#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6w n SER 2 N 0.00 2.43 -0.80 1.61 7.64 -1.26 -4.97 113.62 118.28 2k6w n SER 2 Ca 0.00 0.99 0.04 0.00 1.01 0.00 0.00 58.87 60.91 2k6w n SER 2 Cb 0.00 -1.54 0.18 0.00 -1.01 0.00 0.00 64.21 61.84 2k6w n SER 2 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2k6w n PHE 3 N -0.93 0.14 -0.57 1.43 3.72 -1.26 -4.96 117.46 115.02 2k6w n PHE 3 Ca 0.10 -1.41 -0.29 0.00 -0.05 0.00 0.00 57.45 55.80 2k6w n PHE 3 Cb 0.44 -0.24 0.24 0.00 -0.94 0.00 0.00 39.48 38.98 2k6w n PHE 3 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 2k6w s THR 4 N -2.89 2.03 0.75 4.37 2.01 -1.26 -5.10 115.64 115.54 2k6w s THR 4 Ca 0.38 0.01 -0.01 0.00 0.31 0.00 0.00 61.69 62.38 2k6w s THR 4 Cb 0.37 -2.07 0.15 0.00 0.01 0.00 0.00 72.50 70.97 2k6w s THR 4 CO -0.08 -0.01 1.02 -0.62 -0.69 0.00 0.00 174.62 174.24 2k6w n GLU 5 N -4.83 -0.20 -2.49 4.92 1.02 -1.26 -4.70 120.64 113.11 2k6w n GLU 5 Ca 0.04 -2.67 -0.23 0.00 -0.02 0.00 0.00 57.16 54.28 2k6w n GLU 5 Cb 0.54 -0.71 0.05 0.00 -0.02 0.00 0.00 31.44 31.29 2k6w n GLU 5 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2k6w s GLY 6 N -5.17 1.76 0.01 0.62 0.00 -1.26 -4.20 107.32 99.08 2k6w s GLY 6 Ca 0.67 -1.14 -0.23 0.00 0.00 0.00 0.00 44.72 44.02 2k6w s GLY 6 CO 0.45 -0.82 0.52 0.66 0.00 0.00 0.00 173.10 173.91 2k6w s TRP 7 N -2.94 -0.44 0.10 1.90 -2.14 -1.18 -4.24 118.94 110.00 2k6w s TRP 7 Ca 0.58 0.61 0.09 0.00 2.66 0.00 0.00 56.10 60.04 2k6w s TRP 7 Cb -0.10 0.31 -0.04 0.00 -3.10 0.00 0.00 33.47 30.53 2k6w s TRP 7 CO 0.41 -0.58 -0.21 0.08 -2.66 0.00 0.00 176.95 173.99 2k6w s VAL 8 N -1.84 2.63 -0.41 -0.66 1.01 -0.02 -1.50 120.40 119.61 2k6w s VAL 8 Ca -0.09 -1.49 -0.19 0.00 0.00 0.00 0.00 61.98 60.20 2k6w s VAL 8 Cb -0.01 -2.17 0.02 0.00 0.00 0.00 0.00 36.38 34.22 2k6w s VAL 8 CO 0.03 0.17 0.57 -0.60 0.00 0.00 0.00 175.10 175.27 2k6w s ARG 9 N -1.91 3.33 -0.44 2.72 3.00 0.46 -0.60 118.95 125.50 2k6w s ARG 9 Ca 0.16 -0.39 -0.27 0.00 -1.00 0.00 0.00 55.73 54.22 2k6w s ARG 9 Cb -0.10 -3.92 -0.03 0.00 0.00 0.00 0.00 34.95 30.90 2k6w s ARG 9 CO 0.08 -0.89 1.98 0.12 0.00 0.00 0.00 175.30 176.59 2k6w s PHE 10 N 2.58 1.55 -0.22 5.12 5.36 0.45 -4.35 117.98 128.47 2k6w s PHE 10 Ca 0.20 0.85 -0.13 0.00 -0.96 0.00 0.00 56.93 56.88 2k6w s PHE 10 Cb -0.15 -3.99 0.07 0.00 -0.34 0.00 0.00 43.02 38.61 2k6w s PHE 10 CO 0.16 -2.78 0.55 -1.54 -1.46 0.00 0.00 175.22 170.15 2k6w s SER 11 N 8.13 -0.73 -1.36 6.13 1.04 -1.26 -4.60 113.70 121.04 2k6w s SER 11 Ca 0.81 1.21 -0.15 0.00 0.48 0.00 0.00 55.95 58.29 2k6w s SER 11 Cb -0.19 1.09 0.07 0.00 0.10 0.00 0.00 66.02 67.08 2k6w s SER 11 CO 0.28 -0.22 1.94 -0.81 0.98 0.00 0.00 173.24 175.41 2k6w n PRO 12 N 4.21 3.09 -4.49 4.02 -0.04 -1.26 -4.68 135.00 135.85 2k6w n PRO 12 Ca -0.21 -3.05 -0.27 0.00 -0.04 0.00 0.00 63.50 59.94 2k6w n PRO 12 Cb 0.57 -3.34 -0.10 0.00 -0.04 0.00 0.00 33.50 30.59 2k6w n PRO 12 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k6w s GLY 13 N 3.48 2.35 0.36 0.55 0.00 -1.26 -5.03 107.32 107.76 2k6w s GLY 13 Ca 0.49 -2.18 0.09 0.00 0.00 0.00 0.00 44.72 43.12 2k6w s GLY 13 CO -0.00 -2.03 1.85 -0.56 0.00 0.00 0.00 173.10 172.36 2k6w h PRO 14 N 1.78 0.22 -6.46 2.90 0.13 -1.94 -3.42 132.00 125.20 2k6w h PRO 14 Ca -0.43 -0.07 -0.63 0.00 -0.87 0.00 0.00 66.00 64.00 2k6w h PRO 14 Cb 1.25 -0.02 -0.14 0.00 0.13 0.00 0.00 31.00 32.21 2k6w h PRO 14 CO 0.75 0.44 -0.72 0.54 -0.23 0.00 0.00 178.00 178.79 2k6w s ASN 15 N -6.88 4.40 0.00 1.44 4.22 -1.26 -2.08 114.94 114.77 2k6w s ASN 15 Ca -0.05 -0.48 0.00 0.00 -2.14 0.00 0.00 52.86 50.19 2k6w s ASN 15 Cb 0.15 -0.82 0.00 0.00 1.28 0.00 0.00 41.25 41.86 2k6w s ASN 15 CO 0.74 0.13 0.00 0.00 -2.04 0.00 0.00 177.10 175.93 2k6w n ALA 16 N 0.23 0.00 -2.20 3.54 0.00 -0.34 -4.92 120.51 116.82 2k6w n ALA 16 Ca -0.11 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.25 2k6w n ALA 16 Cb 0.54 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.90 