.00 0.16 -4.61 120.51 123.69 1rk6 n ALA 427 Ca 0.06 -3.79 -0.41 0.00 0.00 0.00 0.00 53.44 49.30 1rk6 n ALA 427 Cb 0.46 -3.31 -0.10 0.00 0.00 0.00 0.00 19.45 16.50 1rk6 n ALA 427 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1rk6 s ASP 428 N 2.13 6.14 0.03 0.00 1.01 -1.26 -0.79 116.67 123.94 1rk6 s ASP 428 Ca 0.58 -0.39 -0.04 0.00 0.71 0.00 0.00 52.55 53.41 1rk6 s ASP 428 Cb 0.16 -2.18 -0.01 0.00 1.01 0.00 0.00 42.92 41.90 1rk6 s ASP 428 CO -0.07 -0.35 0.06 -0.76 0.21 0.00 0.00 175.17 174.27 1rk6 s LEU 429 N 1.92 1.94 -0.01 1.23 1.43 0.12 -1.12 118.68 124.19 1rk6 s LEU 429 Ca 0.10 -0.53 0.05 0.00 -1.03 0.00 0.00 54.13 52.71 1rk6 s LEU 429 Cb -0.17 0.46 -0.01 0.00 0.03 0.00 0.00 46.19 46.49 1rk6 s LEU 429 CO 0.11 -0.45 -0.16 -0.69 0.23 0.00 0.00 176.35 175.39 1rk6 s VAL 430 N -2.34 1.28 -0.26 -1.59 1.01 -0.23 -0.59 120.40 117.69 1rk6 s VAL 430 Ca -0.07 -0.70 -0.03 0.00 0.00 0.00 0.00 61.98 61.18 1rk6 s VAL 430 Cb -0.03 -1.07 0.02 0.00 0.00 0.00 0.00 36.38 35.30 1rk6 s VAL 430 CO -0.04 0.36 -0.03 -0.69 0.00 0.00 0.00 175.10 174.71 1rk6 s VAL 431 N -0.39 3.18 0.09 2.92 1.01 0.01 -1.09 120.40 126.13 1rk6 s VAL 431 Ca 0.06 -0.90 0.02 0.00 0.00 0.00 0.00 61.98 61.17 1rk6 s VAL 431 Cb -0.06 -2.61 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 1rk6 s VAL 431 CO -0.01 0.19 -0.08 0.72 0.00 0.00 0.00 175.10 175.93 1rk6 s PHE 432 N 1.38 0.92 -0.42 5.22 -0.71 -0.16 -0.71 117.98 123.50 1rk6 s PHE 432 Ca 0.01 -0.81 -0.19 0.00 -1.04 0.00 0.00 56.93 54.91 1rk6 s PHE 432 Cb -0.17 -0.52 0.02 0.00 -1.21 0.00 0.00 43.02 41.15 1rk6 s PHE 432 CO -0.03 -0.10 0.52 0.34 -1.34 0.00 0.00 175.22 174.61 1rk6 s ASP 433 N -2.77 6.25 0.53 1.98 -1.08 0.11 -0.33 116.67 121.36 1rk6 s ASP 433 Ca 0.08 -0.50 0.19 0.00 -0.52 0.00 0.00 52.55 51.81 1rk6 s ASP 433 Cb 0.02 -2.26 1.34 0.00 -1.46 0.00 0.00 42.92 40.56 1rk6 s ASP 433 CO -0.03 -0.65 2.12 1.55 0.52 0.00 0.00 175.17 178.68 1rk6 h PRO 434 N 8.76 0.00 0.00 4.34 0.13 -1.88 0.38 132.00 143.74 1rk6 h PRO 434 Ca -0.26 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.76 1rk6 h PRO 434 Cb 1.11 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.22 1rk6 h PRO 434 CO 0.83 0.00 -0.52 0.00 -0.23 0.00 0.00 178.00 178.08 1rk6 h ALA 435 N 1.93 0.85 -0.00 -0.56 0.00 -1.92 -3.36 119.26 116.20 1rk6 h ALA 435 Ca 0.06 -0.47 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1rk6 h ALA 435 Cb 0.25 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1rk6 