#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 -1.20 -3.16 1.61 7.64 -1.26 -5.04 113.62 112.21 2k6w n SER 2 Ca 0.00 -2.04 -0.28 0.00 1.01 0.00 0.00 58.87 57.56 2k6w n SER 2 Cb 0.00 2.06 -0.03 0.00 -1.01 0.00 0.00 64.21 65.24 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 -0.34 1.69 0.00 1.43 3.72 -1.26 -4.63 117.46 118.07 2k6w n PHE 3 Ca -0.03 -2.35 0.00 0.00 -0.05 0.00 0.00 57.45 55.02 2k6w n PHE 3 Cb 0.36 -1.97 0.00 0.00 -0.94 0.00 0.00 39.48 36.93 2k6w n PHE 3 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 176.76 179.12 2k6w n THR 4 N 3.86 -0.35 -3.07 4.37 -1.04 -1.26 -4.88 114.28 111.90 2k6w n THR 4 Ca 0.57 0.00 -0.44 0.00 -2.04 0.00 0.00 64.05 62.14 2k6w n THR 4 Cb 0.20 0.00 -0.05 0.00 -1.82 0.00 0.00 70.33 68.66 2k6w n THR 4 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 2k6w s GLU 5 N -4.91 3.14 0.06 -2.82 0.41 -1.26 -4.95 118.70 108.38 2k6w s GLU 5 Ca 0.00 -0.85 -0.27 0.00 -0.41 0.00 0.00 54.97 53.44 2k6w s GLU 5 Cb 0.00 -4.13 0.09 0.00 -1.78 0.00 0.00 34.13 28.32 2k6w s GLU 5 CO 0.00 -1.37 1.15 0.20 -0.49 0.00 0.00 175.26 174.75 2k6w s GLY 6 N 2.95 -0.27 -0.02 -1.39 0.00 -1.26 -0.98 107.32 106.34 2k6w s GLY 6 Ca 0.18 0.34 -0.20 0.00 0.00 0.00 0.00 44.72 45.03 2k6w s GLY 6 CO 0.12 0.75 0.43 0.66 0.00 0.00 0.00 173.10 175.06 2k6w s TRP 7 N -2.66 -0.34 -0.09 1.90 -2.14 0.19 -4.18 118.94 111.63 2k6w s TRP 7 Ca 0.16 0.53 0.02 0.00 2.66 0.00 0.00 56.10 59.46 2k6w s TRP 7 Cb 0.02 0.21 -0.02 0.00 -3.10 0.00 0.00 33.47 30.57 2k6w s TRP 7 CO -0.01 -0.48 -0.14 0.08 -2.66 0.00 0.00 176.95 173.75 2k6w s VAL 8 N -1.40 3.01 -0.00 -0.66 1.01 -0.12 -1.28 120.40 120.95 2k6w s VAL 8 Ca -0.12 -0.71 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 2k6w s VAL 8 Cb -0.03 -2.21 -0.05 0.00 0.00 0.00 0.00 36.38 34.09 2k6w s VAL 8 CO 0.05 0.56 1.25 -0.60 0.00 0.00 0.00 175.10 176.37 2k6w s ARG 9 N -0.18 4.36 0.03 2.72 3.52 0.28 -0.94 118.95 128.73 2k6w s ARG 9 Ca -0.00 1.78 -0.30 0.00 -0.13 0.00 0.00 55.73 57.08 2k6w s ARG 9 Cb -0.13 -3.49 -0.05 0.00 -1.56 0.00 0.00 34.95 29.71 2k6w s ARG 9 CO 0.03 -0.42 1.19 0.12 -0.81 0.00 0.00 175.30 175.41 2k6w s PHE 10 N 1.90 3.37 -0.26 5.12 5.36 -0.06 -4.54 117.98 128.88 2k6w s PHE 10 Ca 0.59 1.29 -0.23 0.00 -0.96 0.00 0.00 56.93 57.62 2k6w s PHE 10 Cb -0.28 -3.41 0.07 0.00 -0.34 0.00 0.00 43.02 39.06 2k6w s PHE 10 CO 0.25 -1.26 0.69 -1.12 -1.46 0.00 0.00 175.22 172.33 2k6w s SER 11 N 1.18 -0.76 -1.35 6.13 0.01 -1.26 -4.65 113.70 112.99 2k6w s SER 11 Ca 0.58 1.42 -0.14 0.00 1.31 0.00 0.00 55.95 59.12 2k6w s SER 11 Cb -0.28 1.41 0.09 0.00 0.21 0.00 0.00 66.02 67.45 2k6w s SER 11 CO 0.27 -0.24 1.95 -0.81 0.41 0.00 0.00 173.24 174.82 2k6w n PRO 12 N 3.00 3.17 -4.14 12.44 -0.04 -1.26 -4.53 135.00 143.64 2k6w n PRO 12 Ca -0.15 -3.11 -0.15 0.00 -0.04 0.00 0.00 63.50 60.05 2k6w n PRO 12 Cb 0.56 -3.22 -0.06 0.00 -0.04 0.00 0.00 33.50 30.74 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 2.80 1.60 0.00 0.55 0.00 -1.26 -5.04 107.32 105.96 2k6w s GLY 13 Ca 0.46 -1.61 0.25 0.00 0.00 0.00 0.00 44.72 43.82 2k6w s GLY 13 CO -0.02 -1.12 1.84 -1.55 0.00 0.00 0.00 173.10 172.25 2k6w n PRO 14 N -0.53 0.44 -4.12 2.90 -0.04 -1.26 -4.80 135.00 127.58 2k6w n PRO 14 Ca 0.02 0.04 -0.09 0.00 -0.04 0.00 0.00 63.50 63.43 2k6w n PRO 14 Cb 0.62 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.49 2k6w n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k6w s ASN 15 N -2.46 0.32 0.18 3.54 2.20 -1.26 -1.80 114.94 115.66 2k6w s ASN 15 Ca 0.26 -1.14 -0.12 0.00 -0.94 0.00 0.00 52.86 50.93 2k6w s ASN 15 Cb 0.17 0.29 0.00 0.00 -2.00 0.00 0.00 41.25 39.71 2k6w s ASN 15 CO 0.36 -0.72 0.37 0.00 -2.94 0.00 0.00 177.10 174.18 2k6w s ALA 16 N -4.02 -0.31 0.17 3.54 0.00 -0.47 -4.82 121.76 115.85 2k6w s ALA 16 Ca 0.20 -0.67 0.06 0.00 0.00 0.00 0.00 51.96 51.55 2k6w s ALA 16 Cb 0.07 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 24.02 2k6w s ALA 16 CO -0.01 -0.71 0.08 0.00 0.00 0.00 0.00 175.76 175.13 2k6w s ALA 17 N -3.94 3.42 -0.04 0.00 0.00 -1.26 -0.67 121.76 119.27 2k6w s ALA 17 Ca 0.15 -1.27 0.07 0.00 0.00 0.00 0.00 51.96 50.90 2k6w s ALA 17 Cb 0.02 -1.22 -0.01 0.00 0.00 0.00 0.00 23.12 21.91 2k6w s ALA 17 CO -0.01 0.50 -0.25 0.00 0.00 0.00 0.00 175.76 176.00 2k6w s ALA 18 N -1.74 2.15 -0.05 0.00 0.00 -0.48 -0.56 121.76 121.08 2k6w s ALA 18 Ca 0.30 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.20 2k6w s ALA 18 Cb -0.10 -0.63 0.02 0.00 0.00 0.00 0.00 23.12 22.42 2k6w s ALA 18 CO 0.21 0.45 -0.06 0.71 0.00 0.00 0.00 175.76 177.08 2k6w s TYR 19 N -0.31 0.91 0.01 0.00 2.02 -0.41 -2.12 117.35 117.45 2k6w s TYR 19 Ca 0.01 -0.29 -0.28 0.00 -0.37 0.00 0.00 57.07 56.14 2k6w s TYR 19 Cb -0.12 -0.77 0.10 0.00 -0.40 0.00 0.00 41.96 40.76 2k6w s TYR 19 CO 0.02 -0.23 0.85 -0.48 -1.57 0.00 0.00 175.55 174.14 2k6w s LEU 20 N 0.96 -0.40 0.25 -1.29 0.05 -0.49 -0.63 118.68 117.12 2k6w s LEU 20 Ca -0.10 0.04 -0.29 0.00 0.05 0.00 0.00 54.13 53.83 2k6w s LEU 20 Cb -0.14 2.11 -0.09 0.00 -2.05 0.00 0.00 46.19 46.02 2k6w s LEU 20 CO 0.00 -0.65 0.93 -0.89 -0.55 0.00 0.00 176.35 175.18 2k6w s THR 21 N -3.05 4.12 -0.06 5.48 2.01 -0.15 -0.13 115.64 123.85 2k6w s THR 21 Ca 0.04 2.02 0.00 0.00 0.31 0.00 0.00 61.69 64.06 2k6w s THR 21 Cb -0.01 -4.27 0.02 0.00 0.01 0.00 0.00 72.50 68.26 2k6w s THR 21 CO -0.09 0.45 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.02 2k6w s LEU 22 N -1.31 1.18 -0.04 4.42 1.98 -0.28 -4.87 118.68 119.76 2k6w s LEU 22 Ca 0.42 -0.16 -0.18 0.00 -2.89 0.00 0.00 54.13 51.32 2k6w s LEU 22 Cb -0.25 -0.55 0.03 0.00 0.66 0.00 0.00 46.19 46.09 2k6w s LEU 22 CO 0.30 -0.08 0.40 -1.83 -1.89 0.00 0.00 176.35 173.25 2k6w s GLU 23 N 1.24 0.72 -0.34 1.98 -1.05 -1.26 -0.31 118.70 119.67 2k6w s GLU 23 Ca -0.06 0.02 -0.06 0.00 -0.15 0.00 0.00 54.97 54.72 2k6w s GLU 23 Cb -0.14 0.33 0.04 0.00 -0.44 0.00 0.00 34.13 33.92 2k6w s GLU 23 CO -0.02 -0.19 0.10 1.21 0.95 0.00 0.00 175.26 177.31 2k6w s ASN 24 N -1.06 5.30 0.05 0.83 2.47 -0.21 -4.97 114.94 117.35 2k6w s ASN 24 Ca -0.11 -1.18 0.26 0.00 0.42 0.00 0.00 52.86 52.26 2k6w s ASN 24 Cb -0.04 -1.86 1.07 0.00 -1.45 0.00 0.00 41.25 38.97 2k6w s ASN 24 CO 0.05 -0.33 1.83 -0.81 -3.72 0.00 0.00 177.10 174.12 2k6w n PRO 25 N 4.80 0.06 -1.32 0.43 -0.04 -1.26 -0.73 135.00 136.93 2k6w n PRO 25 Ca -0.12 0.09 -0.30 0.00 -0.04 0.00 0.00 63.50 63.13 2k6w n PRO 25 Cb 0.44 -1.57 0.12 0.00 -0.04 0.00 0.00 33.50 32.45 2k6w n PRO 25 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2k6w s GLY 26 N -3.14 1.62 0.15 0.55 0.00 -1.26 -4.75 107.32 100.48 2k6w s GLY 26 Ca 0.12 -0.12 -0.04 0.00 0.00 0.00 0.00 44.72 44.68 2k6w s GLY 26 CO 0.51 0.35 1.36 1.29 0.00 0.00 0.00 173.10 176.61 2k6w h ASP 27 N -1.41 0.57 -1.94 1.64 2.03 -1.97 -3.34 116.42 112.00 2k6w h ASP 27 Ca -0.49 -0.40 -0.47 0.00 -0.73 0.00 0.00 57.03 54.94 2k6w h ASP 27 Cb 1.28 -0.17 -0.02 0.00 -0.83 0.00 0.00 39.33 39.59 2k6w h ASP 27 CO 0.56 1.17 -0.41 -1.48 -1.03 0.00 0.00 179.24 178.06 2k6w s LEU 28 N -7.93 3.93 0.60 0.15 0.05 -1.26 -4.72 118.68 109.50 2k6w s LEU 28 Ca -0.06 -0.22 -0.12 0.00 0.05 0.00 0.00 54.13 53.77 2k6w s LEU 28 Cb 0.10 -2.58 -0.05 0.00 -2.05 0.00 0.00 46.19 41.61 2k6w s LEU 28 CO 0.86 -0.28 1.02 -2.16 -0.55 0.00 0.00 176.35 175.23 2k6w s PRO 29 N -4.04 3.66 -0.01 1.48 0.04 -1.26 -4.31 135.00 130.56 2k6w s PRO 29 Ca 0.40 0.78 -0.01 0.00 0.04 0.00 0.00 61.00 62.21 2k6w s PRO 29 Cb -0.08 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 2k6w s PRO 29 CO 0.29 -0.51 0.11 -0.51 0.04 0.00 0.00 177.00 176.41 2k6w s LEU 30 N -4.98 4.02 -0.26 -3.56 1.43 -0.08 -4.96 118.68 110.28 2k6w s LEU 30 Ca 0.56 0.20 -0.00 0.00 -1.03 0.00 0.00 54.13 53.85 2k6w s LEU 30 Cb -0.11 -2.35 0.08 0.00 0.03 0.00 0.00 46.19 43.84 2k6w s LEU 30 CO 0.50 0.27 0.04 -0.60 0.23 0.00 0.00 176.35 176.79 2k6w s ARG 31 N -1.78 1.02 -0.61 1.70 3.52 -1.26 -0.21 118.95 