2k6w n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k6w s ALA 17 N -1.61 0.34 0.09 0.00 0.00 -1.26 -1.14 121.76 118.18 2k6w s ALA 17 Ca 0.00 -1.08 0.07 0.00 0.00 0.00 0.00 51.96 50.96 2k6w s ALA 17 Cb 0.00 0.34 -0.03 0.00 0.00 0.00 0.00 23.12 23.42 2k6w s ALA 17 CO 0.00 -0.41 -0.19 0.00 0.00 0.00 0.00 175.76 175.16 2k6w s ALA 18 N -3.91 1.64 0.28 0.00 0.00 0.28 -0.41 121.76 119.64 2k6w s ALA 18 Ca 0.07 -1.18 0.01 0.00 0.00 0.00 0.00 51.96 50.86 2k6w s ALA 18 Cb 0.07 -0.21 -0.03 0.00 0.00 0.00 0.00 23.12 22.96 2k6w s ALA 18 CO -0.10 0.31 0.28 0.71 0.00 0.00 0.00 175.76 176.96 2k6w s TYR 19 N -1.18 1.32 -0.24 0.00 2.02 -0.56 -1.54 117.35 117.16 2k6w s TYR 19 Ca 0.04 -1.43 -0.29 0.00 -0.37 0.00 0.00 57.07 55.03 2k6w s TYR 19 Cb -0.10 -0.48 0.17 0.00 -0.40 0.00 0.00 41.96 41.15 2k6w s TYR 19 CO 0.04 -0.85 1.23 -0.48 -1.57 0.00 0.00 175.55 173.92 2k6w s LEU 20 N -3.25 -0.17 -0.18 -1.29 0.05 -1.26 -3.12 118.68 109.46 2k6w s LEU 20 Ca 0.37 0.20 -0.00 0.00 0.05 0.00 0.00 54.13 54.75 2k6w s LEU 20 Cb 0.03 1.38 0.00 0.00 -2.05 0.00 0.00 46.19 45.56 2k6w s LEU 20 CO 0.20 -0.14 -0.14 -0.89 -0.55 0.00 0.00 176.35 174.82 2k6w s THR 21 N -0.90 2.62 -0.26 5.48 2.01 -1.26 -0.86 115.64 122.46 2k6w s THR 21 Ca 0.05 -0.77 -0.24 0.00 0.31 0.00 0.00 61.69 61.05 2k6w s THR 21 Cb -0.01 -2.13 0.07 0.00 0.01 0.00 0.00 72.50 70.44 2k6w s THR 21 CO -0.05 0.50 0.69 -0.22 -0.69 0.00 0.00 174.62 174.85 2k6w s LEU 22 N 1.12 -0.67 0.06 4.42 1.98 -0.64 -4.40 118.68 120.55 2k6w s LEU 22 Ca 0.01 1.41 0.04 0.00 -2.89 0.00 0.00 54.13 52.69 2k6w s LEU 22 Cb -0.14 2.38 -0.04 0.00 0.66 0.00 0.00 46.19 49.05 2k6w s LEU 22 CO -0.05 -0.24 -0.02 -1.83 -1.89 0.00 0.00 176.35 172.32 2k6w s GLU 23 N 0.45 2.57 -0.40 1.98 1.03 -1.26 -0.52 118.70 122.55 2k6w s GLU 23 Ca -0.01 -0.78 -0.25 0.00 0.03 0.00 0.00 54.97 53.96 2k6w s GLU 23 Cb -0.05 -2.55 0.02 0.00 -0.80 0.00 0.00 34.13 30.75 2k6w s GLU 23 CO -0.00 0.57 0.88 1.21 -1.33 0.00 0.00 175.26 176.58 2k6w s ASN 24 N -1.99 6.57 0.01 0.83 2.47 -0.41 -4.95 114.94 117.46 2k6w s ASN 24 Ca 0.23 0.32 0.28 0.00 0.42 0.00 0.00 52.86 54.11 2k6w s ASN 24 Cb -0.12 -2.44 1.11 0.00 -1.45 0.00 0.00 41.25 38.36 2k6w s ASN 24 CO 0.14 -0.90 1.85 -0.81 -3.72 0.00 0.00 177.10 173.67 2k6w n PRO 25 N 6.81 0.01 -1.90 0.43 -0.04 -1.26 -1.73 135.00 137.33 2k6w n PRO 25 Ca 0.05 0.01 -0.28 0.00 -0.04 0.00 0.00 63.50 63.24 2k6w n PRO 25 Cb 0.48 -1.52 0.19 0.00 -0.04 0.00 0.00 33.50 32.62 2k6w n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k6w n GLY 26 N 1.49 -1.35 0.28 0.55 0.00 -1.26 -4.64 105.19 100.25 2k6w n GLY 26 Ca 0.07 -1.73 0.06 0.00 0.00 0.00 0.00 46.02 44.41 2k6w n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k6w n ASP 27 N -3.78 1.37 -4.67 1.61 9.92 -1.26 -2.36 116.55 117.38 2k6w n ASP 27 Ca 0.16 -1.18 -0.23 0.00 -0.53 0.00 0.00 54.79 53.01 2k6w n ASP 27 Cb 0.56 0.42 -0.07 0.00 -0.64 0.00 0.00 41.12 41.40 2k6w n ASP 27 CO 0.00 0.00 0.00 -1.48 0.13 0.00 0.00 177.20 175.85 2k6w s LEU 28 N -1.64 3.29 0.44 0.64 0.05 -1.26 -4.79 118.68 115.42 2k6w s LEU 28 Ca 0.10 -0.56 -0.17 0.00 0.05 0.00 0.00 54.13 53.55 2k6w s LEU 28 Cb 0.09 -1.83 -0.09 0.00 -2.05 0.00 0.00 46.19 42.31 2k6w s LEU 28 CO 0.27 0.01 0.90 -2.16 -0.55 0.00 0.00 176.35 174.82 2k6w s PRO 29 N -3.59 4.01 0.28 1.48 0.04 -1.26 -4.17 135.00 131.78 2k6w s PRO 29 Ca 0.31 0.88 0.00 0.00 0.04 0.00 0.00 61.00 62.23 2k6w s PRO 29 Cb -0.07 -2.23 -0.04 0.00 0.04 0.00 0.00 34.50 32.20 2k6w s PRO 29 CO 0.20 -0.10 0.47 -0.51 0.04 0.00 0.00 177.00 177.10 2k6w s LEU 30 N -3.61 4.14 -0.19 -3.56 1.43 0.17 -4.96 118.68 112.09 2k6w s LEU 30 Ca 0.58 0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 54.03 2k6w s LEU 30 Cb -0.10 -3.21 0.08 0.00 0.03 0.00 0.00 46.19 42.98 2k6w s LEU 30 CO 0.24 -0.16 0.15 -0.60 0.23 0.00 0.00 176.35 176.20 2k6w s ARG 31 N -3.85 0.12 -0.36 1.70 3.52 -1.26 -0.80 118.95 118.02 2k6w s ARG 31 Ca 0.39 -0.01 -0.17 0.00 -0.13 0.00 0.00 