#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 -4.49 -0.46 1.61 2.88 -1.26 -4.91 113.62 106.99 2k6w n SER 2 Ca 0.00 0.93 -0.06 0.00 -1.33 0.00 0.00 58.87 58.41 2k6w n SER 2 Cb 0.00 -2.15 -0.03 0.00 -0.75 0.00 0.00 64.21 61.28 2k6w n SER 2 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 2k6w n PHE 3 N -1.92 0.00 -3.80 0.66 3.72 -1.26 -4.94 117.46 109.92 2k6w n PHE 3 Ca 0.00 0.00 -0.14 0.00 -0.05 0.00 0.00 57.45 57.26 2k6w n PHE 3 Cb 0.22 -2.15 -0.15 0.00 -0.94 0.00 0.00 39.48 36.45 2k6w n PHE 3 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 2k6w s THR 4 N -1.67 -0.04 -0.09 4.37 -4.23 -1.26 -5.15 115.64 107.57 2k6w s THR 4 Ca 0.00 0.14 -0.11 0.00 -1.18 0.00 0.00 61.69 60.54 2k6w s THR 4 Cb 0.00 -0.06 -0.05 0.00 1.34 0.00 0.00 72.50 73.73 2k6w s THR 4 CO 0.00 0.06 0.26 -1.83 -0.54 0.00 0.00 174.62 172.57 2k6w s GLU 5 N 0.72 3.81 0.02 3.99 1.03 -1.26 -4.83 118.70 122.18 2k6w s GLU 5 Ca -0.06 0.09 -0.28 0.00 0.03 0.00 0.00 54.97 54.75 2k6w s GLU 5 Cb -0.09 -3.26 0.10 0.00 -0.80 0.00 0.00 34.13 30.08 2k6w s GLU 5 CO -0.02 0.61 1.23 0.20 -1.33 0.00 0.00 175.26 175.96 2k6w s GLY 6 N -0.66 -0.21 -0.07 -3.83 0.00 -1.26 -0.34 107.32 100.95 2k6w s GLY 6 Ca 0.18 0.24 -0.30 0.00 0.00 0.00 0.00 44.72 44.84 2k6w s GLY 6 CO 0.07 2.77 0.85 0.66 0.00 0.00 0.00 173.10 177.45 2k6w s TRP 7 N -2.26 -0.46 -0.15 1.90 -2.14 -0.20 -4.20 118.94 111.42 2k6w s TRP 7 Ca 0.22 0.68 -0.02 0.00 2.66 0.00 0.00 56.10 59.64 2k6w s TRP 7 Cb 0.01 0.46 -0.02 0.00 -3.10 0.00 0.00 33.47 30.83 2k6w s TRP 7 CO -0.01 -0.50 -0.09 0.08 -2.66 0.00 0.00 176.95 173.77 2k6w s VAL 8 N -1.72 3.32 -0.30 -0.66 1.01 -0.13 -2.32 120.40 119.60 2k6w s VAL 8 Ca -0.03 -0.56 -0.19 0.00 0.00 0.00 0.00 61.98 61.20 2k6w s VAL 8 Cb -0.00 -2.43 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 2k6w s VAL 8 CO 0.01 0.50 0.59 -0.60 0.00 0.00 0.00 175.10 175.60 2k6w s ARG 9 N 0.53 3.91 0.40 2.72 3.00 -0.69 -2.98 118.95 125.84 2k6w s ARG 9 Ca -0.06 0.25 -0.26 0.00 -1.00 0.00 0.00 55.73 54.65 2k6w s ARG 9 Cb -0.15 -3.72 -0.09 0.00 0.00 0.00 0.00 34.95 30.99 2k6w s ARG 9 CO 0.03 -0.53 1.34 0.12 0.00 0.00 0.00 175.30 176.27 2k6w s PHE 10 N 2.51 2.76 0.25 5.12 5.36 0.34 -4.40 117.98 129.92 2k6w s PHE 10 Ca 0.23 1.36 -0.21 0.00 -0.96 0.00 0.00 56.93 57.36 2k6w s PHE 10 Cb -0.15 -3.75 0.03 0.00 -0.34 0.00 0.00 43.02 38.81 2k6w s PHE 10 CO 0.11 -2.29 0.67 -1.12 -1.46 0.00 0.00 175.22 171.12 2k6w s SER 11 N -0.61 -0.31 0.15 6.13 0.01 -1.26 -4.63 113.70 113.18 2k6w s SER 11 Ca 0.56 -0.50 0.24 0.00 1.31 0.00 0.00 55.95 57.56 2k6w s SER 11 Cb -0.40 0.68 0.36 0.00 0.21 0.00 0.00 66.02 66.87 2k6w s SER 11 CO 0.52 -1.24 1.35 1.55 0.41 0.00 0.00 173.24 175.83 2k6w h PRO 12 N 2.03 0.00 -7.21 12.44 0.13 -1.98 -3.42 132.00 133.99 2k6w h PRO 12 Ca -0.23 0.00 -0.48 0.00 -0.87 0.00 0.00 66.00 64.42 2k6w h PRO 12 Cb 1.26 0.00 0.03 0.00 0.13 0.00 0.00 31.00 32.42 2k6w h PRO 12 CO 0.28 0.00 0.38 0.20 -0.23 0.00 0.00 178.00 178.63 2k6w s GLY 13 N -3.75 2.03 0.00 1.56 0.00 -1.26 -4.98 107.32 100.92 2k6w s GLY 13 Ca 0.06 0.19 0.17 0.00 0.00 0.00 0.00 44.72 45.14 2k6w s GLY 13 CO 0.71 0.47 1.52 -1.55 0.00 0.00 0.00 173.10 174.26 2k6w n PRO 14 N -1.80 0.07 -4.32 2.90 -0.04 -1.26 -4.68 135.00 125.87 2k6w n PRO 14 Ca 0.07 0.19 -0.31 0.00 -0.04 0.00 0.00 63.50 63.41 2k6w n PRO 14 Cb 0.54 -1.50 -0.10 0.00 -0.04 0.00 0.00 33.50 32.40 2k6w n PRO 14 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2k6w s ASN 15 N -2.87 4.67 0.23 3.54 -0.87 -1.26 -1.49 114.94 116.89 2k6w s ASN 15 Ca 0.10 -0.21 -0.06 0.00 -1.57 0.00 0.00 52.86 51.12 2k6w s ASN 15 Cb 0.11 -1.05 0.03 0.00 -0.02 0.00 0.00 41.25 40.32 2k6w s ASN 15 CO 0.29 0.23 0.42 0.00 -2.57 0.00 0.00 177.10 175.47 2k6w n ALA 16 N 1.11 -0.77 -2.53 0.60 0.00 0.40 -4.86 120.51 114.46 2k6w n ALA 16 Ca -0.14 -0.86 -0.11 0.00 0.00 0.00 0.00 53.44 52.33 2k6w n ALA 16 Cb 0.52 0.69 -0.11 