121.33 2k6w s ARG 31 Ca 0.24 -0.96 -0.28 0.00 -0.13 0.00 0.00 55.73 54.60 2k6w s ARG 31 Cb -0.12 -2.29 0.03 0.00 -1.56 0.00 0.00 34.95 31.00 2k6w s ARG 31 CO 0.15 -0.79 1.22 -1.17 -0.81 0.00 0.00 175.30 173.90 2k6w s LEU 32 N 1.55 3.38 0.04 -0.88 2.96 0.79 -0.52 118.68 126.00 2k6w s LEU 32 Ca 0.03 -0.01 0.23 0.00 -0.22 0.00 0.00 54.13 54.16 2k6w s LEU 32 Cb -0.18 -3.03 -0.04 0.00 0.50 0.00 0.00 46.19 43.44 2k6w s LEU 32 CO -0.14 -1.57 0.94 1.33 -1.32 0.00 0.00 176.35 175.59 2k6w n VAL 33 N 6.62 0.14 -3.23 1.68 0.24 0.49 -0.51 118.33 123.76 2k6w n VAL 33 Ca 0.07 -0.26 0.00 0.00 -2.04 0.00 0.00 64.34 62.12 2k6w n VAL 33 Cb 0.49 0.26 0.00 0.00 -1.47 0.00 0.00 33.84 33.12 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 1.36 -0.82 3.55 7.63 0.00 -1.18 -4.67 105.19 111.07 2k6w n GLY 34 Ca 0.01 -0.78 -0.13 0.00 0.00 0.00 0.00 46.02 45.12 2k6w n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6w s ALA 35 N -1.00 0.41 -0.12 4.61 0.00 -1.26 -0.83 121.76 123.57 2k6w s ALA 35 Ca 0.00 -1.32 -0.05 0.00 0.00 0.00 0.00 51.96 50.59 2k6w s ALA 35 Cb 0.00 1.07 0.06 0.00 0.00 0.00 0.00 23.12 24.24 2k6w s ALA 35 CO 0.00 -0.83 0.25 0.50 0.00 0.00 0.00 175.76 175.68 2k6w s ARG 36 N -3.04 0.16 0.01 0.00 3.52 0.09 -4.89 118.95 114.80 2k6w s ARG 36 Ca 0.27 0.64 -0.04 0.00 -0.13 0.00 0.00 55.73 56.48 2k6w s ARG 36 Cb -0.01 -0.09 -0.01 0.00 -1.56 0.00 0.00 34.95 33.28 2k6w s ARG 36 CO 0.17 -0.24 0.05 -0.08 -0.81 0.00 0.00 175.30 174.40 2k6w s THR 37 N 1.93 0.10 -1.67 4.11 -1.32 -1.26 -0.45 115.64 117.08 2k6w s THR 37 Ca -0.03 -0.79 0.30 0.00 -1.21 0.00 0.00 61.69 59.96 2k6w s THR 37 Cb -0.11 -0.34 0.66 0.00 -1.51 0.00 0.00 72.50 71.20 2k6w s THR 37 CO -0.08 -0.43 2.08 -0.81 -2.21 0.00 0.00 174.62 173.16 2k6w n PRO 38 N 1.55 0.64 0.00 7.08 -0.04 -1.26 -3.89 135.00 139.08 2k6w n PRO 38 Ca -0.23 0.01 0.11 0.00 -0.04 0.00 0.00 63.50 63.34 2k6w n PRO 38 Cb 0.55 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.51 2k6w n PRO 38 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2k6w n VAL 39 N -1.17 0.00 -4.30 0.52 0.24 -1.26 -4.64 118.33 107.72 2k6w n VAL 39 Ca 0.18 -0.26 -0.18 0.00 -2.04 0.00 0.00 64.34 62.03 2k6w n VAL 39 Cb 0.18 1.25 -0.13 0.00 -1.47 0.00 0.00 33.84 33.66 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 -2.44 0.92 0.00 2.33 0.00 -1.25 -1.33 121.76 119.98 2k6w s ALA 40 Ca 0.18 -0.66 0.00 0.00 0.00 0.00 0.00 51.96 51.47 2k6w s ALA 40 Cb 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.15 2k6w s ALA 40 CO 0.57 0.17 0.00 -1.91 0.00 0.00 0.00 175.76 174.58 2k6w n GLU 41 N 2.15 0.00 -3.25 0.00 4.07 -0.76 -4.68 120.64 118.17 2k6w n GLU 41 Ca -0.17 0.16 -0.39 0.00 -0.06 0.00 0.00 57.16 56.70 2k6w n GLU 41 Cb 0.55 -0.60 -0.06 0.00 -0.06 0.00 0.00 31.44 31.27 2k6w n GLU 41 CO 0.00 0.00 0.00 0.50 -0.06 0.00 0.00 177.13 177.57 2k6w s ARG 42 N -0.40 4.26 -0.07 5.31 3.52 -1.14 -4.98 118.95 125.45 2k6w s ARG 42 Ca 0.00 0.47 0.02 0.00 -0.13 0.00 0.00 55.73 56.08 2k6w s ARG 42 Cb 0.00 -3.51 -0.03 0.00 -1.56 0.00 0.00 34.95 29.86 2k6w s ARG 42 CO 0.00 -0.02 -0.10 0.54 -0.81 0.00 0.00 175.30 174.90 2k6w s VAL 43 N 1.21 3.38 -0.01 7.11 0.11 -1.26 -0.73 120.40 130.22 2k6w s VAL 43 Ca 0.26 -0.59 0.01 0.00 -2.93 0.00 0.00 61.98 58.73 2k6w s VAL 43 Cb -0.15 -2.37 0.01 0.00 -1.53 0.00 0.00 36.38 32.33 2k6w s VAL 43 CO 0.10 0.58 -0.03 -1.61 -3.33 0.00 0.00 175.10 170.81 2k6w s GLU 44 N -0.59 0.39 -0.16 1.54 2.02 -0.51 -4.94 118.70 116.45 2k6w s GLU 44 Ca 0.09 -0.10 -0.23 0.00 0.02 0.00 0.00 54.97 54.74 2k6w s GLU 44 Cb -0.12 -0.42 -0.02 0.00 0.10 0.00 0.00 34.13 33.67 2k6w s GLU 44 CO 0.02 0.03 0.73 -1.17 0.02 0.00 0.00 175.26 174.88 2k6w s LEU 45 N 0.24 4.19 0.14 1.80 0.20 -1.26 -0.31 118.68 123.68 2k6w s LEU 45 Ca -0.02 1.04 0.06 0.00 0.69 0.00 0.00 54.13 55.90 2k6w s LEU 45 Cb -0.06 -3.07 -0.04 0.00 -0.43 0.00 0.00 46.19 42.59 2k6w s LEU 45 CO -0.00 -0.30 0.06 -1.00 -0.29 0.00 0.00 176.35 174.81 