55.73 55.81 2k6w s ARG 31 Cb -0.10 -1.53 -0.00 0.00 -1.56 0.00 0.00 34.95 31.76 2k6w s ARG 31 CO 0.32 -0.70 0.43 -1.17 -0.81 0.00 0.00 175.30 173.37 2k6w s LEU 32 N 2.21 4.50 -0.01 -0.88 2.96 0.57 -0.78 118.68 127.26 2k6w s LEU 32 Ca 0.04 -0.27 0.18 0.00 -0.22 0.00 0.00 54.13 53.86 2k6w s LEU 32 Cb -0.16 -2.43 -0.21 0.00 0.50 0.00 0.00 46.19 43.89 2k6w s LEU 32 CO -0.13 -0.44 0.69 1.33 -1.32 0.00 0.00 176.35 176.48 2k6w n VAL 33 N 5.35 0.00 -2.90 1.68 0.24 0.39 -0.61 118.33 122.48 2k6w n VAL 33 Ca -0.07 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.08 2k6w n VAL 33 Cb 0.49 0.81 0.00 0.00 -1.47 0.00 0.00 33.84 33.67 2k6w n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k6w n GLY 34 N 1.43 -0.56 2.66 7.63 0.00 -1.16 -4.83 105.19 110.36 2k6w n GLY 34 Ca 0.02 -0.72 -0.11 0.00 0.00 0.00 0.00 46.02 45.20 2k6w n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6w n ALA 35 N 0.00 -0.31 -3.27 4.61 0.00 -1.26 -0.76 120.51 119.52 2k6w n ALA 35 Ca 0.00 -1.26 -0.13 0.00 0.00 0.00 0.00 53.44 52.05 2k6w n ALA 35 Cb 0.00 1.02 -0.14 0.00 0.00 0.00 0.00 19.45 20.33 2k6w n ALA 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k6w s ARG 36 N -2.61 0.10 0.01 0.00 1.81 -0.28 -4.87 118.95 113.11 2k6w s ARG 36 Ca 0.22 0.21 -0.02 0.00 -1.72 0.00 0.00 55.73 54.43 2k6w s ARG 36 Cb -0.01 -0.04 -0.01 0.00 -0.45 0.00 0.00 34.95 34.44 2k6w s ARG 36 CO 0.16 -0.07 0.02 -0.08 -0.68 0.00 0.00 175.30 174.65 2k6w s THR 37 N 0.47 0.08 0.20 0.02 -1.32 -1.26 -0.70 115.64 113.12 2k6w s THR 37 Ca -0.03 -0.65 0.27 0.00 -1.21 0.00 0.00 61.69 60.07 2k6w s THR 37 Cb -0.05 -0.25 0.28 0.00 -1.51 0.00 0.00 72.50 70.98 2k6w s THR 37 CO -0.02 -0.36 1.92 1.55 -2.21 0.00 0.00 174.62 175.51 2k6w h PRO 38 N 4.92 0.00 -0.07 7.08 0.13 -2.01 -3.32 132.00 138.74 2k6w h PRO 38 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2k6w h PRO 38 Cb 1.21 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.34 2k6w h PRO 38 CO 0.43 0.15 0.00 1.33 -0.23 0.00 0.00 178.00 179.68 2k6w n VAL 39 N -3.37 0.08 -4.06 1.56 0.24 -1.26 -4.71 118.33 106.81 2k6w n VAL 39 Ca -0.00 -0.12 -0.13 0.00 -2.04 0.00 0.00 64.34 62.05 2k6w n VAL 39 Cb 0.36 -0.04 -0.13 0.00 -1.47 0.00 0.00 33.84 32.56 2k6w n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k6w s ALA 40 N -1.92 0.40 0.11 2.33 0.00 -1.25 -0.58 121.76 120.85 2k6w s ALA 40 Ca 0.25 -0.50 -0.22 0.00 0.00 0.00 0.00 51.96 51.49 2k6w s ALA 40 Cb 0.12 0.01 -0.09 0.00 0.00 0.00 0.00 23.12 23.16 2k6w s ALA 40 CO 0.19 -0.00 1.71 1.49 0.00 0.00 0.00 175.76 179.15 2k6w h GLU 41 N 5.15 -0.07 -3.76 0.00 4.22 -0.06 -3.46 114.58 116.60 2k6w h GLU 41 Ca -0.32 0.00 -0.12 0.00 0.08 0.00 0.00 59.36 59.01 2k6w h GLU 41 Cb 1.20 0.01 -0.17 0.00 0.50 0.00 0.00 28.75 30.29 2k6w h GLU 41 CO 0.45 -0.04 -0.49 0.50 -2.18 0.00 0.00 179.01 177.24 2k6w s ARG 42 N -6.18 0.62 -0.05 1.92 3.52 -1.22 -5.03 118.95 112.53 2k6w s ARG 42 Ca -0.14 -0.75 0.01 0.00 -0.13 0.00 0.00 55.73 54.73 2k6w s ARG 42 Cb 0.08 0.25 0.02 0.00 -1.56 0.00 0.00 34.95 33.74 2k6w s ARG 42 CO 0.67 -0.16 -0.05 0.54 -0.81 0.00 0.00 175.30 175.49 2k6w s VAL 43 N -2.69 0.59 -0.09 7.11 0.11 -1.26 -1.72 120.40 122.45 2k6w s VAL 43 Ca -0.04 -0.14 0.01 0.00 -2.93 0.00 0.00 61.98 58.87 2k6w s VAL 43 Cb -0.01 -0.61 0.02 0.00 -1.53 0.00 0.00 36.38 34.25 2k6w s VAL 43 CO -0.05 0.24 -0.08 -1.61 -3.33 0.00 0.00 175.10 170.27 2k6w s GLU 44 N 0.97 1.45 -0.23 1.54 2.02 -0.92 -4.83 118.70 118.69 2k6w s GLU 44 Ca -0.10 -0.27 -0.29 0.00 0.02 0.00 0.00 54.97 54.33 2k6w s GLU 44 Cb -0.14 -1.40 0.01 0.00 0.10 0.00 0.00 34.13 32.70 2k6w s GLU 44 CO -0.00 -0.15 1.04 -1.17 0.02 0.00 0.00 175.26 175.00 2k6w s LEU 45 N 1.27 4.09 0.21 1.80 0.20 -1.26 -0.39 118.68 124.59 2k6w s LEU 45 Ca -0.04 1.35 0.07 0.00 0.69 0.00 0.00 54.13 56.21 2k6w s LEU 45 Cb -0.14 -3.53 -0.04 0.00 -0.43 0.00 0.00 46.19 42.05 2k6w s LEU 45 CO -0.03 -0.68 0.08 -1.00 -0.29 0.00 0.00 176.35 174.44 2k6w s HIS 46 N 3.21 2.95 0.43 