0.00 0.00 0.00 0.00 19.45 20.56 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 -1.90 0.65 0.02 0.00 0.00 -1.26 -1.12 121.76 118.15 2k6w s ALA 17 Ca 0.13 -1.01 0.01 0.00 0.00 0.00 0.00 51.96 51.09 2k6w s ALA 17 Cb -0.02 0.13 -0.02 0.00 0.00 0.00 0.00 23.12 23.21 2k6w s ALA 17 CO 0.09 -0.16 -0.05 0.00 0.00 0.00 0.00 175.76 175.65 2k6w s ALA 18 N -2.52 0.30 0.01 0.00 0.00 -0.62 -1.70 121.76 117.23 2k6w s ALA 18 Ca -0.01 -0.55 -0.00 0.00 0.00 0.00 0.00 51.96 51.40 2k6w s ALA 18 Cb -0.02 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.16 2k6w s ALA 18 CO -0.03 -0.07 -0.02 0.71 0.00 0.00 0.00 175.76 176.36 2k6w s TYR 19 N -1.13 0.17 -0.04 0.00 1.51 -0.98 -1.89 117.35 114.98 2k6w s TYR 19 Ca -0.10 -0.34 -0.29 0.00 -1.01 0.00 0.00 57.07 55.33 2k6w s TYR 19 Cb -0.08 -0.12 0.09 0.00 -0.11 0.00 0.00 41.96 41.74 2k6w s TYR 19 CO -0.00 -0.13 0.80 -0.48 -1.11 0.00 0.00 175.55 174.63 2k6w s LEU 20 N -0.95 -0.50 -0.37 -1.29 2.34 -1.26 -1.04 118.68 115.62 2k6w s LEU 20 Ca -0.10 0.36 -0.29 0.00 0.06 0.00 0.00 54.13 54.15 2k6w s LEU 20 Cb -0.06 2.24 -0.00 0.00 -0.56 0.00 0.00 46.19 47.81 2k6w s LEU 20 CO -0.01 -0.59 1.54 -0.89 -1.06 0.00 0.00 176.35 175.34 2k6w s THR 21 N -2.00 3.77 -0.08 5.48 2.01 0.54 -0.64 115.64 124.72 2k6w s THR 21 Ca -0.03 0.80 -0.26 0.00 0.31 0.00 0.00 61.69 62.51 2k6w s THR 21 Cb -0.01 -4.00 -0.03 0.00 0.01 0.00 0.00 72.50 68.48 2k6w s THR 21 CO -0.00 -0.61 0.82 -0.22 -0.69 0.00 0.00 174.62 173.92 2k6w s LEU 22 N 5.79 4.28 -0.20 4.42 1.98 0.02 -4.84 118.68 130.13 2k6w s LEU 22 Ca 0.67 1.31 0.01 0.00 -2.89 0.00 0.00 54.13 53.23 2k6w s LEU 22 Cb -0.17 -3.26 0.04 0.00 0.66 0.00 0.00 46.19 43.46 2k6w s LEU 22 CO 0.32 -0.25 -0.11 -1.83 -1.89 0.00 0.00 176.35 172.59 2k6w s GLU 23 N 1.32 2.10 -0.47 1.98 -1.05 -1.26 -0.64 118.70 120.69 2k6w s GLU 23 Ca 0.42 -0.89 -0.13 0.00 -0.15 0.00 0.00 54.97 54.22 2k6w s GLU 23 Cb -0.18 -2.47 0.09 0.00 -0.44 0.00 0.00 34.13 31.13 2k6w s GLU 23 CO 0.19 -0.43 0.37 1.21 0.95 0.00 0.00 175.26 177.55 2k6w s ASN 24 N 1.36 5.96 0.00 0.83 2.47 -0.13 -4.93 114.94 120.50 2k6w s ASN 24 Ca -0.02 -1.52 0.29 0.00 0.42 0.00 0.00 52.86 52.03 2k6w s ASN 24 Cb -0.16 -2.11 1.22 0.00 -1.45 0.00 0.00 41.25 38.74 2k6w s ASN 24 CO -0.08 -0.66 1.88 -0.81 -3.72 0.00 0.00 177.10 173.72 2k6w n PRO 25 N 5.10 0.24 -1.69 0.43 -0.04 -1.26 -1.89 135.00 135.88 2k6w n PRO 25 Ca -0.12 -0.04 -0.29 0.00 -0.04 0.00 0.00 63.50 63.01 2k6w n PRO 25 Cb 0.42 -1.50 0.13 0.00 -0.04 0.00 0.00 33.50 32.51 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 -2.79 1.60 0.00 0.55 0.00 -1.26 -4.58 107.32 100.84 2k6w s GLY 26 Ca 0.20 -0.66 0.22 0.00 0.00 0.00 0.00 44.72 44.48 2k6w s GLY 26 CO 0.52 -0.09 1.21 1.22 0.00 0.00 0.00 173.10 175.96 2k6w n ASP 27 N -3.64 2.86 -4.59 1.64 8.00 -1.26 -1.52 116.55 118.04 2k6w n ASP 27 Ca 0.08 -1.92 -0.24 0.00 0.71 0.00 0.00 54.79 53.42 2k6w n ASP 27 Cb 0.60 -0.01 -0.08 0.00 -0.02 0.00 0.00 41.12 41.61 2k6w n ASP 27 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2k6w s LEU 28 N -1.83 3.01 0.49 0.64 0.05 -1.26 -4.79 118.68 114.98 2k6w s LEU 28 Ca 0.26 -0.73 -0.15 0.00 0.05 0.00 0.00 54.13 53.56 2k6w s LEU 28 Cb 0.19 -1.55 -0.08 0.00 -2.05 0.00 0.00 46.19 42.69 2k6w s LEU 28 CO 0.28 0.03 0.94 -2.16 -0.55 0.00 0.00 176.35 174.89 2k6w s PRO 29 N -3.49 3.92 0.08 1.48 0.04 -1.26 -4.00 135.00 131.77 2k6w s PRO 29 Ca 0.30 0.86 0.01 0.00 0.04 0.00 0.00 61.00 62.21 2k6w s PRO 29 Cb -0.06 -2.19 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 2k6w s PRO 29 CO 0.18 -0.22 0.18 -0.51 0.04 0.00 0.00 177.00 176.67 2k6w s LEU 30 N -4.00 4.19 -0.27 -3.56 1.43 0.08 -4.95 118.68 111.61 2k6w s LEU 30 Ca 0.57 0.17 -0.02 0.00 -1.03 0.00 0.00 54.13 53.83 2k6w s LEU 30 Cb -0.10 -2.81 0.09 0.00 0.03 0.00 0.00 46.19 43.40 2k6w s LEU 30 CO 0.31 0.16 0.08 -0.60 0.23 0.00 0.00 176.35 176.52 2k6w s ARG 31 N -2.56 0.64 -0.59 1.70 3.52 -1.26 -0.31 118.95 120.09 2k6w s ARG 31 Ca 0.33 -0.81 -0.25 0.00 -0.13 0.00 0.00 55.73 54.87 2k6w s ARG 31 Cb -0.12 -1.92 0.04 0.00 -1.56 0.00 0.00 34.95 31.39 2k6w s ARG 31 CO 0.26 -0.89 1.04 -1.17 -0.81 0.00 0.00 175.30 173.74 2k6w s LEU 32 N 1.75 3.86 0.01 -0.88 2.96 0.64 -0.62 118.68 126.40 2k6w s LEU 32 Ca 0.06 -0.29 0.22 0.00 -0.22 0.00 0.00 54.13 53.91 2k6w s LEU 32 Cb -0.17 -2.86 -0.05 0.00 0.50 0.00 0.00 46.19 43.60 2k6w s LEU 32 CO -0.22 -1.37 0.96 1.33 -1.32 0.00 0.00 176.35 175.72 2k6w n VAL 33 N 6.32 0.06 -3.19 1.68 0.24 0.71 -0.52 118.33 123.64 2k6w n VAL 33 Ca 0.03 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.18 2k6w n VAL 33 Cb 0.48 0.50 0.00 0.00 -1.47 0.00 0.00 33.84 33.34 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 1.42 -1.22 3.15 7.63 0.00 -1.16 -4.67 105.19 110.34 2k6w n GLY 34 Ca 0.02 -0.87 -0.08 0.00 0.00 0.00 0.00 46.02 45.09 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 -1.32 -3.48 4.61 0.00 -1.26 -1.08 120.51 117.99 2k6w n ALA 35 Ca 0.00 -1.13 -0.17 0.00 0.00 0.00 0.00 53.44 52.14 2k6w n ALA 35 Cb 0.00 0.90 -0.06 0.00 0.00 0.00 0.00 19.45 20.29 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 -2.18 1.00 0.00 0.00 1.81 0.19 -4.82 118.95 114.95 2k6w s ARG 36 Ca 0.15 0.19 -0.21 0.00 -1.72 0.00 0.00 55.73 54.15 2k6w s ARG 36 Cb -0.04 0.47 0.04 0.00 -0.45 0.00 0.00 34.95 34.97 2k6w s ARG 36 CO 0.11 -0.30 0.46 -0.08 -0.68 0.00 0.00 175.30 174.81 2k6w s THR 37 N -1.20 0.04 0.41 0.02 -1.32 -1.26 -0.34 115.64 111.99 2k6w s THR 37 Ca -0.11 -0.31 0.26 0.00 -1.21 0.00 0.00 61.69 60.32 2k6w s THR 37 Cb -0.01 -0.87 0.28 0.00 -1.51 0.00 0.00 72.50 70.40 2k6w s THR 37 CO 0.09 -0.17 2.06 1.55 -2.21 0.00 0.00 174.62 175.94 2k6w h PRO 38 N 3.23 0.00 0.00 7.08 0.13 -2.00 -3.26 132.00 137.17 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 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2k6w h PRO 38 CO 0.41 0.13 0.00 1.33 -0.23 0.00 0.00 178.00 179.63 2k6w n VAL 39 N -3.68 0.02 -4.05 1.56 0.24 -1.26 -4.54 118.33 106.61 2k6w n VAL 39 Ca -0.02 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.17 2k6w n VAL 39 Cb 0.24 -0.51 -0.05 0.00 -1.47 0.00 0.00 33.84 32.05 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 -2.42 0.35 0.00 2.33 0.00 -1.23 -1.52 121.76 119.27 2k6w s ALA 40 Ca 0.33 -1.25 0.00 0.00 0.00 0.00 0.00 51.96 51.04 2k6w s ALA 40 Cb 0.20 1.12 0.00 0.00 0.00 0.00 0.00 23.12 24.44 2k6w s ALA 40 CO 0.43 -0.81 0.00 -1.91 0.00 0.00 0.00 175.76 173.47 2k6w n GLU 41 N -0.47 0.00 -2.05 0.00 4.07 -0.65 -4.70 120.64 116.83 2k6w n GLU 41 Ca -0.00 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.68 2k6w n GLU 41 Cb 0.62 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.97 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 0.00 3.16 0.19 5.31 3.52 0.05 -4.79 118.95 126.39 2k6w s ARG 42 Ca 0.00 1.14 -0.24 0.00 -0.13 0.00 0.00 55.73 56.50 2k6w s ARG 42 Cb 0.00 -4.23 -0.08 0.00 -1.56 0.00 0.00 34.95 29.08 2k6w s ARG 42 CO 0.00 -2.07 0.78 0.54 -0.81 0.00 0.00 175.30 173.73 2k6w s VAL 43 N 7.35 4.40 -0.12 7.11 0.11 -1.26 -0.86 120.40 137.12 2k6w s VAL 43 Ca 0.74 1.62 -0.05 0.00 -2.93 0.00 0.00 61.98 61.36 2k6w s VAL 43 Cb -0.18 -4.07 0.06 0.00 -1.53 0.00 0.00 36.38 30.65 2k6w s VAL 43 CO 0.30 0.43 0.26 -1.61 -3.33 0.00 0.00 175.10 171.14 2k6w s GLU 44 N -1.39 0.17 -0.35 1.54 2.02 -0.48 -4.99 118.70 115.23 2k6w s GLU 44 Ca 0.38 0.66 -0.28 0.00 0.02 0.00 0.00 54.97 55.76 2k6w s GLU 44 Cb -0.21 -0.07 0.02 0.00 0.10 0.00 0.00 34.13 33.96 2k6w s GLU 44 CO 0.25 -0.23 1.01 -1.17 0.02 0.00 0.00 175.26 175.13 2k6w s LEU 45 N 1.93 3.94 0.09 1.80 0.20 -1.26 -0.39 118.68 124.99 2k6w s LEU 45 Ca -0.03 0.83 0.01 0.00 0.69 0.00 0.00 54.13 55.63 2k6w s LEU 45 Cb -0.11 -3.42 -0.04 0.00 -0.43 0.00 0.00 46.19 42.19 2k6w s LEU 45 CO -0.09 -0.88 0.23 -1.00 -0.29 0.00 0.00 176.35 174.33 2k6w s HIS 46 N 3.60 3.49 0.64 