h ALA 435 CO -0.00 0.65 -0.14 0.25 0.00 0.00 0.00 179.25 180.01 1rk6 n THR 436 N -3.49 0.00 -1.69 0.00 -2.24 -0.93 -5.03 114.28 100.91 1rk6 n THR 436 Ca 0.00 -0.43 -0.45 0.00 -2.27 0.00 0.00 64.05 60.91 1rk6 n THR 436 Cb 0.63 1.02 -0.03 0.00 -2.10 0.00 0.00 70.33 69.84 1rk6 n THR 436 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1rk6 n VAL 437 N -0.83 0.19 -3.57 2.28 3.14 0.08 -4.06 118.33 115.56 1rk6 n VAL 437 Ca 0.01 -0.05 -0.13 0.00 -2.96 0.00 0.00 64.34 61.21 1rk6 n VAL 437 Cb 0.07 -1.67 -0.06 0.00 -1.06 0.00 0.00 33.84 31.12 1rk6 n VAL 437 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1rk6 s ALA 438 N 0.79 -1.88 0.02 1.55 0.00 -0.71 -4.07 121.76 117.46 1rk6 s ALA 438 Ca 0.75 1.54 -0.30 0.00 0.00 0.00 0.00 51.96 53.95 1rk6 s ALA 438 Cb -0.62 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 21.91 1rk6 s ALA 438 CO 0.39 -0.32 1.04 0.16 0.00 0.00 0.00 175.76 177.02 1rk6 s ASP 439 N -1.00 7.29 -0.07 0.00 -4.77 -1.26 -1.03 116.67 115.83 1rk6 s ASP 439 Ca -0.04 1.76 0.18 0.00 -3.30 0.00 0.00 52.55 51.15 1rk6 s ASP 439 Cb -0.01 -2.57 -0.28 0.00 -1.09 0.00 0.00 42.92 38.97 1rk6 s ASP 439 CO 0.04 -0.32 0.33 -1.20 0.70 0.00 0.00 175.17 174.72 1rk6 n SER 440 N 3.90 0.58 -4.74 2.11 7.64 -1.26 -4.89 113.62 116.96 1rk6 n SER 440 Ca 0.07 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.53 1rk6 n SER 440 Cb 0.50 1.63 -0.03 0.00 -1.01 0.00 0.00 64.21 65.30 1rk6 n SER 440 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1rk6 s ALA 441 N -3.10 3.58 0.37 -0.43 0.00 -1.23 -4.74 121.76 116.21 1rk6 s ALA 441 Ca -0.08 1.22 0.04 0.00 0.00 0.00 0.00 51.96 53.15 1rk6 s ALA 441 Cb 0.10 -3.52 -0.05 0.00 0.00 0.00 0.00 23.12 19.65 1rk6 s ALA 441 CO 0.78 -0.64 0.06 0.95 0.00 0.00 0.00 175.76 176.91 1rk6 s THR 442 N 0.12 1.20 0.35 0.00 -4.23 -0.18 -4.89 115.64 108.01 1rk6 s THR 442 Ca 0.59 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.14 1rk6 s THR 442 Cb -0.39 -2.70 0.19 0.00 1.34 0.00 0.00 72.50 70.95 1rk6 s THR 442 CO 0.40 0.00 1.93 -0.26 -0.54 0.00 0.00 174.62 176.15 1rk6 h PHE 443 N 1.95 0.57 -0.34 3.99 0.04 -1.95 -0.48 116.94 120.71 1rk6 h PHE 443 Ca -0.41 -0.03 -0.13 0.00 2.80 0.00 0.00 57.97 60.20 1rk6 h PHE 443 Cb 1.25 -0.17 -0.01 0.00 2.20 0.00 0.00 35.95 39.22 1rk6 h PHE 443 CO 0.84 0.49 -0.31 0.93 -0.60 0.00 0.00 178.31 179.65 1rk6 h GLU 444 N 0.56 0.82 -2.76 1.51 3.07 -1.96 -3.37 114.58 112.45 1rk6 h GLU 