5.38 3.76 0.27 -1.03 115.29 130.26 2k6w s HIS 46 Ca 0.44 -0.12 0.03 0.00 -0.15 0.00 0.00 55.06 55.26 2k6w s HIS 46 Cb -0.15 -1.38 0.03 0.00 1.11 0.00 0.00 32.58 32.20 2k6w s HIS 46 CO 0.06 0.54 0.28 -0.85 -0.85 0.00 0.00 174.74 173.93 2k6w n GLU 47 N -0.62 0.87 -4.14 1.40 0.28 -0.18 -1.14 120.64 117.11 2k6w n GLU 47 Ca -0.08 -2.73 -0.31 0.00 -0.16 0.00 0.00 57.16 53.88 2k6w n GLU 47 Cb 0.57 0.35 -0.16 0.00 1.43 0.00 0.00 31.44 33.62 2k6w n GLU 47 CO 0.00 0.00 0.00 0.99 -0.16 0.00 0.00 177.13 177.96 2k6w s THR 48 N -2.18 1.71 0.34 3.84 2.01 -0.90 -3.20 115.64 117.25 2k6w s THR 48 Ca 0.21 -0.73 0.07 0.00 0.31 0.00 0.00 61.69 61.55 2k6w s THR 48 Cb -0.02 -1.58 -0.01 0.00 0.01 0.00 0.00 72.50 70.91 2k6w s THR 48 CO 0.14 0.48 0.46 0.72 -0.69 0.00 0.00 174.62 175.73 2k6w s PHE 49 N 1.34 3.09 -0.04 4.92 -0.12 -0.11 -4.73 117.98 122.32 2k6w s PHE 49 Ca 0.03 -0.23 0.03 0.00 -0.05 0.00 0.00 56.93 56.71 2k6w s PHE 49 Cb -0.13 -2.00 0.00 0.00 -0.63 0.00 0.00 43.02 40.26 2k6w s PHE 49 CO -0.10 -0.02 -0.12 -1.64 -0.05 0.00 0.00 175.22 173.29 2k6w s MET 50 N -4.17 1.37 -0.08 1.99 -1.94 -1.26 -1.92 119.30 113.29 2k6w s MET 50 Ca 0.45 -0.43 -0.19 0.00 -1.71 0.00 0.00 55.69 53.82 2k6w s MET 50 Cb -0.09 -1.22 0.04 0.00 2.01 0.00 0.00 34.83 35.57 2k6w s MET 50 CO 0.31 0.15 0.44 0.50 -0.01 0.00 0.00 175.02 176.41 2k6w s ARG 51 N 0.21 0.70 0.20 2.03 3.00 -0.39 -4.95 118.95 119.75 2k6w s ARG 51 Ca -0.05 0.22 -0.30 0.00 -1.00 0.00 0.00 55.73 54.60 2k6w s ARG 51 Cb -0.11 0.32 -0.08 0.00 0.00 0.00 0.00 34.95 35.09 2k6w s ARG 51 CO 0.02 -0.17 1.11 -1.21 0.00 0.00 0.00 175.30 175.04 2k6w s GLU 52 N -0.70 4.60 0.00 5.12 8.01 -1.26 -0.55 118.70 133.93 2k6w s GLU 52 Ca -0.08 1.75 0.00 0.00 0.01 0.00 0.00 54.97 56.65 2k6w s GLU 52 Cb -0.03 -3.25 0.00 0.00 -4.31 0.00 0.00 34.13 26.53 2k6w s GLU 52 CO 0.04 0.10 0.00 0.28 0.01 0.00 0.00 175.26 175.69 2k6w n VAL 53 N 2.09 0.00 -2.11 2.63 0.31 -1.17 -4.91 118.33 115.17 2k6w n VAL 53 Ca 0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.93 2k6w n VAL 53 Cb 0.46 0.00 -0.00 0.00 -0.91 0.00 0.00 33.84 33.38 2k6w n VAL 53 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2k6w n GLU 54 N 0.00 2.93 0.00 5.55 0.00 -1.26 -4.67 120.64 123.18 2k6w n GLU 54 Ca 0.00 -2.88 0.00 0.00 0.00 0.00 0.00 57.16 54.28 2k6w n GLU 54 Cb 0.00 -3.39 0.00 0.00 0.00 0.00 0.00 31.44 28.05 2k6w n GLU 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2k6w n GLY 55 N 4.77 0.00 3.33 8.31 0.00 -1.26 -4.87 105.19 115.48 2k6w n GLY 55 Ca 0.50 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.29 2k6w n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6w s LYS 56 N 0.00 1.27 -0.69 1.61 1.02 -1.26 -4.99 119.74 116.69 2k6w s LYS 56 Ca 0.00 -1.35 -0.26 0.00 0.02 0.00 0.00 55.97 54.38 2k6w s LYS 56 Cb 0.00 -1.43 -0.02 0.00 -0.52 0.00 0.00 37.83 35.86 2k6w s LYS 56 CO 0.00 0.31 1.84 -1.59 -0.92 0.00 0.00 175.35 174.99 2k6w s LYS 57 N -2.52 2.65 0.06 1.68 -2.85 -1.26 -3.02 119.74 114.49 2k6w s LYS 57 Ca 0.14 0.34 -0.30 0.00 -1.00 0.00 0.00 55.97 55.15 2k6w s LYS 57 Cb -0.07 -4.54 -0.05 0.00 -2.06 0.00 0.00 37.83 31.11 2k6w s LYS 57 CO 0.06 -2.84 0.98 0.08 0.10 0.00 0.00 175.35 173.73 2k6w s VAL 58 N 9.06 4.64 0.12 1.79 1.01 0.29 -4.77 120.40 132.55 2k6w s VAL 58 Ca 0.66 2.05 -0.12 0.00 0.00 0.00 0.00 61.98 64.57 2k6w s VAL 58 Cb -0.11 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 31.89 2k6w s VAL 58 CO 0.15 0.25 0.49 0.00 0.00 0.00 0.00 175.10 175.99 2k6w s MET 59 N 0.44 3.89 0.22 2.72 0.23 -1.26 -1.26 119.30 124.27 2k6w s MET 59 Ca 0.49 0.36 -0.22 0.00 -1.03 0.00 0.00 55.69 55.29 2k6w s MET 59 Cb -0.23 -2.94 0.04 0.00 -1.53 0.00 0.00 34.83 30.17 2k6w s MET 59 CO 0.29 0.50 0.72 0.20 -2.03 0.00 0.00 175.02 174.71 2k6w s GLY 60 N -1.77 -0.27 0.14 3.16 0.00 -0.81 -5.01 107.32 102.77 2k6w s GLY 60 Ca 0.36 0.02 0.10 0.00 0.00 0.00 0.00 44.72 45.20 2k6w s GLY 60 CO 0.19 0.01 -0.22 1.06 0.00 0.00 0.00 173.10 174.13 