#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6w s SER 2 N 0.00 -0.41 0.00 1.61 0.01 -1.26 -5.01 113.70 108.64 2k6w s SER 2 Ca 0.00 -0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.06 2k6w s SER 2 Cb 0.00 0.57 0.00 0.00 0.21 0.00 0.00 66.02 66.80 2k6w s SER 2 CO 0.00 -0.97 0.47 0.49 0.41 0.00 0.00 173.24 173.64 2k6w n PHE 3 N -0.34 0.00 -0.93 2.43 3.72 -1.26 -4.92 117.46 116.17 2k6w n PHE 3 Ca -0.15 -0.18 0.12 0.00 -0.05 0.00 0.00 57.45 57.19 2k6w n PHE 3 Cb 0.64 -0.14 -0.03 0.00 -0.94 0.00 0.00 39.48 39.01 2k6w n PHE 3 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2k6w n THR 4 N 0.54 0.00 -2.53 4.37 -2.24 -1.26 -4.66 114.28 108.50 2k6w n THR 4 Ca 0.00 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.76 2k6w n THR 4 Cb 0.23 -0.30 0.05 0.00 -2.10 0.00 0.00 70.33 68.22 2k6w n THR 4 CO 0.00 0.00 0.00 -1.84 -0.57 0.00 0.00 175.07 172.66 2k6w n GLU 5 N -2.78 0.95 -1.82 -0.78 0.00 -1.26 -5.02 120.64 109.92 2k6w n GLU 5 Ca 0.01 -1.77 -0.29 0.00 0.00 0.00 0.00 57.16 55.10 2k6w n GLU 5 Cb 0.40 -0.06 0.16 0.00 0.00 0.00 0.00 31.44 31.93 2k6w n GLU 5 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 2k6w s GLY 6 N -1.81 1.69 0.11 -1.84 0.00 -1.26 -4.71 107.32 99.50 2k6w s GLY 6 Ca 0.14 -0.95 -0.18 0.00 0.00 0.00 0.00 44.72 43.73 2k6w s GLY 6 CO -0.08 -0.28 0.45 0.66 0.00 0.00 0.00 173.10 173.85 2k6w s TRP 7 N -3.67 -0.30 0.05 1.90 -2.14 -1.17 -4.22 118.94 109.40 2k6w s TRP 7 Ca 0.69 0.08 0.06 0.00 2.66 0.00 0.00 56.10 59.58 2k6w s TRP 7 Cb -0.08 0.31 -0.04 0.00 -3.10 0.00 0.00 33.47 30.57 2k6w s TRP 7 CO 0.52 -0.70 -0.11 0.08 -2.66 0.00 0.00 176.95 174.07 2k6w s VAL 8 N -3.46 3.29 0.26 -0.66 1.01 -0.14 -2.23 120.40 118.47 2k6w s VAL 8 Ca 0.01 -1.07 -0.30 0.00 0.00 0.00 0.00 61.98 60.62 2k6w s VAL 8 Cb 0.01 -2.46 -0.09 0.00 0.00 0.00 0.00 36.38 33.84 2k6w s VAL 8 CO -0.10 0.28 1.02 -0.60 0.00 0.00 0.00 175.10 175.71 2k6w s ARG 9 N -1.69 4.74 -0.03 2.72 3.52 -1.16 -2.84 118.95 124.20 2k6w s ARG 9 Ca 0.18 1.65 -0.38 0.00 -0.13 0.00 0.00 55.73 57.05 2k6w s ARG 9 Cb -0.11 -3.22 -0.17 0.00 -1.56 0.00 0.00 34.95 29.89 2k6w s ARG 9 CO 0.09 0.35 1.42 0.34 -0.81 0.00 0.00 175.30 176.70 2k6w n PHE 10 N 1.31 1.57 -3.15 5.12 7.35 0.28 -4.79 117.46 125.16 2k6w n PHE 10 Ca -0.01 0.67 0.05 0.00 -0.76 0.00 0.00 57.45 57.40 2k6w