444 Ca 0.13 -0.42 -0.61 0.00 -0.50 0.00 0.00 59.36 57.96 1rk6 h GLU 444 Cb 0.20 0.01 -0.40 0.00 -0.84 0.00 0.00 28.75 27.71 1rk6 h GLU 444 CO -0.01 1.06 -0.76 -1.01 -1.40 0.00 0.00 179.01 176.89 1rk6 s HIS 445 N -4.41 2.41 -2.00 4.33 3.76 -1.00 -4.99 115.29 113.39 1rk6 s HIS 445 Ca -0.12 -2.86 0.27 0.00 -0.15 0.00 0.00 55.06 52.21 1rk6 s HIS 445 Cb 0.10 -1.88 1.64 0.00 1.11 0.00 0.00 32.58 33.55 1rk6 s HIS 445 CO 0.85 -0.68 1.99 -0.35 -0.85 0.00 0.00 174.74 175.70 1rk6 n PRO 446 N 2.41 0.87 -0.14 8.40 -0.04 -0.22 -1.01 135.00 145.26 1rk6 n PRO 446 Ca 0.24 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.77 1rk6 n PRO 446 Cb 0.41 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.50 1rk6 n PRO 446 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1rk6 n THR 447 N -1.00 1.67 -2.29 0.52 -2.24 -1.26 -4.42 114.28 105.26 1rk6 n THR 447 Ca 0.21 -1.75 -0.41 0.00 -2.27 0.00 0.00 64.05 59.82 1rk6 n THR 447 Cb 0.09 0.01 -0.03 0.00 -2.10 0.00 0.00 70.33 68.30 1rk6 n THR 447 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1rk6 s GLU 448 N -2.23 4.48 0.24 -0.78 0.41 -1.23 -4.97 118.70 114.63 1rk6 s GLU 448 Ca 0.26 2.00 -0.30 0.00 -0.41 0.00 0.00 54.97 56.52 1rk6 s GLU 448 Cb 0.21 -3.15 -0.09 0.00 -1.78 0.00 0.00 34.13 29.32 1rk6 s GLU 448 CO 0.05 -0.03 1.16 1.03 -0.49 0.00 0.00 175.26 176.98 1rk6 s ARG 449 N -1.27 4.54 0.70 1.61 3.00 -1.26 -3.53 118.95 122.74 1rk6 s ARG 449 Ca 0.49 1.87 -0.17 0.00 0.00 0.00 0.00 55.73 57.92 1rk6 s ARG 449 Cb -0.36 -3.21 0.02 0.00 0.00 0.00 0.00 34.95 31.41 1rk6 s ARG 449 CO 0.45 0.03 1.27 0.00 0.00 0.00 0.00 175.30 177.05 1rk6 n ALA 450 N 1.81 0.80 -2.53 2.13 0.00 -1.26 -4.43 120.51 117.02 1rk6 n ALA 450 Ca 0.02 -0.10 -0.27 0.00 0.00 0.00 0.00 53.44 53.09 1rk6 n ALA 450 Cb 0.44 -2.30 -0.02 0.00 0.00 0.00 0.00 19.45 17.57 1rk6 n ALA 450 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1rk6 s ALA 451 N -1.60 3.62 0.00 0.00 0.00 -0.20 -4.50 121.76 119.08 1rk6 s ALA 451 Ca 0.80 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 52.10 1rk6 s ALA 451 Cb -0.35 -2.27 0.00 0.00 0.00 0.00 0.00 23.12 20.49 1rk6 s ALA 451 CO 0.43 0.09 0.00 0.41 0.00 0.00 0.00 175.76 176.69 1rk6 n GLY 452 N -1.37 0.48 3.38 0.00 0.00 -1.26 -1.73 105.19 104.69 1rk6 n GLY 452 Ca -0.02 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.55 1rk6 n GLY 452 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1rk6 s ILE 453 N -2.08 5.16 -0.09 -0.61 -1.09 -1.26 -0.71 121.20 120.51 1rk6 s ILE 453 Ca 0.00 -1.08 -0.24 0.00 -2.23 0.00 0.00 60.65 57.10 1rk6 s ILE 453 Cb 0.00 -4.22 -0.20 0.00 -1.58 0.00 0.00 42.46 36.46 1rk6 s ILE 453 CO 0.00 -0.71 0.85 -0.74 -1.23 0.00 0.00 174.94 173.12 1rk6 h HIS 454 N 8.84 -0.05 -2.83 3.97 -0.00 -1.28 -3.46 115.15 120.36 1rk6 h HIS 454 Ca -0.29 -0.00 -0.04 0.00 -0.00 0.00 0.00 60.37 60.04 1rk6 h HIS 454 Cb 1.10 0.02 -0.14 0.00 -0.00 0.00 0.00 27.41 28.39 1rk6 h HIS 454 CO 0.69 0.62 0.14 -1.54 -0.00 0.00 0.00 177.93 177.84 1rk6 s SER 455 N -5.87 -0.52 -0.02 3.26 1.04 -1.05 -4.19 113.70 106.35 1rk6 s SER 455 Ca -0.15 0.12 0.01 0.00 0.48 0.00 0.00 55.95 56.41 1rk6 s SER 455 Cb -0.01 0.55 0.01 0.00 0.10 0.00 0.00 66.02 66.68 1rk6 s SER 455 CO 0.58 -0.84 -0.01 -0.69 0.98 0.00 0.00 173.24 173.26 1rk6 s VAL 456 N -3.05 0.17 -0.04 5.02 1.01 -0.60 -0.81 120.40 122.09 1rk6 s VAL 456 Ca -0.02 0.01 0.05 0.00 0.00 0.00 0.00 61.98 62.02 1rk6 s VAL 456 Cb -0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 36.38 36.16 1rk6 s VAL 456 CO -0.07 0.10 -0.21 -0.31 0.00 0.00 0.00 175.10 174.61 1rk6 s TYR 457 N 0.53 2.03 -0.14 5.22 1.51 0.24 -0.13 117.35 126.61 1rk6 s TYR 457 Ca -0.05 -0.56 0.00 0.00 -1.01 0.00 0.00 57.07 55.46 1rk6 s TYR 457 Cb -0.08 -1.34 0.02 0.00 -0.11 0.00 0.00 41.96 40.45 1rk6 s TYR 457 CO -0.01 -0.16 -0.14 0.08 -1.11 0.00 0.00 175.55 174.21 1rk6 s VAL 458 N -0.14 1.52 -1.57 0.71 1.01 0.08 -0.70 120.40 121.31 1rk6 s VAL 458 Ca -0.01 -0.61 -0.14 0.00 0.00 0.00 0.00 61.98 61.21 1rk6 s VAL 458 Cb -0.12 -1.43 0.10 0.00 0.00 0.00 0.00 36.38 34.93 1rk6 s VAL 458 CO 0.02 0.45 0.91 0.59 0.00 0.00 0.00 175.10 177.07 1rk6 n ASN 459 N 4.69 -4.19 0.00 3.32 5.03 -1.11 -1.27 115.26 121.73 1rk6 n ASN 459 Ca -0.17 -0.85 0.00 0.00 0.87 0.00 0.00 54.58 54.43 1rk6 n ASN 459 Cb 0.50 -3.57 0.00 0.00 -1.02 0.00 0.00 39.78 35.70 1rk6 n ASN 459 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1rk6 n GLY 460 N -1.62 2.87 3.75 7.41 0.00 0.03 -4.03 105.19 113.61 1rk6 n GLY 460 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1rk6 n GLY 460 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1rk6 s ALA 461 N -1.93 3.57 0.03 4.61 0.00 -0.39 -4.98 121.76 122.68 1rk6 s ALA 461 Ca 0.00 -0.31 -0.30 0.00 0.00 0.00 0.00 51.96 51.35 1rk6 s ALA 461 Cb 0.00 -2.48 -0.07 0.00 0.00 0.00 0.00 23.12 20.57 1rk6 s ALA 461 CO 0.00 0.15 1.48 0.00 0.00 0.00 0.00 175.76 177.39 1rk6 s ALA 462 