2k6w s MET 61 N -3.76 1.59 -0.00 2.90 -1.94 -1.26 -0.94 119.30 115.90 2k6w s MET 61 Ca 0.08 -1.31 -0.28 0.00 -1.71 0.00 0.00 55.69 52.48 2k6w s MET 61 Cb -0.04 -1.99 0.09 0.00 2.01 0.00 0.00 34.83 34.91 2k6w s MET 61 CO 0.00 0.45 0.78 1.03 -0.01 0.00 0.00 175.02 177.27 2k6w s ARG 62 N -2.22 0.96 0.43 2.03 0.52 -1.20 -4.99 118.95 114.49 2k6w s ARG 62 Ca 0.17 -0.12 -0.25 0.00 -0.52 0.00 0.00 55.73 55.00 2k6w s ARG 62 Cb -0.10 0.45 -0.08 0.00 0.52 0.00 0.00 34.95 35.74 2k6w s ARG 62 CO 0.09 -0.37 1.31 -1.25 0.02 0.00 0.00 175.30 175.09 2k6w s PRO 63 N -2.44 3.83 0.21 3.54 0.04 -1.26 -1.01 135.00 137.91 2k6w s PRO 63 Ca -0.01 2.16 0.11 0.00 0.04 0.00 0.00 61.00 63.30 2k6w s PRO 63 Cb -0.01 -2.66 -0.05 0.00 0.04 0.00 0.00 34.50 31.83 2k6w s PRO 63 CO -0.03 -0.61 -0.22 0.14 0.04 0.00 0.00 177.00 176.32 2k6w s VAL 64 N -1.28 2.45 0.22 -0.36 -7.23 -0.20 -4.87 120.40 109.13 2k6w s VAL 64 Ca 0.59 -2.07 0.26 0.00 -1.81 0.00 0.00 61.98 58.95 2k6w s VAL 64 Cb -0.38 -2.20 0.26 0.00 0.56 0.00 0.00 36.38 34.62 2k6w s VAL 64 CO 0.48 -0.17 1.91 1.55 -0.31 0.00 0.00 175.10 178.57 2k6w h PRO 65 N 3.00 0.00 -1.63 4.82 0.13 -1.96 -3.44 132.00 132.92 2k6w h PRO 65 Ca -0.45 0.00 0.29 0.00 -0.87 0.00 0.00 66.00 64.97 2k6w h PRO 65 Cb 1.22 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.23 2k6w h PRO 65 CO 0.51 0.18 0.76 -0.59 -0.23 0.00 0.00 178.00 178.62 2k6w s PHE 66 N -3.81 -0.07 0.46 1.56 -0.12 -1.26 -4.75 117.98 109.99 2k6w s PHE 66 Ca -0.00 -0.06 0.04 0.00 -0.05 0.00 0.00 56.93 56.85 2k6w s PHE 66 Cb 0.11 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 43.02 2k6w s PHE 66 CO 0.61 -0.38 0.01 -0.51 -0.05 0.00 0.00 175.22 174.91 2k6w s LEU 67 N -2.89 2.58 0.20 -1.99 1.43 0.23 -4.98 118.68 113.25 2k6w s LEU 67 Ca 0.13 -1.51 -0.05 0.00 -1.03 0.00 0.00 54.13 51.67 2k6w s LEU 67 Cb 0.03 -0.83 -0.03 0.00 0.03 0.00 0.00 46.19 45.40 2k6w s LEU 67 CO -0.03 -0.67 0.24 -1.83 0.23 0.00 0.00 176.35 174.29 2k6w s GLU 68 N -3.81 1.25 -0.12 1.70 -1.05 -1.26 -0.32 118.70 115.09 2k6w s GLU 68 Ca 0.20 -1.43 -0.06 0.00 -0.15 0.00 0.00 54.97 53.53 2k6w s GLU 68 Cb 0.05 0.34 0.05 0.00 -0.44 0.00 0.00 34.13 34.13 2k6w s GLU 68 CO 0.10 -0.44 0.27 0.08 0.95 0.00 0.00 175.26 176.22 2k6w s VAL 69 N -4.08 -0.05 0.78 1.83 1.01 0.02 -4.92 120.40 114.99 2k6w s VAL 69 Ca 0.29 0.14 -0.11 0.00 0.00 0.00 0.00 61.98 62.30 2k6w s VAL 69 Cb 0.04 -0.42 0.06 0.00 0.00 0.00 0.00 36.38 36.07 2k6w s VAL 69 CO 0.08 0.06 1.09 -2.16 0.00 0.00 0.00 175.10 174.17 2k6w s PRO 70 N 1.33 2.19 0.35 2.72 0.04 -1.26 -0.66 135.00 139.71 2k6w s PRO 70 Ca -0.09 0.73 -0.29 0.00 0.04 0.00 0.00 61.00 61.40 2k6w s PRO 70 Cb -0.10 -1.92 -0.11 0.00 0.04 0.00 0.00 34.50 32.41 2k6w s PRO 70 CO -0.09 -1.57 1.42 -1.25 0.04 0.00 0.00 177.00 175.55 2k6w s PRO 71 N -5.11 4.21 -1.63 0.56 0.04 -1.26 -2.33 135.00 129.49 2k6w s PRO 71 Ca 0.60 2.42 0.00 0.00 0.04 0.00 0.00 61.00 64.07 2k6w s PRO 71 Cb -0.15 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.37 2k6w s PRO 71 CO 0.55 -0.40 0.00 1.63 0.04 0.00 0.00 177.00 178.81 2k6w n LYS 72 N 0.82 -1.54 -3.33 4.56 4.01 -0.70 -4.96 118.16 117.01 2k6w n LYS 72 Ca 0.01 1.00 -0.40 0.00 -0.51 0.00 0.00 58.31 58.41 2k6w n LYS 72 Cb 0.40 -5.35 -0.09 0.00 -0.51 0.00 0.00 35.03 29.49 2k6w n LYS 72 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2k6w s GLY 73 N -2.47 1.86 -0.09 0.72 0.00 -0.98 -4.91 107.32 101.45 2k6w s GLY 73 Ca 0.00 -0.99 -0.19 0.00 0.00 0.00 0.00 44.72 43.54 2k6w s GLY 73 CO 0.00 1.10 0.54 -1.60 0.00 0.00 0.00 173.10 173.14 2k6w s ARG 74 N 2.18 4.34 0.41 2.90 3.52 -1.26 -1.29 118.95 129.75 2k6w s ARG 74 Ca 0.16 0.58 0.06 0.00 -0.13 0.00 0.00 55.73 56.39 2k6w s ARG 74 Cb -0.16 -3.42 -0.07 0.00 -1.56 0.00 0.00 34.95 29.74 2k6w s ARG 74 CO 0.12 0.18 0.02 0.14 -0.81 0.00 0.00 175.30 174.95 2k6w s VAL 75 N 0.50 1.74 -0.14 7.11 -7.23 0.32 -4.96 120.40 117.75 2k6w s VAL 75 Ca 0.29 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.40 