5.38 3.76 0.33 -0.71 115.29 131.79 2k6w s HIS 46 Ca 0.42 0.20 0.04 0.00 -0.15 0.00 0.00 55.06 55.57 2k6w s HIS 46 Cb -0.12 -1.72 0.10 0.00 1.11 0.00 0.00 32.58 31.95 2k6w s HIS 46 CO 0.17 0.56 0.89 -1.83 -0.85 0.00 0.00 174.74 173.68 2k6w s GLU 47 N -2.75 2.00 -0.27 1.40 -1.05 -0.26 -1.03 118.70 116.74 2k6w s GLU 47 Ca 0.35 -1.35 -0.01 0.00 -0.15 0.00 0.00 54.97 53.80 2k6w s GLU 47 Cb -0.12 -2.49 0.13 0.00 -0.44 0.00 0.00 34.13 31.21 2k6w s GLU 47 CO 0.28 -1.14 0.31 0.99 0.95 0.00 0.00 175.26 176.64 2k6w s THR 48 N -2.90 -0.44 0.15 1.83 2.01 0.41 -3.74 115.64 112.96 2k6w s THR 48 Ca 0.64 -0.36 0.08 0.00 0.31 0.00 0.00 61.69 62.36 2k6w s THR 48 Cb -0.06 -0.92 -0.04 0.00 0.01 0.00 0.00 72.50 71.49 2k6w s THR 48 CO 0.42 -0.37 -0.07 0.72 -0.69 0.00 0.00 174.62 174.63 2k6w s PHE 49 N 2.40 2.74 -0.24 4.92 -0.12 -0.44 -3.69 117.98 123.55 2k6w s PHE 49 Ca 0.09 -0.17 -0.07 0.00 -0.05 0.00 0.00 56.93 56.73 2k6w s PHE 49 Cb -0.14 -1.36 -0.03 0.00 -0.63 0.00 0.00 43.02 40.85 2k6w s PHE 49 CO -0.27 0.49 0.07 0.00 -0.05 0.00 0.00 175.22 175.46 2k6w s MET 50 N -2.67 3.72 0.22 1.99 0.23 -1.26 -1.55 119.30 119.98 2k6w s MET 50 Ca 0.25 -0.45 -0.06 0.00 -1.03 0.00 0.00 55.69 54.40 2k6w s MET 50 Cb -0.10 -3.32 -0.03 0.00 -1.53 0.00 0.00 34.83 29.86 2k6w s MET 50 CO 0.16 -0.11 0.27 1.03 -2.03 0.00 0.00 175.02 174.34 2k6w s ARG 51 N 1.41 1.35 0.00 3.16 0.52 -0.89 -4.88 118.95 119.62 2k6w s ARG 51 Ca 0.05 -1.47 -0.07 0.00 -0.52 0.00 0.00 55.73 53.72 2k6w s ARG 51 Cb -0.15 0.35 -0.05 0.00 0.52 0.00 0.00 34.95 35.63 2k6w s ARG 51 CO 0.04 -0.50 0.27 -1.21 0.02 0.00 0.00 175.30 173.93 2k6w s GLU 52 N -4.10 3.60 0.00 3.54 8.01 -1.26 -0.37 118.70 128.12 2k6w s GLU 52 Ca 0.32 -0.03 0.00 0.00 0.01 0.00 0.00 54.97 55.27 2k6w s GLU 52 Cb 0.04 -3.09 0.00 0.00 -4.31 0.00 0.00 34.13 26.77 2k6w s GLU 52 CO 0.11 0.66 0.00 0.28 0.01 0.00 0.00 175.26 176.31 2k6w n VAL 53 N 1.22 0.00 -0.90 2.63 0.31 -1.21 -4.90 118.33 115.49 2k6w n VAL 53 Ca -0.12 0.00 -0.13 0.00 -0.01 0.00 0.00 64.34 64.08 2k6w n VAL 53 Cb 0.53 -0.01 -0.14 0.00 -0.91 0.00 0.00 33.84 33.32 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 -0.23 1.89 0.00 5.55 2.13 -1.26 -4.72 120.64 124.00 2k6w n GLU 54 Ca 0.00 -0.98 0.00 0.00 0.66 0.00 0.00 57.16 56.84 2k6w n GLU 54 Cb 0.00 -2.01 0.00 0.00 0.27 0.00 0.00 31.44 29.70 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 2.67 1.12 3.84 8.31 0.00 -1.26 -4.93 105.19 114.94 2k6w n GLY 55 Ca 0.41 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.08 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 4.00 -0.11 1.61 1.02 -1.26 -4.91 119.74 120.09 2k6w s LYS 56 Ca 0.00 0.55 -0.29 0.00 0.02 0.00 0.00 55.97 56.24 2k6w s LYS 56 Cb 0.00 -2.79 -0.04 0.00 -0.52 0.00 0.00 37.83 34.48 2k6w s LYS 56 CO 0.00 0.38 1.61 0.15 -0.92 0.00 0.00 175.35 176.57 2k6w s LYS 57 N -2.29 4.09 0.03 1.68 1.02 -1.26 -3.30 119.74 119.71 2k6w s LYS 57 Ca 0.43 2.01 0.02 0.00 0.02 0.00 0.00 55.97 58.45 2k6w s LYS 57 Cb -0.14 -3.98 -0.02 0.00 -0.52 0.00 0.00 37.83 33.18 2k6w s LYS 57 CO 0.20 -0.94 -0.06 0.54 -0.92 0.00 0.00 175.35 174.16 2k6w s VAL 58 N 4.29 0.42 0.28 3.17 0.11 0.50 -4.89 120.40 124.28 2k6w s VAL 58 Ca 0.71 -0.85 -0.29 0.00 -2.93 0.00 0.00 61.98 58.62 2k6w s VAL 58 Cb -0.30 -0.48 -0.09 0.00 -1.53 0.00 0.00 36.38 33.98 2k6w s VAL 58 CO 0.28 -0.30 1.00 -0.04 -3.33 0.00 0.00 175.10 172.71 2k6w s MET 59 N -1.23 4.70 0.09 1.54 -1.94 -1.26 -2.10 119.30 119.11 2k6w s MET 59 Ca -0.08 1.57 -0.19 0.00 -1.71 0.00 0.00 55.69 55.27 2k6w s MET 59 Cb -0.08 -3.13 0.05 0.00 2.01 0.00 0.00 34.83 33.67 2k6w s MET 59 CO 0.00 0.34 0.47 0.20 -0.01 0.00 0.00 175.02 176.02 2k6w s GLY 60 N -1.17 -0.38 -0.07 -0.03 0.00 -0.59 -5.00 107.32 100.08 2k6w s GLY 60 Ca 0.45 0.30 0.03 0.00 0.00 0.00 0.00 44.72 45.49 2k6w s GLY 60 CO 0.34 0.01 -0.15 1.06 0.00 0.00 0.00 173.10 174.36 2k6w s MET 61 N -3.17 2.70 0.05 2.90 -1.94 -1.26 -1.32 119.30 117.25 2k6w s MET 61 Ca -0.01 -0.71 -0.11 0.00 -1.71 0.00 0.00 55.69 53.14 2k6w s MET 61 Cb 0.00 -2.41 0.01 0.00 2.01 0.00 0.00 34.83 34.44 2k6w s MET 61 CO -0.07 0.51 0.24 1.03 -0.01 0.00 0.00 175.02 176.72 2k6w s ARG 62 N -0.45 0.77 0.48 2.03 0.52 -1.25 -5.01 118.95 116.05 2k6w s ARG 62 Ca 0.05 -0.63 -0.23 0.00 -0.52 0.00 0.00 55.73 54.40 2k6w s ARG 62 Cb -0.12 0.32 -0.07 0.00 0.52 0.00 0.00 34.95 35.61 2k6w s ARG 62 CO 0.02 -0.24 1.27 -1.25 0.02 0.00 0.00 175.30 175.11 2k6w s PRO 63 N -2.78 3.57 0.24 3.54 0.04 -1.26 -1.10 135.00 137.25 2k6w s PRO 63 Ca -0.03 2.02 0.08 0.00 0.04 0.00 0.00 61.00 63.11 2k6w s PRO 63 Cb -0.00 -2.42 -0.04 0.00 0.04 0.00 0.00 34.50 32.08 2k6w s PRO 63 CO -0.05 -0.78 0.07 0.14 0.04 0.00 0.00 177.00 176.43 2k6w s VAL 64 N -1.40 3.89 -0.46 -0.36 -7.23 0.11 -4.85 120.40 110.10 2k6w s VAL 64 Ca 0.65 -1.63 0.25 0.00 -1.81 0.00 0.00 61.98 59.44 2k6w s VAL 64 Cb -0.35 -3.07 0.26 0.00 0.56 0.00 0.00 36.38 33.79 2k6w s VAL 64 CO 0.42 -0.32 1.74 1.55 -0.31 0.00 0.00 175.10 178.19 2k6w h PRO 65 N 1.88 0.00 -1.43 4.82 0.13 -1.94 -3.42 132.00 132.04 2k6w h PRO 65 Ca -0.46 0.00 0.27 0.00 -0.87 0.00 0.00 66.00 64.94 2k6w h PRO 65 Cb 1.24 0.00 -0.19 0.00 0.13 0.00 0.00 31.00 32.18 2k6w h PRO 65 CO 0.60 0.00 0.83 -0.59 -0.23 0.00 0.00 178.00 178.61 2k6w s PHE 66 N -3.32 -0.11 0.50 1.56 -0.12 -1.26 -4.71 117.98 110.52 2k6w s PHE 66 Ca 0.05 0.06 0.06 0.00 -0.05 0.00 0.00 56.93 57.05 2k6w s PHE 66 Cb 0.10 0.52 0.02 0.00 -0.63 0.00 0.00 43.02 43.02 2k6w s PHE 66 CO 0.43 -0.19 0.37 -0.51 -0.05 0.00 0.00 175.22 175.27 2k6w s LEU 67 N -2.22 2.87 0.23 -1.99 1.43 0.33 -4.99 118.68 114.34 2k6w s LEU 67 Ca 0.10 -1.14 -0.15 0.00 -1.03 0.00 0.00 54.13 51.91 2k6w s LEU 67 Cb -0.01 -1.37 0.01 0.00 0.03 0.00 0.00 46.19 44.85 2k6w s LEU 67 CO -0.04 -0.95 0.51 -1.83 0.23 0.00 0.00 176.35 174.26 2k6w s GLU 68 N -4.20 1.51 -0.14 1.70 -1.05 -1.26 -0.26 118.70 114.99 2k6w s GLU 68 Ca 0.37 -1.11 -0.11 0.00 -0.15 0.00 0.00 54.97 53.97 2k6w s GLU 68 Cb -0.02 0.49 0.04 0.00 -0.44 0.00 0.00 34.13 34.21 2k6w s GLU 68 CO 0.22 -0.63 0.35 0.08 0.95 0.00 0.00 175.26 176.23 2k6w s VAL 69 N -3.96 -0.01 0.92 1.83 1.01 0.58 -4.93 120.40 115.83 2k6w s VAL 69 Ca 0.17 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 62.07 2k6w s VAL 69 Cb -0.01 -0.51 0.14 0.00 0.00 0.00 0.00 36.38 36.00 2k6w s VAL 69 CO 0.05 0.02 1.11 -2.16 0.00 0.00 0.00 175.10 174.11 2k6w s PRO 70 N 0.60 1.07 0.52 2.72 0.04 -1.26 -0.74 135.00 137.95 2k6w s PRO 70 Ca -0.03 0.52 -0.23 0.00 0.04 0.00 0.00 61.00 61.30 2k6w s PRO 70 Cb -0.05 -1.81 -0.06 0.00 0.04 0.00 0.00 34.50 32.62 2k6w s PRO 70 CO -0.04 -2.29 1.38 -1.25 0.04 0.00 0.00 177.00 174.84 2k6w s PRO 71 N -5.09 3.30 0.00 0.56 0.04 -1.26 -2.66 135.00 129.90 2k6w s PRO 71 Ca 0.64 2.30 0.00 0.00 0.04 0.00 0.00 61.00 63.97 2k6w s PRO 71 Cb -0.17 -2.38 0.00 0.00 0.04 0.00 0.00 34.50 32.00 2k6w s PRO 71 CO 0.56 -1.08 0.00 1.17 0.04 0.00 0.00 177.00 177.68 2k6w n LYS 72 N -0.78 -0.17 -2.59 4.56 3.00 -0.58 -4.94 118.16 116.67 2k6w n LYS 72 Ca 0.09 0.04 -0.43 0.00 -0.00 0.00 0.00 58.31 58.01 2k6w n LYS 72 Cb 0.44 -4.42 -0.02 0.00 0.00 0.00 0.00 35.03 31.03 2k6w n LYS 72 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2k6w s GLY 73 N -2.00 1.43 0.19 3.14 0.00 -1.09 -4.80 107.32 104.20 2k6w s GLY 73 Ca 0.00 -0.17 -0.28 0.00 0.00 0.00 0.00 44.72 44.27 2k6w s GLY 73 CO 0.00 2.38 0.87 -1.60 0.00 0.00 0.00 173.10 174.74 2k6w s ARG 74 N 4.02 4.71 -0.17 2.90 3.52 -1.26 -0.96 118.95 131.71 2k6w s ARG 74 Ca 0.48 1.33 -0.09 0.00 -0.13 0.00 0.00 55.73 57.32 2k6w s ARG 74 Cb -0.11 -3.29 0.06 0.00 -1.56 0.00 0.00 34.95 30.05 2k6w s ARG 74 CO 0.22 0.50 0.41 0.14 -0.81 0.00 0.00 175.30 175.76 2k6w s VAL 75 N -1.01 -0.02 -0.10 7.11 -7.23 0.19 -5.01 120.40 114.33 2k6w s VAL 75 Ca 0.39 0.09 -0.20 0.00 -1.81 0.00 0.00 61.98 60.46 2k6w s VAL 75 Cb -0.24 -0.60 -0.04 0.00 0.56 0.00 0.00 36.38 36.05 2k6w s VAL 75 CO 0.29 0.04 0.54 -1.61 -0.31 0.00 0.00 175.10 174.04 2k6w s GLU 76 N 1.34 4.36 0.09 4.82 8.01 -1.26 -0.80 118.70 135.26 2k6w s GLU 76 Ca -0.09 0.57 -0.31 0.00 0.01 0.00 0.00 54.97 55.15 2k6w s GLU 76 Cb -0.08 -3.43 -0.07 0.00 -4.31 0.00 0.00 34.13 26.23 2k6w s GLU 76 CO -0.12 0.15 1.38 -0.51 0.01 0.00 0.00 175.26 176.17 2k6w s LEU 77 N 0.60 4.36 -0.04 1.80 1.02 0.19 -4.90 118.68 121.71 2k6w s LEU 77 Ca 0.29 2.26 -0.04 0.00 0.02 0.00 0.00 54.13 56.66 2k6w s LEU 77 Cb -0.16 -3.58 0.01 0.00 0.02 0.00 0.00 46.19 42.48 2k6w s LEU 77 CO 0.13 -0.65 0.12 -1.59 0.02 0.00 0.00 176.35 174.37 2k6w s LYS 78 N 1.32 0.16 0.39 1.70 -2.85 -0.17 -3.99 119.74 116.30 2k6w s LYS 78 Ca 0.64 0.12 0.28 0.00 -1.00 0.00 0.00 55.97 56.01 2k6w s LYS 78 Cb -0.35 0.07 1.26 0.00 -2.06 0.00 0.00 37.83 36.75 2k6w s LYS 78 CO 0.30 -0.02 1.85 -1.00 0.10 0.00 0.00 175.35 176.57 2k6w h PRO 79 N 5.85 0.00 -4.21 1.78 0.13 -1.96 -0.37 132.00 133.22 2k6w h PRO 79 Ca -0.25 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 64.14 2k6w h PRO 79 Cb 1.20 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.06 2k6w h PRO 79 CO 0.43 0.00 -0.32 0.20 -0.23 0.00 0.00 178.00 178.08 2k6w s GLY 80 N -3.79 2.06 0.00 1.56 0.00 -1.26 -4.77 107.32 101.12 2k6w s GLY 80 Ca 0.01 -2.54 0.00 0.00 0.00 0.00 0.00 44.72 42.20 2k6w s GLY 80 CO 0.41 1.15 0.00 0.61 0.00 0.00 0.00 173.10 175.27 2k6w n GLY 81 N 5.05 0.83 3.44 0.20 0.00 -1.05 -5.03 105.19 108.62 2k6w n GLY 81 Ca -0.10 -0.20 -0.15 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.55 0.10 1.61 2.02 -0.17 -0.44 117.35 119.91 2k6w s TYR 82 Ca 0.00 1.20 -0.25 0.00 -0.37 0.00 0.00 57.07 57.65 2k6w s TYR 82 Cb 0.00 0.24 0.07 0.00 -0.40 0.00 0.00 41.96 41.88 2k6w s TYR 82 CO 0.00 -0.39 0.65 -3.38 -1.57 0.00 0.00 175.55 170.86 2k6w s HIS 83 N -0.35 -0.54 -0.10 2.71 -3.43 -0.20 -1.00 115.29 112.38 2k6w s HIS 83 Ca -0.05 0.47 -0.15 0.00 -0.80 0.00 0.00 55.06 54.52 2k6w s HIS 83 Cb -0.03 0.53 -0.05 0.00 -1.43 0.00 0.00 32.58 31.60 2k6w s HIS 83 CO 0.04 -0.77 0.37 -0.06 -2.00 0.00 0.00 174.74 172.32 2k6w s PHE 84 N -3.18 3.55 0.01 0.38 0.08 -0.79 -0.51 117.98 117.52 2k6w s PHE 84 Ca -0.01 0.78 -0.18 0.00 0.12 0.00 0.00 56.93 57.64 2k6w s PHE 84 Cb -0.01 -2.37 -0.06 0.00 -0.57 0.00 0.00 43.02 40.01 2k6w s PHE 84 CO -0.08 0.34 0.52 -1.64 -0.10 0.00 0.00 175.22 174.26 2k6w s MET 85 N 0.05 4.18 -0.10 0.44 -1.94 0.48 -1.59 119.30 120.82 2k6w s MET 85 Ca 0.21 0.61 0.02 0.00 -1.71 0.00 0.00 55.69 54.82 2k6w s MET 85 Cb -0.15 -3.29 0.01 0.00 2.01 0.00 0.00 34.83 33.42 2k6w s MET 85 CO 0.08 0.51 -0.16 -0.51 -0.01 0.00 0.00 175.02 174.93 2k6w s LEU 86 N -0.60 1.78 0.05 -0.03 2.01 -0.27 -1.38 118.68 120.24 2k6w s LEU 86 Ca 0.28 -0.44 0.05 0.00 0.01 0.00 0.00 54.13 54.03 2k6w s LEU 86 Cb -0.18 -1.11 -0.02 0.00 0.01 0.00 0.00 46.19 44.89 2k6w s LEU 86 CO 0.16 0.04 -0.14 -0.22 1.01 0.00 0.00 176.35 177.20 2k6w s LEU 87 N 0.85 2.21 -0.32 1.79 0.20 -0.04 -0.45 118.68 122.92 2k6w s LEU 87 Ca -0.09 -0.52 -0.01 0.00 0.69 0.00 0.00 54.13 54.19 2k6w s LEU 87 Cb -0.15 -0.56 -0.02 0.00 -0.43 0.00 0.00 46.19 45.03 2k6w s LEU 87 CO 0.00 -0.01 0.28 0.61 -0.29 0.00 0.00 176.35 176.94 2k6w n GLY 88 N 1.65 0.27 3.66 7.98 0.00 -0.56 -0.77 105.19 117.43 2k6w n GLY 88 Ca -0.19 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.33 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 -3.63 4.35 0.00 0.99 1.43 -1.23 -2.36 118.68 118.23 2k6w s LEU 89 Ca 0.11 2.37 0.24 0.00 -1.03 0.00 0.00 54.13 55.81 2k6w s LEU 89 Cb -0.01 -3.54 1.02 0.00 0.03 0.00 0.00 46.19 43.69 2k6w s LEU 89 CO 0.22 -0.95 1.76 0.29 0.23 0.00 0.00 176.35 177.90 2k6w n LYS 90 N 7.08 0.02 -3.63 1.70 5.02 -0.57 -4.83 118.16 122.93 2k6w n LYS 90 Ca 0.18 0.09 -0.04 0.00 -2.02 0.00 0.00 58.31 56.52 2k6w n LYS 90 Cb 0.42 -1.50 -0.06 0.00 -0.02 0.00 0.00 35.03 33.87 