2k6w s HIS 46 N 1.82 3.02 0.56 5.38 3.76 0.48 -1.17 115.29 129.15 2k6w s HIS 46 Ca 0.34 -0.05 0.08 0.00 -0.15 0.00 0.00 55.06 55.29 2k6w s HIS 46 Cb -0.16 -1.48 0.08 0.00 1.11 0.00 0.00 32.58 32.13 2k6w s HIS 46 CO 0.12 0.51 0.69 -0.85 -0.85 0.00 0.00 174.74 174.37 2k6w n GLU 47 N -0.01 0.63 -3.85 1.40 0.28 0.39 -1.34 120.64 118.14 2k6w n GLU 47 Ca -0.09 -3.11 -0.29 0.00 -0.16 0.00 0.00 57.16 53.50 2k6w n GLU 47 Cb 0.54 -0.10 -0.16 0.00 1.43 0.00 0.00 31.44 33.15 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 -2.54 1.17 0.44 3.84 2.01 0.60 -2.73 115.64 118.43 2k6w s THR 48 Ca 0.53 -1.11 -0.02 0.00 0.31 0.00 0.00 61.69 61.40 2k6w s THR 48 Cb -0.04 -1.59 -0.02 0.00 0.01 0.00 0.00 72.50 70.85 2k6w s THR 48 CO 0.33 -0.25 0.69 0.72 -0.69 0.00 0.00 174.62 175.42 2k6w s PHE 49 N 1.54 3.41 0.38 4.92 -0.71 0.24 -4.63 117.98 123.13 2k6w s PHE 49 Ca -0.01 0.48 0.08 0.00 -1.04 0.00 0.00 56.93 56.43 2k6w s PHE 49 Cb -0.18 -2.21 -0.07 0.00 -1.21 0.00 0.00 43.02 39.35 2k6w s PHE 49 CO -0.10 -0.22 0.01 -1.64 -1.34 0.00 0.00 175.22 171.92 2k6w s MET 50 N -4.57 1.97 -0.15 1.99 -1.94 -1.26 -1.53 119.30 113.81 2k6w s MET 50 Ca 0.46 -1.98 -0.34 0.00 -1.71 0.00 0.00 55.69 52.11 2k6w s MET 50 Cb -0.10 -1.74 0.14 0.00 2.01 0.00 0.00 34.83 35.14 2k6w s MET 50 CO 0.40 0.02 1.28 1.03 -0.01 0.00 0.00 175.02 177.74 2k6w s ARG 51 N -3.71 0.25 0.16 2.03 0.52 -0.73 -4.99 118.95 112.48 2k6w s ARG 51 Ca 0.35 -0.11 -0.10 0.00 -0.52 0.00 0.00 55.73 55.34 2k6w s ARG 51 Cb 0.06 0.10 -0.07 0.00 0.52 0.00 0.00 34.95 35.57 2k6w s ARG 51 CO 0.18 -0.11 0.49 -1.21 0.02 0.00 0.00 175.30 174.67 2k6w s GLU 52 N -2.31 3.81 -0.00 3.54 8.01 -1.26 -0.33 118.70 130.16 2k6w s GLU 52 Ca 0.12 0.26 0.06 0.00 0.01 0.00 0.00 54.97 55.42 2k6w s GLU 52 Cb 0.01 -2.83 -0.08 0.00 -4.31 0.00 0.00 34.13 26.92 2k6w s GLU 52 CO -0.04 0.44 0.19 1.55 0.01 0.00 0.00 175.26 177.41 2k6w n VAL 53 N 0.39 0.00 -1.58 2.63 3.14 -0.25 -4.83 118.33 117.83 2k6w n VAL 53 Ca -0.03 -0.24 -0.02 0.00 -2.96 0.00 0.00 64.34 61.09 2k6w n VAL 53 Cb 0.52 0.64 -0.02 0.00 -1.06 0.00 0.00 33.84 33.93 2k6w n VAL 53 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 2k6w n GLU 54 N -1.46 0.00 0.00 1.45 2.13 -1.26 -4.91 120.64 116.58 2k6w n GLU 54 Ca -0.00 -0.24 0.00 0.00 0.66 0.00 0.00 57.16 57.58 2k6w n GLU 54 Cb 0.13 0.29 0.00 0.00 0.27 0.00 0.00 31.44 32.14 2k6w n GLU 54 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2k6w n GLY 55 N 0.00 2.17 3.74 8.31 0.00 -1.26 -4.98 105.19 113.16 2k6w n GLY 55 Ca -0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 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 4.63 0.24 1.61 3.01 -1.26 -4.95 119.74 123.02 2k6w s LYS 56 Ca 0.00 1.31 -0.30 0.00 -1.01 0.00 0.00 55.97 55.97 2k6w s LYS 56 Cb 0.00 -3.36 -0.09 0.00 -1.01 0.00 0.00 37.83 33.37 2k6w s LYS 56 CO 0.00 0.28 1.06 0.15 0.51 0.00 0.00 175.35 177.34 2k6w s LYS 57 N -0.16 4.68 0.05 1.68 1.02 -1.26 -1.09 119.74 124.67 2k6w s LYS 57 Ca 0.43 1.69 0.03 0.00 0.02 0.00 0.00 55.97 58.15 2k6w s LYS 57 Cb -0.23 -3.24 -0.03 0.00 -0.52 0.00 0.00 37.83 33.82 2k6w s LYS 57 CO 0.27 0.25 -0.10 0.08 -0.92 0.00 0.00 175.35 174.93 2k6w s VAL 58 N -0.86 0.73 0.04 3.17 1.01 0.55 -4.91 120.40 120.13 2k6w s VAL 58 Ca 0.45 -1.19 0.08 0.00 0.00 0.00 0.00 61.98 61.31 2k6w s VAL 58 Cb -0.30 -0.81 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 2k6w s VAL 58 CO 0.37 -0.36 -0.22 -0.32 0.00 0.00 0.00 175.10 174.57 2k6w s MET 59 N -1.74 1.52 0.18 2.72 1.75 -1.26 -1.78 119.30 120.69 2k6w s MET 59 Ca -0.06 -0.96 -0.17 0.00 -1.25 0.00 0.00 55.69 53.25 2k6w s MET 59 Cb -0.09 -1.63 0.03 0.00 2.84 0.00 0.00 34.83 35.97 2k6w s MET 59 CO 0.01 0.42 0.49 0.20 -0.65 0.00 0.00 175.02 175.49 2k6w s GLY 60 N -1.12 -0.10 0.34 2.11 0.00 -0.58 -5.01 107.32 102.96 2k6w s GLY 60 Ca 0.09 -0.21 0.01 0.00 0.00 0.00 0.00 44.72 44.60 2k6w s GLY 60 CO 0.02 -0.29 0.54 1.06 0.00 0.00 0.00 173.10 174.42 2k6w s MET 