N 0.17 3.62 -0.05 0.00 0.00 -1.26 -0.74 121.76 123.49 1rk6 s ALA 462 Ca 0.22 1.01 0.14 0.00 0.00 0.00 0.00 51.96 53.32 1rk6 s ALA 462 Cb -0.15 -3.62 -0.21 0.00 0.00 0.00 0.00 23.12 19.15 1rk6 s ALA 462 CO 0.08 -0.94 0.24 1.33 0.00 0.00 0.00 175.76 176.47 1rk6 n VAL 463 N 4.60 0.26 -3.90 0.00 0.24 0.81 -4.56 118.33 115.77 1rk6 n VAL 463 Ca 0.14 -0.39 -0.24 0.00 -2.04 0.00 0.00 64.34 61.80 1rk6 n VAL 463 Cb 0.42 -0.06 -0.17 0.00 -1.47 0.00 0.00 33.84 32.56 1rk6 n VAL 463 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 1rk6 s TRP 464 N -2.80 1.04 -0.12 6.34 -0.11 -1.04 -1.46 118.94 120.79 1rk6 s TRP 464 Ca -0.06 -0.42 -0.21 0.00 1.22 0.00 0.00 56.10 56.63 1rk6 s TRP 464 Cb 0.08 -0.98 0.05 0.00 -1.50 0.00 0.00 33.47 31.12 1rk6 s TRP 464 CO 0.58 -0.39 0.52 -1.21 -4.62 0.00 0.00 176.95 171.84 1rk6 s GLU 465 N 1.69 0.75 -1.59 5.86 2.02 -0.80 -1.56 118.70 125.08 1rk6 s GLU 465 Ca 0.02 0.41 -0.15 0.00 0.02 0.00 0.00 54.97 55.28 1rk6 s GLU 465 Cb -0.13 0.35 0.11 0.00 0.10 0.00 0.00 34.13 34.57 1rk6 s GLU 465 CO -0.05 -0.16 0.87 -0.25 0.02 0.00 0.00 175.26 175.68 1rk6 n ASP 466 N 1.97 -3.86 -3.85 -0.19 8.00 -1.26 -1.60 116.55 115.76 1rk6 n ASP 466 Ca -0.17 -0.89 -0.29 0.00 0.71 0.00 0.00 54.79 54.16 1rk6 n ASP 466 Cb 0.56 -3.39 0.04 0.00 -0.02 0.00 0.00 41.12 38.31 1rk6 n ASP 466 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1rk6 n GLN 467 N -4.54 -6.06 -3.63 -1.24 1.13 -1.26 -4.98 117.38 96.80 1rk6 n GLN 467 Ca 0.03 0.65 -0.13 0.00 -1.94 0.00 0.00 57.00 55.61 1rk6 n GLN 467 Cb 0.52 -5.57 -0.06 0.00 0.11 0.00 0.00 30.24 25.24 1rk6 n GLN 467 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 1rk6 s SER 468 N -3.33 -0.34 0.15 1.08 0.15 -0.63 -5.13 113.70 105.65 1rk6 s SER 468 Ca 0.64 0.05 -0.30 0.00 0.70 0.00 0.00 55.95 57.04 1rk6 s SER 468 Cb -0.31 0.45 -0.08 0.00 -1.71 0.00 0.00 66.02 64.37 1rk6 s SER 468 CO 0.81 -0.69 1.30 0.12 1.20 0.00 0.00 173.24 175.97 1rk6 s PHE 469 N -2.52 3.31 -0.75 3.44 5.36 -1.26 -1.90 117.98 123.66 1rk6 s PHE 469 Ca -0.05 1.19 0.26 0.00 -0.96 0.00 0.00 56.93 57.37 1rk6 s PHE 469 Cb -0.01 -3.57 0.85 0.00 -0.34 0.00 0.00 43.02 39.96 1rk6 s PHE 469 CO -0.03 -1.81 1.79 0.25 -1.46 0.00 0.00 175.22 173.96 1rk6 n THR 470 N 3.24 0.55 -0.05 0.12 -2.24 -0.53 -4.91 114.28 110.47 1rk6 n THR 470 Ca 0.08 -0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 1rk6 n THR 470 Cb 0.44 -0.59 0.00 0.00 -2.10 0.00 0.00 70.33 68.07 1rk6 