2k6w n LYS 90 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 2k6w s ARG 91 N -2.98 0.19 0.63 1.97 1.04 -1.26 -5.03 118.95 113.51 2k6w s ARG 91 Ca 0.12 0.13 -0.16 0.00 -1.04 0.00 0.00 55.73 54.78 2k6w s ARG 91 Cb 0.15 0.09 -0.01 0.00 -2.04 0.00 0.00 34.95 33.14 2k6w s ARG 91 CO 0.43 -0.04 1.11 -1.25 -0.04 0.00 0.00 175.30 175.50 2k6w s PRO 92 N -0.49 2.96 0.29 3.89 0.04 -1.26 -4.94 135.00 135.49 2k6w s PRO 92 Ca 0.06 1.40 0.08 0.00 0.04 0.00 0.00 61.00 62.58 2k6w s PRO 92 Cb -0.03 -1.97 -0.04 0.00 0.04 0.00 0.00 34.50 32.50 2k6w s PRO 92 CO -0.09 -1.12 0.13 -0.51 0.04 0.00 0.00 177.00 175.45 2k6w s LEU 93 N -4.64 3.44 -0.15 -3.56 1.02 -1.26 -5.10 118.68 108.42 2k6w s LEU 93 Ca 0.67 -0.55 -0.00 0.00 0.02 0.00 0.00 54.13 54.27 2k6w s LEU 93 Cb -0.20 -1.97 -0.01 0.00 0.02 0.00 0.00 46.19 44.03 2k6w s LEU 93 CO 0.38 -0.14 -0.13 -0.54 0.02 0.00 0.00 176.35 175.95 2k6w s LYS 94 N -3.81 3.32 -0.04 1.70 3.01 -1.26 -4.94 119.74 117.72 2k6w s LYS 94 Ca 0.35 -0.70 -0.30 0.00 -1.01 0.00 0.00 55.97 54.30 2k6w s LYS 94 Cb -0.06 -2.67 -0.08 0.00 -1.01 0.00 0.00 37.83 34.01 2k6w s LYS 94 CO 0.23 0.09 2.03 0.00 0.51 0.00 0.00 175.35 178.21 2k6w n ALA 95 N 3.88 1.56 0.00 5.17 0.00 -1.26 -0.92 120.51 128.95 2k6w n ALA 95 Ca -0.18 0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.36 2k6w n ALA 95 Cb 0.52 -2.72 0.00 0.00 0.00 0.00 0.00 19.45 17.25 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 4.87 0.76 3.87 0.00 0.00 -1.21 -5.04 105.19 108.43 2k6w n GLY 96 Ca 0.23 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.49 3.31 0.21 1.61 2.02 -0.09 -4.94 118.70 120.32 2k6w s GLU 97 Ca 0.00 0.70 0.08 0.00 0.02 0.00 0.00 54.97 55.77 2k6w s GLU 97 Cb 0.00 -2.05 -0.04 0.00 0.10 0.00 0.00 34.13 32.14 2k6w s GLU 97 CO 0.00 -0.76 0.02 -1.21 0.02 0.00 0.00 175.26 173.33 2k6w s GLU 98 N -5.21 2.42 -0.12 1.61 2.02 -1.26 -0.37 118.70 117.79 2k6w s GLU 98 Ca 0.56 -1.20 0.02 0.00 0.02 0.00 0.00 54.97 54.37 2k6w s GLU 98 Cb -0.11 -2.32 0.01 0.00 0.10 0.00 0.00 34.13 31.81 2k6w s GLU 98 CO 0.54 0.42 -0.17 0.08 0.02 0.00 0.00 175.26 176.14 2k6w s VAL 99 N -1.96 1.68 0.40 2.63 1.01 0.73 -4.89 120.40 119.99 2k6w s VAL 99 Ca 0.29 -0.75 -0.24 0.00 0.00 0.00 0.00 61.98 61.28 2k6w s VAL 99 Cb -0.08 -1.52 -0.09 0.00 0.00 0.00 0.00 36.38 34.69 2k6w s VAL 99 CO 0.20 0.48 1.06 -1.61 0.00 0.00 0.00 175.10 175.23 2k6w s GLU 100 N 0.94 4.13 -0.22 2.72 2.02 -1.26 -1.96 118.70 125.08 2k6w s GLU 100 Ca -0.06 1.55 -0.11 0.00 0.02 0.00 0.00 54.97 56.37 2k6w s GLU 100 Cb -0.15 -2.55 0.08 0.00 0.10 0.00 0.00 34.13 31.61 2k6w s GLU 100 CO -0.02 -0.18 0.52 -1.17 0.02 0.00 0.00 175.26 174.43 2k6w s LEU 101 N -2.65 -0.57 -0.44 1.80 0.20 -0.23 -4.30 118.68 112.49 2k6w s LEU 101 Ca 0.58 1.17 -0.21 0.00 0.69 0.00 0.00 54.13 56.36 2k6w s LEU 101 Cb -0.23 1.74 0.02 0.00 -0.43 0.00 0.00 46.19 47.30 2k6w s LEU 101 CO 0.29 -0.22 0.66 -1.81 -0.29 0.00 0.00 176.35 174.98 2k6w s ASP 102 N 1.90 6.33 -0.26 3.68 1.01 0.54 -0.45 116.67 129.43 2k6w s ASP 102 Ca -0.08 -0.32 -0.27 0.00 0.71 0.00 0.00 52.55 52.59 2k6w s ASP 102 Cb -0.09 -2.33 0.00 0.00 1.01 0.00 0.00 42.92 41.52 2k6w s ASP 102 CO -0.15 -0.80 0.93 -0.76 0.21 0.00 0.00 175.17 174.60 2k6w s LEU 103 N 2.88 4.06 -0.42 1.23 1.43 0.10 -0.64 118.68 127.32 2k6w s LEU 103 Ca 0.23 1.10 -0.22 0.00 -1.03 0.00 0.00 54.13 54.21 2k6w s LEU 103 Cb -0.14 -3.34 0.02 0.00 0.03 0.00 0.00 46.19 42.76 2k6w s LEU 103 CO 0.19 -0.64 0.71 -0.76 0.23 0.00 0.00 176.35 176.09 2k6w s LEU 104 N 3.10 4.33 -0.19 1.79 1.43 -0.24 -2.10 118.68 126.81 2k6w s LEU 104 Ca 0.39 -0.11 -0.03 0.00 -1.03 0.00 0.00 54.13 53.35 2k6w s LEU 104 Cb -0.15 -2.86 -0.01 0.00 0.03 0.00 0.00 46.19 43.21 2k6w s LEU 104 CO 0.09 -0.80 -0.06 -0.36 0.23 0.00 0.00 176.35 175.45 2k6w s PHE 105 N 3.01 2.93 -1.42 0.29 0.08 0.24 -0.21 117.98 122.90 2k6w s PHE 105 Ca 0.26 -0.76 -0.16 0.00 0.12 0.00 0.00 56.93 