61 N -3.86 3.48 -0.29 2.90 -1.94 -1.26 -0.60 119.30 117.74 2k6w s MET 61 Ca 0.08 -0.35 -0.25 0.00 -1.71 0.00 0.00 55.69 53.46 2k6w s MET 61 Cb -0.00 -2.68 0.16 0.00 2.01 0.00 0.00 34.83 34.32 2k6w s MET 61 CO -0.04 0.17 1.23 0.50 -0.01 0.00 0.00 175.02 176.87 2k6w s ARG 62 N -4.28 0.29 0.47 2.03 3.52 -1.11 -4.92 118.95 114.95 2k6w s ARG 62 Ca 0.40 0.33 -0.22 0.00 -0.13 0.00 0.00 55.73 56.11 2k6w s ARG 62 Cb -0.10 0.14 -0.07 0.00 -1.56 0.00 0.00 34.95 33.36 2k6w s ARG 62 CO 0.36 -0.04 1.13 -1.25 -0.81 0.00 0.00 175.30 174.69 2k6w s PRO 63 N 0.09 3.74 0.12 5.12 0.04 -1.26 -0.47 135.00 142.38 2k6w s PRO 63 Ca 0.05 1.66 0.09 0.00 0.04 0.00 0.00 61.00 62.83 2k6w s PRO 63 Cb -0.05 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.15 2k6w s PRO 63 CO -0.11 -0.54 -0.21 0.14 0.04 0.00 0.00 177.00 176.32 2k6w s VAL 64 N -1.66 1.79 -1.12 -0.36 -7.23 -0.31 -4.84 120.40 106.67 2k6w s VAL 64 Ca 0.65 -1.66 0.17 0.00 -1.81 0.00 0.00 61.98 59.32 2k6w s VAL 64 Cb -0.25 -1.67 0.18 0.00 0.56 0.00 0.00 36.38 35.20 2k6w s VAL 64 CO 0.30 -0.11 1.52 -0.81 -0.31 0.00 0.00 175.10 175.69 2k6w n PRO 65 N 0.86 0.07 -3.59 4.82 -0.04 -1.26 -4.63 135.00 131.23 2k6w n PRO 65 Ca -0.18 0.19 -0.05 0.00 -0.04 0.00 0.00 63.50 63.43 2k6w n PRO 65 Cb 0.54 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.48 2k6w n PRO 65 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 2k6w s PHE 66 N -2.88 -0.15 0.46 0.54 -0.12 -1.26 -4.71 117.98 109.86 2k6w s PHE 66 Ca 0.10 0.11 0.07 0.00 -0.05 0.00 0.00 56.93 57.16 2k6w s PHE 66 Cb 0.11 0.51 -0.01 0.00 -0.63 0.00 0.00 43.02 43.01 2k6w s PHE 66 CO 0.29 -0.22 0.36 -0.51 -0.05 0.00 0.00 175.22 175.09 2k6w s LEU 67 N -2.11 3.13 0.19 -1.99 1.43 0.33 -4.99 118.68 114.67 2k6w s LEU 67 Ca 0.09 -0.96 -0.21 0.00 -1.03 0.00 0.00 54.13 52.02 2k6w s LEU 67 Cb -0.01 -1.67 0.05 0.00 0.03 0.00 0.00 46.19 44.59 2k6w s LEU 67 CO -0.05 -0.79 0.59 -1.83 0.23 0.00 0.00 176.35 174.50 2k6w s GLU 68 N -4.15 1.40 -0.16 1.70 -1.05 -1.26 -0.15 118.70 115.02 2k6w s GLU 68 Ca 0.43 -0.70 -0.10 0.00 -0.15 0.00 0.00 54.97 54.45 2k6w s GLU 68 Cb -0.02 0.57 0.06 0.00 -0.44 0.00 0.00 34.13 34.30 2k6w s GLU 68 CO 0.25 -0.61 0.40 0.08 0.95 0.00 0.00 175.26 176.33 2k6w s VAL 69 N -3.82 -0.02 0.85 1.83 1.01 0.71 -4.96 120.40 115.99 2k6w s VAL 69 Ca 0.05 0.08 -0.11 0.00 0.00 0.00 0.00 61.98 62.00 2k6w s VAL 69 Cb -0.02 -0.59 0.10 0.00 0.00 0.00 0.00 36.38 35.87 2k6w s VAL 69 CO -0.06 0.03 1.09 -2.16 0.00 0.00 0.00 175.10 174.01 2k6w s PRO 70 N 1.23 1.65 0.24 2.72 0.04 -1.26 -0.90 135.00 138.72 2k6w s PRO 70 Ca -0.08 0.79 -0.31 0.00 0.04 0.00 0.00 61.00 61.44 2k6w s PRO 70 Cb -0.08 -1.86 -0.11 0.00 0.04 0.00 0.00 34.50 32.50 2k6w s PRO 70 CO -0.11 -1.96 1.60 -1.25 0.04 0.00 0.00 177.00 175.32 2k6w s PRO 71 N -5.01 4.16 0.00 0.56 0.04 -1.26 -1.86 135.00 131.63 2k6w s PRO 71 Ca 0.62 2.50 0.00 0.00 0.04 0.00 0.00 61.00 64.17 2k6w s PRO 71 Cb -0.17 -3.07 0.00 0.00 0.04 0.00 0.00 34.50 31.30 2k6w s PRO 71 CO 0.56 -0.62 0.00 1.63 0.04 0.00 0.00 177.00 178.61 2k6w n LYS 72 N 2.93 -0.03 -2.45 4.56 4.76 0.09 -5.00 118.16 123.03 2k6w n LYS 72 Ca 0.11 0.01 -0.30 0.00 -2.87 0.00 0.00 58.31 55.25 2k6w n LYS 72 Cb 0.37 -3.31 -0.01 0.00 -1.84 0.00 0.00 35.03 30.24 2k6w n LYS 72 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k6w s GLY 73 N -2.00 1.77 0.02 0.72 0.00 -0.78 -4.82 107.32 102.24 2k6w s GLY 73 Ca 0.00 -0.18 0.03 0.00 0.00 0.00 0.00 44.72 44.57 2k6w s GLY 73 CO 0.00 0.04 -0.11 -1.60 0.00 0.00 0.00 173.10 171.43 2k6w s ARG 74 N -4.49 0.76 0.13 2.90 3.52 -1.26 -1.05 118.95 119.46 2k6w s ARG 74 Ca 0.53 -0.58 0.00 0.00 -0.13 0.00 0.00 55.73 55.55 2k6w s ARG 74 Cb -0.10 -0.71 -0.04 0.00 -1.56 0.00 0.00 34.95 32.54 2k6w s ARG 74 CO 0.41 0.18 0.02 0.14 -0.81 0.00 0.00 175.30 175.23 2k6w s VAL 75 N -0.70 0.37 -0.11 7.11 -7.23 0.58 -4.99 120.40 115.42 2k6w s VAL 75 Ca 0.00 -1.92 -0.03 0.00 -1.81 0.00 0.00 61.98 58.21 2k6w s