2k6w s VAL 75 Cb -0.16 -2.84 0.06 0.00 0.56 0.00 0.00 36.38 34.00 2k6w s VAL 75 CO 0.13 0.00 0.30 -0.70 -0.31 0.00 0.00 175.10 174.52 2k6w s GLU 76 N -3.76 0.24 0.45 4.82 2.12 -1.26 -1.62 118.70 119.69 2k6w s GLU 76 Ca 0.31 0.71 -0.15 0.00 0.36 0.00 0.00 54.97 56.20 2k6w s GLU 76 Cb 0.09 -0.02 -0.08 0.00 0.26 0.00 0.00 34.13 34.38 2k6w s GLU 76 CO 0.16 -0.21 0.89 -0.51 -0.54 0.00 0.00 175.26 175.04 2k6w s LEU 77 N 1.83 3.77 -0.19 2.70 1.02 -0.04 -4.84 118.68 122.92 2k6w s LEU 77 Ca -0.05 1.42 -0.30 0.00 0.02 0.00 0.00 54.13 55.22 2k6w s LEU 77 Cb -0.11 -4.31 0.14 0.00 0.02 0.00 0.00 46.19 41.93 2k6w s LEU 77 CO -0.10 -0.47 1.07 -1.59 0.02 0.00 0.00 176.35 175.28 2k6w s LYS 78 N -3.80 0.49 -0.01 1.70 -2.85 0.23 -4.46 119.74 111.04 2k6w s LYS 78 Ca 0.56 0.15 -0.25 0.00 -1.00 0.00 0.00 55.97 55.43 2k6w s LYS 78 Cb -0.10 0.23 -0.19 0.00 -2.06 0.00 0.00 37.83 35.71 2k6w s LYS 78 CO 0.28 -0.15 1.29 -1.00 0.10 0.00 0.00 175.35 175.87 2k6w h PRO 79 N 2.58 0.05 -6.06 1.78 0.13 -1.98 -2.59 132.00 125.92 2k6w h PRO 79 Ca -0.17 -0.03 -0.49 0.00 -0.87 0.00 0.00 66.00 64.44 2k6w h PRO 79 Cb 1.17 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.24 2k6w h PRO 79 CO 0.28 0.51 1.17 0.20 -0.23 0.00 0.00 178.00 179.94 2k6w s GLY 80 N -3.19 0.56 0.00 1.56 0.00 -1.26 -4.62 107.32 100.37 2k6w s GLY 80 Ca -0.16 -1.29 0.00 0.00 0.00 0.00 0.00 44.72 43.28 2k6w s GLY 80 CO 0.69 3.10 0.00 0.61 0.00 0.00 0.00 173.10 177.49 2k6w n GLY 81 N 6.03 0.49 3.83 0.20 0.00 -1.21 -5.01 105.19 109.52 2k6w n GLY 81 Ca 0.21 -2.14 -0.38 0.00 0.00 0.00 0.00 46.02 43.72 2k6w n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k6w s TYR 82 N -0.47 3.75 0.02 1.61 1.51 -0.98 -2.12 117.35 120.67 2k6w s TYR 82 Ca 0.00 1.06 -0.28 0.00 -1.01 0.00 0.00 57.07 56.84 2k6w s TYR 82 Cb 0.00 -2.33 0.08 0.00 -0.11 0.00 0.00 41.96 39.59 2k6w s TYR 82 CO 0.00 0.63 0.69 -3.38 -1.11 0.00 0.00 175.55 172.39 2k6w s HIS 83 N -1.09 -0.57 -0.26 2.71 -3.43 -0.29 -0.61 115.29 111.75 2k6w s HIS 83 Ca 0.25 0.75 -0.16 0.00 -0.80 0.00 0.00 55.06 55.10 2k6w s HIS 83 Cb -0.17 0.47 -0.03 0.00 -1.43 0.00 0.00 32.58 31.42 2k6w s HIS 83 CO 0.15 -0.67 0.42 -0.06 -2.00 0.00 0.00 174.74 172.58 2k6w s PHE 84 N -2.20 3.26 0.13 0.38 0.08 -0.59 -0.57 117.98 118.47 2k6w s PHE 84 Ca -0.05 0.49 -0.31 0.00 0.12 0.00 0.00 56.93 57.18 2k6w s PHE 84 Cb -0.00 -2.61 -0.08 0.00 -0.57 0.00 0.00 43.02 39.75 2k6w s PHE 84 CO 0.00 -0.23 1.39 -1.64 -0.10 0.00 0.00 175.22 174.65 2k6w s MET 85 N 2.09 4.32 -0.26 0.44 -1.94 0.47 -0.56 119.30 123.85 2k6w s MET 85 Ca 0.17 2.10 -0.08 0.00 -1.71 0.00 0.00 55.69 56.17 2k6w s MET 85 Cb -0.16 -3.23 -0.02 0.00 2.01 0.00 0.00 34.83 33.43 2k6w s MET 85 CO 0.10 -0.43 0.08 -0.51 -0.01 0.00 0.00 175.02 174.25 2k6w s LEU 86 N 0.96 3.57 0.13 -0.03 1.43 -0.29 -2.17 118.68 122.28 2k6w s LEU 86 Ca 0.64 -0.29 0.05 0.00 -1.03 0.00 0.00 54.13 53.50 2k6w s LEU 86 Cb -0.37 -1.93 -0.04 0.00 0.03 0.00 0.00 46.19 43.88 2k6w s LEU 86 CO 0.31 -0.07 0.07 -0.76 0.23 0.00 0.00 176.35 176.13 2k6w s LEU 87 N 1.61 3.64 -0.85 1.79 2.01 -0.70 -1.20 118.68 124.98 2k6w s LEU 87 Ca 0.06 -0.15 -0.04 0.00 0.01 0.00 0.00 54.13 54.00 2k6w s LEU 87 Cb -0.16 -2.30 -0.01 0.00 0.01 0.00 0.00 46.19 43.73 2k6w s LEU 87 CO 0.04 0.12 0.70 0.61 1.01 0.00 0.00 176.35 178.84 2k6w n GLY 88 N 0.12 -1.22 3.61 -3.19 0.00 -0.89 -0.61 105.19 103.02 2k6w n GLY 88 Ca -0.09 0.51 -0.43 0.00 0.00 0.00 0.00 46.02 46.01 2k6w n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2k6w s LEU 89 N -4.79 3.58 0.27 0.99 1.43 -1.26 -1.81 118.68 117.09 2k6w s LEU 89 Ca 0.11 1.63 0.15 0.00 -1.03 0.00 0.00 54.13 55.00 2k6w s LEU 89 Cb -0.03 -3.52 0.05 0.00 0.03 0.00 0.00 46.19 42.71 2k6w s LEU 89 CO 0.81 -1.71 1.42 0.11 0.23 0.00 0.00 176.35 177.21 2k6w h LYS 90 N 13.28 0.00 -5.25 1.70 1.57 -1.13 -3.36 116.57 123.39 2k6w h LYS 90 Ca -0.37 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 57.73 2k6w h LYS 90 Cb 