n THR 470 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1rk6 n GLY 471 N 1.29 0.43 3.62 3.38 0.00 -1.26 -5.05 105.19 107.59 1rk6 n GLY 471 Ca 0.06 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.65 1rk6 n GLY 471 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1rk6 s GLN 472 N -0.91 3.87 -1.20 1.61 -1.52 -1.26 -4.93 119.66 115.32 1rk6 s GLN 472 Ca 0.00 0.80 -0.10 0.00 -1.95 0.00 0.00 55.36 54.12 1rk6 s GLN 472 Cb 0.00 -3.83 0.21 0.00 -0.22 0.00 0.00 33.01 29.17 1rk6 s GLN 472 CO 0.00 -1.17 1.55 0.72 -0.25 0.00 0.00 175.29 176.13 1rk6 n HIS 473 N 7.43 3.89 1.12 0.91 8.25 -1.26 -4.57 115.22 130.98 1rk6 n HIS 473 Ca 0.12 -3.13 0.12 0.00 -0.26 0.00 0.00 57.72 54.58 1rk6 n HIS 473 Cb 0.48 -1.88 0.29 0.00 1.12 0.00 0.00 29.99 30.00 1rk6 n HIS 473 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1rk6 n ALA 474 N 3.86 3.37 -1.63 -1.41 0.00 -1.21 -4.76 120.51 118.72 1rk6 n ALA 474 Ca 0.34 -0.40 -0.33 0.00 0.00 0.00 0.00 53.44 53.06 1rk6 n ALA 474 Cb 0.38 -1.10 0.02 0.00 0.00 0.00 0.00 19.45 18.75 1rk6 n ALA 474 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1rk6 s GLY 475 N -2.74 2.12 0.11 0.00 0.00 0.07 -4.64 107.32 102.25 1rk6 s GLY 475 Ca 0.18 0.42 0.07 0.00 0.00 0.00 0.00 44.72 45.39 1rk6 s GLY 475 CO 0.61 0.74 -0.17 0.50 0.00 0.00 0.00 173.10 174.79 1rk6 s ARG 476 N -4.10 1.06 -0.16 2.90 0.52 -1.26 -4.55 118.95 113.37 1rk6 s ARG 476 Ca 0.64 -1.19 -0.29 0.00 -0.52 0.00 0.00 55.73 54.37 1rk6 s ARG 476 Cb -0.17 -1.12 -0.00 0.00 0.52 0.00 0.00 34.95 34.17 1rk6 s ARG 476 CO 0.38 0.24 1.04 0.08 0.02 0.00 0.00 175.30 177.06 1rk6 s VAL 477 N -1.64 4.70 0.23 3.52 1.01 -1.26 -1.18 120.40 125.78 1rk6 s VAL 477 Ca 0.07 2.01 0.00 0.00 0.00 0.00 0.00 61.98 64.06 1rk6 s VAL 477 Cb -0.08 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.97 1rk6 s VAL 477 CO 0.04 -0.08 0.41 -0.76 0.00 0.00 0.00 175.10 174.71 1rk6 s LEU 478 N 2.58 4.21 0.15 3.92 1.43 0.34 -4.93 118.68 126.38 1rk6 s LEU 478 Ca 0.47 0.37 0.11 0.00 -1.03 0.00 0.00 54.13 54.04 1rk6 s LEU 478 Cb -0.17 -3.15 -0.04 0.00 0.03 0.00 0.00 46.19 42.86 1rk6 s LEU 478 CO 0.13 -0.08 -0.25 0.20 0.23 0.00 0.00 176.35 176.57 1rk6 s ASN 479 N -3.40 3.30 0.00 2.29 0.02 -1.26 -4.59 114.94 111.30 1rk6 s ASN 479 Ca 0.38 -0.79 0.18 0.00 -1.02 0.00 0.00 52.86 51.61 1rk6 s ASN 479 Cb -0.11 -0.23 1.06 0.00 0.02 0.00 0.00 41.25 42.00 1rk6 s ASN 479 CO 0.30 0.15 1.46 -2.11 0.02 0.00 0.00 177.10 176.92