VAL 75 Cb -0.06 -1.98 0.04 0.00 0.56 0.00 0.00 36.38 34.94 2k6w s VAL 75 CO 0.00 -0.57 0.06 -1.61 -0.31 0.00 0.00 175.10 172.68 2k6w s GLU 76 N -3.97 0.11 -0.90 4.82 2.02 -1.26 -1.12 118.70 118.40 2k6w s GLU 76 Ca 0.21 0.10 -0.24 0.00 0.02 0.00 0.00 54.97 55.05 2k6w s GLU 76 Cb 0.07 -1.24 -0.02 0.00 0.10 0.00 0.00 34.13 33.04 2k6w s GLU 76 CO 0.01 -0.49 1.81 -0.51 0.02 0.00 0.00 175.26 176.09 2k6w s LEU 77 N 2.11 3.25 0.12 1.80 1.02 0.81 -4.64 118.68 123.15 2k6w s LEU 77 Ca 0.03 -0.76 0.06 0.00 0.02 0.00 0.00 54.13 53.49 2k6w s LEU 77 Cb -0.14 -2.56 -0.04 0.00 0.02 0.00 0.00 46.19 43.47 2k6w s LEU 77 CO -0.06 -2.41 -0.02 -1.59 0.02 0.00 0.00 176.35 172.29 2k6w s LYS 78 N 6.52 2.43 0.13 1.70 -2.85 -0.29 -1.39 119.74 125.99 2k6w s LYS 78 Ca 0.63 -0.95 -0.25 0.00 -1.00 0.00 0.00 55.97 54.41 2k6w s LYS 78 Cb -0.06 -2.45 -0.02 0.00 -2.06 0.00 0.00 37.83 33.24 2k6w s LYS 78 CO -0.01 0.51 1.63 -1.00 0.10 0.00 0.00 175.35 176.59 2k6w h PRO 79 N 3.27 -0.33 -5.76 1.78 0.13 -1.94 -0.66 132.00 128.49 2k6w h PRO 79 Ca -0.48 0.02 -0.62 0.00 -0.87 0.00 0.00 66.00 64.06 2k6w h PRO 79 Cb 1.17 0.08 -0.12 0.00 0.13 0.00 0.00 31.00 32.26 2k6w h PRO 79 CO 0.58 -0.22 1.07 0.20 -0.23 0.00 0.00 178.00 179.39 2k6w s GLY 80 N -2.62 1.38 0.00 1.56 0.00 -1.26 -4.37 107.32 102.01 2k6w s GLY 80 Ca -0.15 -2.15 0.00 0.00 0.00 0.00 0.00 44.72 42.42 2k6w s GLY 80 CO 0.66 2.39 0.00 0.61 0.00 0.00 0.00 173.10 176.77 2k6w n GLY 81 N 5.96 -0.62 3.44 0.20 0.00 -1.07 -5.00 105.19 108.10 2k6w n GLY 81 Ca 0.18 0.24 -0.15 0.00 0.00 0.00 0.00 46.02 46.29 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 0.00 -0.54 -0.18 1.61 2.02 -0.28 -0.29 117.35 119.70 2k6w s TYR 82 Ca 0.00 1.10 -0.33 0.00 -0.37 0.00 0.00 57.07 57.47 2k6w s TYR 82 Cb 0.00 0.26 0.14 0.00 -0.40 0.00 0.00 41.96 41.96 2k6w s TYR 82 CO 0.00 -0.43 1.17 -3.38 -1.57 0.00 0.00 175.55 171.34 2k6w s HIS 83 N -0.60 -0.17 0.12 2.71 -3.43 -0.45 -1.14 115.29 112.33 2k6w s HIS 83 Ca -0.07 0.16 -0.24 0.00 -0.80 0.00 0.00 55.06 54.11 2k6w s HIS 83 Cb -0.03 0.51 -0.07 0.00 -1.43 0.00 0.00 32.58 31.56 2k6w s HIS 83 CO 0.05 -0.23 0.72 -0.06 -2.00 0.00 0.00 174.74 173.21 2k6w s PHE 84 N -2.15 3.86 -0.28 0.38 0.08 -0.90 -0.38 117.98 118.58 2k6w s PHE 84 Ca 0.08 1.51 -0.18 0.00 0.12 0.00 0.00 56.93 58.45 2k6w s PHE 84 Cb -0.01 -2.70 -0.02 0.00 -0.57 0.00 0.00 43.02 39.72 2k6w s PHE 84 CO -0.05 0.50 0.52 -1.64 -0.10 0.00 0.00 175.22 174.46 2k6w s MET 85 N -0.97 3.98 -0.35 0.44 -1.94 0.58 -1.38 119.30 119.66 2k6w s MET 85 Ca 0.34 0.24 -0.13 0.00 -1.71 0.00 0.00 55.69 54.43 2k6w s MET 85 Cb -0.22 -3.68 -0.01 0.00 2.01 0.00 0.00 34.83 32.92 2k6w s MET 85 CO 0.24 -0.42 0.25 -0.51 -0.01 0.00 0.00 175.02 174.56 2k6w s LEU 86 N 2.35 4.58 0.10 -0.03 1.43 0.16 -1.42 118.68 125.85 2k6w s LEU 86 Ca 0.21 -0.47 0.05 0.00 -1.03 0.00 0.00 54.13 52.89 2k6w s LEU 86 Cb -0.15 -2.14 -0.04 0.00 0.03 0.00 0.00 46.19 43.89 2k6w s LEU 86 CO 0.10 -0.26 0.02 -0.76 0.23 0.00 0.00 176.35 175.68 2k6w s LEU 87 N 1.72 3.50 0.00 1.79 2.01 0.09 -1.37 118.68 126.43 2k6w s LEU 87 Ca 0.06 -0.18 0.00 0.00 0.01 0.00 0.00 54.13 54.02 2k6w s LEU 87 Cb -0.18 -2.21 0.00 0.00 0.01 0.00 0.00 46.19 43.81 2k6w s LEU 87 CO 0.10 0.16 0.00 0.61 1.01 0.00 0.00 176.35 178.23 2k6w n GLY 88 N 0.43 1.53 1.13 -3.19 0.00 -0.74 -1.83 105.19 102.51 2k6w n GLY 88 Ca -0.10 -0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.89 2k6w n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k6w n LEU 89 N 0.00 -4.27 -0.71 0.99 4.77 -1.26 -4.83 117.00 111.68 2k6w n LEU 89 Ca 0.00 1.73 -0.00 0.00 -0.03 0.00 0.00 56.01 57.71 2k6w n LEU 89 Cb 0.00 -1.58 0.02 0.00 -2.33 0.00 0.00 43.42 39.52 2k6w n LEU 89 CO 0.00 -0.58 0.36 0.29 -1.33 0.00 0.00 177.39 176.12 2k6w n LYS 90 N 0.44 1.14 0.00 3.23 5.02 -0.44 -4.78 118.16 122.77 2k6w n LYS 90 Ca 0.00 -0.14 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 2k6w n LYS 90 Cb 0.00 -1.39 0.00 0.00 -0.02 0.00 0.00 35.03 33.62 2k6w n LYS 90 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2k6w n ARG 91 N 0.15 0.00 -1.95 1.97 1.85 -1.26 -4.93 116.66 112.48 2k6w n ARG 91 Ca 0.02 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.45 2k6w n ARG 91 Cb 0.37 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 31.75 2k6w n ARG 91 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 2k6w s PRO 92 N -2.00 4.23 -0.50 2.89 0.04 -1.26 -4.91 135.00 133.48 2k6w s PRO 92 Ca 0.00 2.35 -0.27 0.00 0.04 0.00 0.00 61.00 63.12 2k6w s PRO 92 Cb 0.00 -3.13 -0.05 0.00 0.04 0.00 0.00 34.50 31.36 2k6w s PRO 92 CO 0.00 -0.55 2.16 -0.51 0.04 0.00 0.00 177.00 178.14 2k6w s LEU 93 N 0.57 3.38 -0.70 -3.56 2.01 -1.26 -4.88 118.68 114.23 2k6w s LEU 93 Ca 0.66 0.90 -0.26 0.00 0.01 0.00 0.00 54.13 55.44 2k6w s LEU 93 Cb -0.43 -2.66 -0.02 0.00 0.01 0.00 0.00 46.19 43.08 2k6w s LEU 93 CO 0.36 -2.55 1.83 -0.75 1.01 0.00 0.00 176.35 176.24 2k6w s LYS 94 N 7.51 2.68 -0.18 1.70 2.47 -1.26 -4.61 119.74 128.04 2k6w s LYS 94 Ca 0.86 0.28 -0.41 0.00 -1.56 0.00 0.00 55.97 55.14 2k6w s LYS 94 Cb -0.17 -4.56 -0.18 0.00 -1.46 0.00 0.00 37.83 31.46 2k6w s LYS 94 CO 0.25 -2.83 1.47 0.00 0.16 0.00 0.00 175.35 174.40 2k6w n ALA 95 N 12.69 -1.35 -2.21 3.13 0.00 -1.26 -0.36 120.51 131.16 2k6w n ALA 95 Ca 0.24 0.49 -0.09 0.00 0.00 0.00 0.00 53.44 54.08 2k6w n ALA 95 Cb 0.51 -2.02 -0.00 0.00 0.00 0.00 0.00 19.45 17.93 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 3.18 0.02 0.84 0.00 0.00 -0.71 -5.02 105.19 103.49 2k6w n GLY 96 Ca 0.24 -0.50 -0.04 0.00 0.00 0.00 0.00 46.02 45.72 2k6w n GLY 96 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2k6w n GLU 97 N -1.88 0.97 -4.15 1.61 0.28 0.52 -5.00 120.64 112.99 2k6w n GLU 97 Ca -0.10 -0.68 -0.16 0.00 -0.16 0.00 0.00 57.16 56.05 2k6w n GLU 97 Cb 0.58 -0.03 -0.12 0.00 1.43 0.00 0.00 31.44 33.30 2k6w n GLU 97 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 2k6w s GLU 98 N -2.55 0.77 -0.36 3.44 -1.05 -1.26 -0.55 118.70 117.14 2k6w s GLU 98 Ca 0.12 -0.97 -0.14 0.00 -0.15 0.00 0.00 54.97 53.83 2k6w s GLU 98 Cb -0.01 -0.66 -0.01 0.00 -0.44 0.00 0.00 34.13 33.02 2k6w s GLU 98 CO 0.08 0.13 0.30 0.08 0.95 0.00 0.00 175.26 176.80 2k6w s VAL 99 N -1.59 5.23 0.26 1.83 1.01 0.11 -4.87 120.40 122.37 2k6w s VAL 99 Ca -0.02 -0.24 -0.30 0.00 0.00 0.00 0.00 61.98 61.43 2k6w s VAL 99 Cb -0.08 -3.82 -0.09 0.00 0.00 0.00 0.00 36.38 32.39 2k6w s VAL 99 CO 0.01 -0.13 1.16 -0.70 0.00 0.00 0.00 175.10 175.45 2k6w s GLU 100 N 1.84 4.55 -0.25 2.72 -6.30 -1.26 -2.51 118.70 117.49 2k6w s GLU 100 Ca 0.08 1.89 -0.06 0.00 -2.50 0.00 0.00 54.97 54.38 2k6w s GLU 100 Cb -0.17 -3.19 0.13 0.00 0.00 0.00 0.00 34.13 30.90 2k6w s GLU 100 CO 0.11 0.05 0.50 -0.51 0.02 0.00 0.00 175.26 175.43 2k6w s LEU 101 N -1.11 -0.90 -0.57 2.70 1.43 -0.59 -4.00 118.68 115.64 2k6w s LEU 101 Ca 0.48 0.96 -0.23 0.00 -1.03 0.00 0.00 54.13 54.30 2k6w s LEU 101 Cb -0.33 1.68 0.05 0.00 0.03 0.00 0.00 46.19 47.62 2k6w s LEU 101 CO 0.41 -0.25 0.92 -1.81 0.23 0.00 0.00 176.35 175.86 2k6w s ASP 102 N 2.71 6.30 -0.04 2.29 1.01 0.41 -0.35 116.67 129.00 2k6w s ASP 102 Ca 0.04 -0.52 -0.30 0.00 0.71 0.00 0.00 52.55 52.48 2k6w s ASP 102 Cb -0.13 -2.42 -0.03 0.00 1.01 0.00 0.00 42.92 41.34 2k6w s ASP 102 CO -0.16 -1.24 1.17 -0.76 0.21 0.00 0.00 175.17 174.38 2k6w s LEU 103 N 3.87 4.30 -0.26 1.23 1.43 -0.29 -0.73 118.68 128.23 2k6w s LEU 103 Ca 0.27 1.81 -0.13 0.00 -1.03 0.00 0.00 54.13 55.06 2k6w s LEU 103 Cb -0.14 -3.56 -0.04 0.00 0.03 0.00 0.00 46.19 42.48 2k6w s LEU 103 CO 0.17 -0.53 0.29 -0.76 0.23 0.00 0.00 176.35 175.74 2k6w s LEU 104 N 1.93 4.06 -0.17 1.79 1.43 -0.01 -2.07 118.68 125.64 2k6w s LEU 104 Ca 0.55 0.20 0.01 0.00 -1.03 0.00 0.00 54.13 53.86 2k6w s LEU 104 Cb -0.25 -2.29 0.02 0.00 0.03 0.00 0.00 46.19 43.70 2k6w s LEU 104 CO 0.23 -0.09 -0.17 -0.36 0.23 0.00 0.00 176.35 176.19 2k6w s PHE 105 N 1.73 2.54 -0.67 0.29 0.08 0.23 -0.38 117.98 121.80 2k6w s PHE 105 Ca 0.12 -1.51 0.00 0.00 0.12 0.00 0.00 56.93 55.66 2k6w s PHE 105 Cb -0.15 -1.78 0.00 0.00 -0.57 0.00 0.00 43.02 40.52 2k6w s PHE 105 CO 0.09 -0.75 0.00 0.00 -0.10 0.00 0.00 175.22 174.46 2k6w n ALA 106 N 4.68 -0.73 0.00 5.36 0.00 0.32 -1.33 120.51 128.81 2k6w n ALA 106 Ca -0.19 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.32 2k6w n ALA 106 Cb 0.50 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.88 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 -0.59 1.07 0.00 0.00 0.00 -1.26 -4.62 105.19 99.79 2k6w n GLY 107 Ca -0.09 -0.02 0.12 0.00 0.00 0.00 0.00 46.02 46.04 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 0.00 -1.22 3.45 -0.02 0.00 -1.17 -4.64 105.19 101.59 2k6w n GLY 108 Ca 0.00 -0.11 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 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 -2.75 2.04 -0.11 1.61 3.01 -0.44 -5.05 119.74 118.05 2k6w s LYS 109 Ca 0.19 -1.00 -0.08 0.00 -1.01 0.00 0.00 55.97 54.07 2k6w s LYS 109 Cb 0.17 -2.17 0.04 0.00 -1.01 0.00 0.00 37.83 34.85 2k6w s LYS 109 CO 0.41 0.53 0.28 0.54 0.51 0.00 0.00 175.35 177.63 2k6w s VAL 110 N -0.93 -0.02 -0.08 3.17 0.11 -1.26 -0.60 120.40 120.79 2k6w s VAL 110 Ca 0.15 0.06 -0.03 0.00 -2.93 0.00 0.00 61.98 59.22 2k6w s VAL 110 Cb -0.10 -0.41 0.04 0.00 -1.53 0.00 0.00 36.38 34.38 2k6w s VAL 110 CO 0.05 0.02 0.17 -0.76 -3.33 0.00 0.00 175.10 171.26 2k6w s LEU 111 N 0.63 0.48 0.17 2.54 1.43 -0.88 -4.98 118.68 118.07 2k6w s LEU 111 Ca -0.04 0.36 -0.12 0.00 -1.03 0.00 0.00 54.13 53.30 2k6w s LEU 111 Cb -0.05 0.43 -0.07 0.00 0.03 0.00 0.00 46.19 46.53 2k6w s LEU 111 CO -0.04 -0.17 0.53 -1.59 0.23 0.00 0.00 176.35 175.31 2k6w s LYS 112 N 1.44 3.87 0.24 1.70 -2.85 -1.26 -1.13 119.74 121.75 2k6w s LYS 112 Ca -0.07 0.36 0.05 0.00 -1.00 0.00 0.00 55.97 55.31 2k6w s LYS 112 Cb -0.11 -2.82 -0.05 0.00 -2.06 0.00 0.00 37.83 32.79 2k6w s LYS 112 CO -0.06 0.42 -0.03 0.14 0.10 0.00 0.00 175.35 175.91 2k6w s VAL 113 N -1.61 1.26 -0.02 1.79 -7.23 0.52 -4.96 120.40 110.15 2k6w s VAL 113 Ca 0.41 -2.07 0.01 0.00 -1.81 0.00 0.00 61.98 58.52 2k6w s VAL 113 Cb -0.13 -2.32 0.02 0.00 0.56 0.00 0.00 36.38 34.50 2k6w s VAL 113 CO 0.20 -0.36 -0.01 0.54 -0.31 0.00 0.00 175.10 175.16 2k6w s VAL 114 N -3.27 0.22 -0.03 1.32 0.11 -1.26 -1.54 120.40 115.95 2k6w s VAL 114 Ca 0.27 0.01 -0.07 0.00 -2.93 0.00 0.00 61.98 59.26 2k6w s VAL 114 Cb 0.05 -0.27 0.01 0.00 -1.53 0.00 0.00 36.38 34.63 2k6w s VAL 114 CO 0.09 0.13 0.17 -0.76 -3.33 0.00 0.00 175.10 171.39 2k6w s LEU 115 N 0.69 1.40 0.61 2.54 1.02 -1.04 -4.96 118.68 118.94 2k6w s LEU 115 Ca -0.07 0.08 -0.17 0.00 0.02 0.00 0.00 54.13 53.99 2k6w s LEU 115 Cb -0.10 0.68 -0.02 0.00 0.02 0.00 0.00 46.19 46.77 2k6w s LEU 115 CO -0.01 -0.23 1.11 -2.16 0.02 0.00 0.00 176.35 175.08 2k6w s PRO 116 N -0.69 3.03 -0.09 1.29 0.04 -1.26 0.05 135.00 137.36 2k6w s PRO 116 Ca -0.08 1.44 -0.26 0.00 0.04 0.00 0.00 61.00 62.15 2k6w s PRO 116 Cb -0.05 -1.98 -0.02 0.00 0.04 0.00 0.00 34.50 32.49 2k6w s PRO 116 CO 0.01 -1.08 0.84 0.08 0.04 0.00 0.00 177.00 176.90 2k6w s VAL 117 N -2.16 4.92 0.03 -0.36 1.01 0.29 -0.94 120.40 123.18 2k6w s VAL 117 Ca 0.68 1.71 -0.10 0.00 0.00 0.00 0.00 61.98 64.28 2k6w s VAL 117 Cb -0.21 -4.17 0.01 0.00 0.00 0.00 0.00 36.38 32.01 2k6w s VAL 117 CO 0.36 0.12 0.22 -0.70 0.00 0.00 0.00 175.10 175.10 2k6w s GLU 118 N 1.47 0.69 -0.77 2.72 2.12 -0.12 -1.74 118.70 123.06 2k6w s GLU 118 Ca 0.42 -0.55 -0.02 0.00 0.36 0.00 0.00 54.97 55.18 2k6w s GLU 118 Cb -0.18 0.29 0.35 0.00 0.26 0.00 0.00 34.13 34.85 2k6w s GLU 118 CO 0.18 -0.20 2.08 0.00 -0.54 0.00 0.00 175.26 176.78 2k6w n ALA 119 N 0.80 6.46 -1.45 6.30 0.00 -1.26 -0.88 120.51 130.48 2k6w n ALA 119 Ca -0.19 -3.86 0.00 0.00 0.00 0.00 0.00 53.44 49.38 2k6w n ALA 119 Cb 0.58 -1.95 0.00 0.00 0.00 0.00 0.00 19.45 18.08 2k6w n ALA 119 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.50 180.39