1.20 0.00 -0.33 0.00 0.08 0.00 0.00 32.23 33.17 2k6w h LYS 90 CO 1.00 0.51 -0.87 1.03 -0.57 0.00 0.00 179.45 180.55 2k6w s ARG 91 N -2.95 3.04 0.29 3.15 1.81 -1.21 -4.97 118.95 118.11 2k6w s ARG 91 Ca 0.04 -0.86 -0.29 0.00 -1.72 0.00 0.00 55.73 52.90 2k6w s ARG 91 Cb 0.08 -2.40 -0.10 0.00 -0.45 0.00 0.00 34.95 32.07 2k6w s ARG 91 CO 0.75 0.05 1.44 -1.25 -0.68 0.00 0.00 175.30 175.61 2k6w s PRO 92 N 0.66 4.24 -1.24 3.54 0.04 -1.26 -4.88 135.00 136.10 2k6w s PRO 92 Ca -0.11 2.36 -0.11 0.00 0.04 0.00 0.00 61.00 63.18 2k6w s PRO 92 Cb -0.16 -3.07 -0.06 0.00 0.04 0.00 0.00 34.50 31.24 2k6w s PRO 92 CO 0.02 -0.41 2.41 1.28 0.04 0.00 0.00 177.00 180.33 2k6w n LEU 93 N 1.69 6.51 -4.68 -3.56 7.99 -1.26 -4.94 117.00 118.75 2k6w n LEU 93 Ca 0.05 -3.63 -0.52 0.00 -0.01 0.00 0.00 56.01 51.90 2k6w n LEU 93 Cb 0.40 -1.36 -0.06 0.00 -0.11 0.00 0.00 43.42 42.30 2k6w n LEU 93 CO 0.61 1.09 1.34 1.17 -1.51 0.00 0.00 177.39 180.09 2k6w n LYS 94 N 4.68 1.66 -1.72 3.23 0.00 -1.26 -3.98 118.16 120.77 2k6w n LYS 94 Ca 0.59 0.61 -0.64 0.00 0.00 0.00 0.00 58.31 58.87 2k6w n LYS 94 Cb 0.25 -2.36 -0.09 0.00 0.00 0.00 0.00 35.03 32.83 2k6w n LYS 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k6w n ALA 95 N 5.45 -1.05 -2.82 3.14 0.00 -1.26 -0.57 120.51 123.39 2k6w n ALA 95 Ca 0.23 0.47 -0.08 0.00 0.00 0.00 0.00 53.44 54.06 2k6w n ALA 95 Cb 0.22 -2.02 0.03 0.00 0.00 0.00 0.00 19.45 17.67 2k6w n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6w n GLY 96 N 3.92 0.36 3.81 0.00 0.00 -0.12 -4.99 105.19 108.18 2k6w n GLY 96 Ca 0.29 -0.33 -0.29 0.00 0.00 0.00 0.00 46.02 45.69 2k6w n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k6w s GLU 97 N -5.27 1.03 0.09 1.61 0.41 0.26 -4.87 118.70 111.96 2k6w s GLU 97 Ca 0.17 0.14 0.03 0.00 -0.41 0.00 0.00 54.97 54.90 2k6w s GLU 97 Cb -0.07 -1.84 -0.04 0.00 -1.78 0.00 0.00 34.13 30.40 2k6w s GLU 97 CO 0.26 -2.24 0.08 -1.21 -0.49 0.00 0.00 175.26 171.66 2k6w s GLU 98 N -5.43 2.87 -0.11 1.61 2.02 -1.26 -0.54 118.70 117.87 2k6w s GLU 98 Ca 0.65 -0.72 -0.01 0.00 0.02 0.00 0.00 54.97 54.92 2k6w s GLU 98 Cb -0.12 -2.71 0.03 0.00 0.10 0.00 0.00 34.13 31.43 2k6w s GLU 98 CO 0.53 0.56 -0.04 0.08 0.02 0.00 0.00 175.26 176.40 2k6w s VAL 99 N -1.43 0.77 0.22 2.63 1.01 0.83 -4.89 120.40 119.53 2k6w s VAL 99 Ca 0.29 -0.17 -0.30 0.00 0.00 0.00 0.00 61.98 61.80 2k6w s VAL 99 Cb -0.12 -0.87 -0.08 0.00 0.00 0.00 0.00 36.38 35.30 2k6w s VAL 99 CO 0.22 0.29 1.08 -1.61 0.00 0.00 0.00 175.10 175.07 2k6w s GLU 100 N 1.81 4.65 -0.22 2.72 0.41 -1.26 -1.60 118.70 125.20 2k6w s GLU 100 Ca 0.04 1.71 -0.15 0.00 -0.41 0.00 0.00 54.97 56.16 2k6w s GLU 100 Cb -0.13 -3.25 0.07 0.00 -1.78 0.00 0.00 34.13 29.04 2k6w s GLU 100 CO -0.07 0.18 0.56 -0.51 -0.49 0.00 0.00 175.26 174.93 2k6w s LEU 101 N -0.82 -0.42 -0.37 1.80 1.43 -0.57 -4.13 118.68 115.60 2k6w s LEU 101 Ca 0.47 1.20 -0.01 0.00 -1.03 0.00 0.00 54.13 54.76 2k6w s LEU 101 Cb -0.30 1.92 0.10 0.00 0.03 0.00 0.00 46.19 47.94 2k6w s LEU 101 CO 0.36 -0.21 0.13 -1.81 0.23 0.00 0.00 176.35 175.05 2k6w s ASP 102 N 1.10 5.06 -0.22 2.29 1.01 0.12 -0.24 116.67 125.78 2k6w s ASP 102 Ca -0.06 -1.94 -0.29 0.00 0.71 0.00 0.00 52.55 50.97 2k6w s ASP 102 Cb -0.06 -1.75 0.01 0.00 1.01 0.00 0.00 42.92 42.12 2k6w s ASP 102 CO -0.11 -0.45 1.08 -0.76 0.21 0.00 0.00 175.17 175.14 2k6w s LEU 103 N 1.09 4.11 -0.22 1.23 1.43 0.06 -1.12 118.68 125.26 2k6w s LEU 103 Ca 0.07 1.42 -0.17 0.00 -1.03 0.00 0.00 54.13 54.42 2k6w s LEU 103 Cb -0.21 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.43 2k6w s LEU 103 CO -0.05 -0.69 0.44 -0.76 0.23 0.00 0.00 176.35 175.52 2k6w s LEU 104 N 3.27 4.11 -0.07 1.79 1.43 0.06 -1.42 118.68 127.84 2k6w s LEU 104 Ca 0.46 0.52 0.03 0.00 -1.03 0.00 0.00 54.13 54.11 2k6w s LEU 104 Cb -0.16 -2.57 -0.02 0.00 0.03 0.00 0.00 46.19 43.47 2k6w s LEU 104 CO 0.08 -0.16 -0.18 -0.36 0.23 0.00 0.00 176.35 175.96 2k6w s PHE 105 N 1.69 2.64 -1.45 0.29 0.08 -0.35 -0.46 117.98 