56.39 2k6w s PHE 105 Cb -0.13 -2.02 0.16 0.00 -0.57 0.00 0.00 43.02 40.46 2k6w s PHE 105 CO 0.20 -0.38 0.51 0.00 -0.10 0.00 0.00 175.22 175.45 2k6w n ALA 106 N 4.28 -1.15 -0.06 5.36 0.00 0.21 -1.66 120.51 127.48 2k6w n ALA 106 Ca -0.18 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.18 2k6w n ALA 106 Cb 0.52 -2.40 0.00 0.00 0.00 0.00 0.00 19.45 17.56 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 -1.04 1.83 0.12 0.00 0.00 -1.26 -4.60 105.19 100.24 2k6w n GLY 107 Ca 0.07 0.05 -0.03 0.00 0.00 0.00 0.00 46.02 46.10 2k6w n GLY 107 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2k6w h GLY 108 N 0.00 0.02 -7.45 -0.02 0.00 -1.94 -3.37 103.07 90.31 2k6w h GLY 108 Ca 0.00 -0.03 -0.66 0.00 0.00 0.00 0.00 47.33 46.64 2k6w h GLY 108 CO 0.00 0.02 1.45 1.25 0.00 0.00 0.00 176.54 179.27 2k6w s LYS 109 N -3.35 3.75 -0.44 4.80 2.20 -0.67 -4.95 119.74 121.09 2k6w s LYS 109 Ca -0.01 -1.69 -0.15 0.00 -0.36 0.00 0.00 55.97 53.77 2k6w s LYS 109 Cb 0.12 -5.24 0.05 0.00 -1.51 0.00 0.00 37.83 31.25 2k6w s LYS 109 CO 0.78 -2.04 0.34 0.54 -0.36 0.00 0.00 175.35 174.61 2k6w s VAL 110 N 3.72 5.11 -0.11 4.02 0.11 -1.26 -0.59 120.40 131.41 2k6w s VAL 110 Ca 0.44 -0.96 0.02 0.00 -2.93 0.00 0.00 61.98 58.55 2k6w s VAL 110 Cb -0.01 -3.98 0.01 0.00 -1.53 0.00 0.00 36.38 30.87 2k6w s VAL 110 CO -0.05 -0.47 -0.15 -0.76 -3.33 0.00 0.00 175.10 170.34 2k6w s LEU 111 N 1.63 1.74 0.16 2.54 2.01 -0.89 -4.91 118.68 120.96 2k6w s LEU 111 Ca 0.04 -0.43 -0.26 0.00 0.01 0.00 0.00 54.13 53.49 2k6w s LEU 111 Cb -0.22 -1.09 -0.08 0.00 0.01 0.00 0.00 46.19 44.81 2k6w s LEU 111 CO 0.07 0.02 0.82 -1.59 1.01 0.00 0.00 176.35 176.68 2k6w s LYS 112 N 0.94 4.62 0.41 1.70 -2.85 -1.26 -0.72 119.74 122.59 2k6w s LYS 112 Ca -0.07 1.23 0.08 0.00 -1.00 0.00 0.00 55.97 56.20 2k6w s LYS 112 Cb -0.15 -3.28 -0.02 0.00 -2.06 0.00 0.00 37.83 32.32 2k6w s LYS 112 CO -0.01 0.51 0.40 0.14 0.10 0.00 0.00 175.35 176.49 2k6w s VAL 113 N -0.96 2.79 -0.02 1.79 -7.23 0.41 -4.95 120.40 112.24 2k6w s VAL 113 Ca 0.38 -1.30 0.05 0.00 -1.81 0.00 0.00 61.98 59.30 2k6w s VAL 113 Cb -0.23 -3.02 -0.01 0.00 0.56 0.00 0.00 36.38 33.67 2k6w s VAL 113 CO 0.27 -0.02 -0.17 0.54 -0.31 0.00 0.00 175.10 175.41 2k6w s VAL 114 N -2.44 1.37 -0.03 1.32 0.11 -1.26 -1.07 120.40 118.40 2k6w s VAL 114 Ca 0.48 -0.73 -0.09 0.00 -2.93 0.00 0.00 61.98 58.71 2k6w s VAL 114 Cb -0.04 -1.15 0.01 0.00 -1.53 0.00 0.00 36.38 33.67 2k6w s VAL 114 CO 0.28 0.39 0.20 -0.76 -3.33 0.00 0.00 175.10 171.88 2k6w s LEU 115 N -0.33 1.29 0.72 2.54 1.43 -0.83 -4.90 118.68 118.59 2k6w s LEU 115 Ca 0.05 0.10 -0.12 0.00 -1.03 0.00 0.00 54.13 53.13 2k6w s LEU 115 Cb -0.07 0.80 0.03 0.00 0.03 0.00 0.00 46.19 46.97 2k6w s LEU 115 CO -0.00 -0.26 1.09 -2.16 0.23 0.00 0.00 176.35 175.24 2k6w s PRO 116 N -0.76 2.61 -0.10 1.29 0.04 -1.26 -0.20 135.00 136.62 2k6w s PRO 116 Ca -0.08 1.18 -0.14 0.00 0.04 0.00 0.00 61.00 62.00 2k6w s PRO 116 Cb -0.05 -1.94 -0.05 0.00 0.04 0.00 0.00 34.50 32.51 2k6w s PRO 116 CO 0.01 -1.38 0.32 0.08 0.04 0.00 0.00 177.00 176.08 2k6w s VAL 117 N -2.76 5.24 0.08 -0.36 1.01 0.50 -0.95 120.40 123.16 2k6w s VAL 117 Ca 0.62 0.63 -0.01 0.00 0.00 0.00 0.00 61.98 63.21 2k6w s VAL 117 Cb -0.17 -3.64 0.01 0.00 0.00 0.00 0.00 36.38 32.57 2k6w s VAL 117 CO 0.51 0.47 0.13 -1.84 0.00 0.00 0.00 175.10 174.37 2k6w n GLU 118 N 2.82 0.19 -4.22 2.72 0.28 -1.16 -3.35 120.64 117.92 2k6w n GLU 118 Ca -0.13 -0.59 -0.25 0.00 -0.16 0.00 0.00 57.16 56.03 2k6w n GLU 118 Cb 0.52 0.61 -0.17 0.00 1.43 0.00 0.00 31.44 33.84 2k6w n GLU 118 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2k6w s ALA 119 N -1.64 1.26 0.00 -1.84 0.00 -1.26 -0.50 121.76 117.77 2k6w s ALA 119 Ca 0.06 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 51.56 2k6w s ALA 119 Cb -0.01 -0.73 0.00 0.00 0.00 0.00 0.00 23.12 22.38 2k6w s ALA 119 CO 0.04 -0.16 0.00 -2.13 0.00 0.00 0.00 175.76 173.51