120.43 2k6w s PHE 105 Ca 0.20 -0.49 -0.11 0.00 0.12 0.00 0.00 56.93 56.65 2k6w s PHE 105 Cb -0.15 -1.68 -0.05 0.00 -0.57 0.00 0.00 43.02 40.57 2k6w s PHE 105 CO 0.09 -0.06 2.59 0.00 -0.10 0.00 0.00 175.22 177.73 2k6w n ALA 106 N 2.86 6.40 -1.91 5.36 0.00 0.04 -3.58 120.51 129.69 2k6w n ALA 106 Ca -0.17 -3.45 -0.01 0.00 0.00 0.00 0.00 53.44 49.80 2k6w n ALA 106 Cb 0.52 -3.40 -0.00 0.00 0.00 0.00 0.00 19.45 16.57 2k6w n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6w n GLY 107 N 3.81 -0.28 3.07 0.00 0.00 -1.26 -4.89 105.19 105.64 2k6w n GLY 107 Ca 0.65 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 46.66 2k6w n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6w n GLY 108 N -0.11 0.95 3.91 -0.02 0.00 -1.24 -5.02 105.19 103.67 2k6w n GLY 108 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 2k6w n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6w s LYS 109 N -0.07 3.52 0.06 1.61 -0.14 -1.23 -5.05 119.74 118.44 2k6w s LYS 109 Ca 0.00 -0.31 0.03 0.00 -1.36 0.00 0.00 55.97 54.33 2k6w s LYS 109 Cb 0.00 -2.93 -0.03 0.00 -1.68 0.00 0.00 37.83 33.19 2k6w s LYS 109 CO 0.00 0.52 -0.10 0.54 -0.76 0.00 0.00 175.35 175.55 2k6w s VAL 110 N -1.64 0.77 -0.17 3.17 0.11 -1.26 -1.21 120.40 120.17 2k6w s VAL 110 Ca 0.38 -1.28 0.01 0.00 -2.93 0.00 0.00 61.98 58.16 2k6w s VAL 110 Cb -0.12 -0.91 0.02 0.00 -1.53 0.00 0.00 36.38 33.84 2k6w s VAL 110 CO 0.27 -0.39 -0.17 -0.76 -3.33 0.00 0.00 175.10 170.71 2k6w s LEU 111 N -1.84 1.97 0.15 2.54 1.43 -0.51 -4.96 118.68 117.45 2k6w s LEU 111 Ca -0.04 -0.60 -0.30 0.00 -1.03 0.00 0.00 54.13 52.16 2k6w s LEU 111 Cb -0.08 -1.35 -0.07 0.00 0.03 0.00 0.00 46.19 44.72 2k6w s LEU 111 CO 0.01 -0.03 1.16 -0.75 0.23 0.00 0.00 176.35 176.96 2k6w s LYS 112 N 1.37 4.52 0.01 1.70 2.20 -1.26 -0.76 119.74 127.52 2k6w s LYS 112 Ca 0.05 1.78 0.00 0.00 -0.36 0.00 0.00 55.97 57.44 2k6w s LYS 112 Cb -0.13 -3.29 -0.01 0.00 -1.51 0.00 0.00 37.83 32.89 2k6w s LYS 112 CO -0.12 -0.07 -0.03 0.14 -0.36 0.00 0.00 175.35 174.92 2k6w s VAL 113 N 0.19 0.14 -0.11 4.02 -7.23 0.66 -4.97 120.40 113.10 2k6w s VAL 113 Ca 0.53 -0.52 0.02 0.00 -1.81 0.00 0.00 61.98 60.20 2k6w s VAL 113 Cb -0.30 -0.21 0.01 0.00 0.56 0.00 0.00 36.38 36.44 2k6w s VAL 113 CO 0.34 -0.24 -0.15 0.54 -0.31 0.00 0.00 175.10 175.27 2k6w s VAL 114 N -0.78 1.52 0.21 1.32 0.11 -1.26 -1.51 120.40 120.01 2k6w s VAL 114 Ca -0.08 -0.65 0.11 0.00 -2.93 0.00 0.00 61.98 58.43 2k6w s VAL 114 Cb -0.05 -1.39 -0.05 0.00 -1.53 0.00 0.00 36.38 33.36 2k6w s VAL 114 CO -0.00 0.45 -0.22 -0.76 -3.33 0.00 0.00 175.10 171.23 2k6w s LEU 115 N 1.00 2.48 0.78 2.54 2.01 -0.63 -4.97 118.68 121.90 2k6w s LEU 115 Ca -0.06 -0.91 -0.11 0.00 0.01 0.00 0.00 54.13 53.05 2k6w s LEU 115 Cb -0.15 -1.12 0.06 0.00 0.01 0.00 0.00 46.19 44.99 2k6w s LEU 115 CO -0.02 0.08 1.10 -2.16 1.01 0.00 0.00 176.35 176.36 2k6w s PRO 116 N -2.92 2.22 -0.03 1.29 0.04 -1.26 -0.12 135.00 134.21 2k6w s PRO 116 Ca 0.23 0.64 -0.08 0.00 0.04 0.00 0.00 61.00 61.82 2k6w s PRO 116 Cb -0.07 -1.93 -0.05 0.00 0.04 0.00 0.00 34.50 32.49 2k6w s PRO 116 CO 0.11 -1.53 0.26 0.08 0.04 0.00 0.00 177.00 175.96 2k6w s VAL 117 N -3.17 5.31 0.11 -0.36 1.01 0.30 -0.84 120.40 122.76 2k6w s VAL 117 Ca 0.60 0.33 -0.07 0.00 0.00 0.00 0.00 61.98 62.84 2k6w s VAL 117 Cb -0.14 -3.54 -0.01 0.00 0.00 0.00 0.00 36.38 32.68 2k6w s VAL 117 CO 0.54 0.49 0.18 -1.61 0.00 0.00 0.00 175.10 174.70 2k6w s GLU 118 N -1.38 0.92 -1.40 2.72 2.02 0.23 -0.94 118.70 120.87 2k6w s GLU 118 Ca 0.23 -1.10 -0.11 0.00 0.02 0.00 0.00 54.97 54.01 2k6w s GLU 118 Cb -0.14 0.33 -0.06 0.00 0.10 0.00 0.00 34.13 34.36 2k6w s GLU 118 CO 0.12 -0.29 2.58 0.00 0.02 0.00 0.00 175.26 177.69 2k6w n ALA 119 N -0.09 6.33 0.57 5.21 0.00 -1.26 -0.42 120.51 130.86 2k6w n ALA 119 Ca -0.12 -3.27 0.07 0.00 0.00 0.00 0.00 53.44 50.12 2k6w n ALA 119 Cb 0.63 -3.35 0.06 0.00 0.00 0.00 0.00 19.45 16.78 2k6w n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04