n PHE 10 Cb 0.46 -2.34 -0.01 0.00 0.35 0.00 0.00 39.48 37.94 2k6w n PHE 10 CO 0.00 0.00 0.00 0.45 -0.76 0.00 0.00 176.76 176.45 2k6w s SER 11 N 1.29 -0.41 -0.09 -2.13 0.15 -0.08 -4.92 113.70 107.51 2k6w s SER 11 Ca 0.89 0.17 0.06 0.00 0.70 0.00 0.00 55.95 57.77 2k6w s SER 11 Cb -1.03 1.31 0.33 0.00 -1.71 0.00 0.00 66.02 64.91 2k6w s SER 11 CO 0.54 -0.08 1.02 -0.81 1.20 0.00 0.00 173.24 175.12 2k6w n PRO 12 N 5.33 2.51 -0.32 5.44 -0.04 -1.26 -1.17 135.00 145.51 2k6w n PRO 12 Ca -0.01 -1.26 0.00 0.00 -0.04 0.00 0.00 63.50 62.19 2k6w n PRO 12 Cb 0.55 -1.77 0.00 0.00 -0.04 0.00 0.00 33.50 32.25 2k6w n PRO 12 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k6w n GLY 13 N 0.31 0.79 0.24 0.55 0.00 -1.26 -4.91 105.19 100.91 2k6w n GLY 13 Ca 0.11 -1.91 0.15 0.00 0.00 0.00 0.00 46.02 44.37 2k6w n GLY 13 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k6w h PRO 14 N 0.00 0.00 -3.94 1.61 0.13 -1.96 -3.43 132.00 124.40 2k6w h PRO 14 Ca 0.00 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 65.02 2k6w h PRO 14 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 2k6w h PRO 14 CO 0.00 0.00 -0.36 0.54 -0.23 0.00 0.00 178.00 177.95 2k6w s ASN 15 N -5.70 0.07 0.38 1.44 4.22 -1.26 -1.52 114.94 112.58 2k6w s ASN 15 Ca 0.04 -0.90 -0.09 0.00 -2.14 0.00 0.00 52.86 49.76 2k6w s ASN 15 Cb 0.08 0.42 0.04 0.00 1.28 0.00 0.00 41.25 43.06 2k6w s ASN 15 CO 0.57 -0.87 0.67 0.00 -2.04 0.00 0.00 177.10 175.43 2k6w n ALA 16 N -0.20 -1.15 -2.89 3.54 0.00 -0.44 -4.89 120.51 114.48 2k6w n ALA 16 Ca -0.07 -1.45 -0.25 0.00 0.00 0.00 0.00 53.44 51.66 2k6w n ALA 16 Cb 0.63 1.16 -0.16 0.00 0.00 0.00 0.00 19.45 21.08 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 -2.41 1.47 -0.24 0.00 0.00 -1.26 -0.75 121.76 118.58 2k6w s ALA 17 Ca 0.22 -0.67 -0.13 0.00 0.00 0.00 0.00 51.96 51.39 2k6w s ALA 17 Cb -0.03 -0.48 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 2k6w s ALA 17 CO 0.16 0.27 0.28 0.00 0.00 0.00 0.00 175.76 176.47 2k6w s ALA 18 N 0.02 3.58 0.30 0.00 0.00 -0.37 -3.00 121.76 122.28 2k6w s ALA 18 Ca -0.03 -0.77 -0.05 0.00 0.00 0.00 0.00 51.96 51.11 2k6w s ALA 18 Cb -0.11 -2.51 -0.05 0.00 0.00 0.00 0.00 23.12 20.45 2k6w s ALA 18 CO 0.02 -0.34 0.56 0.71 0.00 0.00 0.00 175.76 176.71 2k6w s TYR 19 N 1.38 3.48 -0.28 0.00 2.02 -0.95 -1.38 117.35 121.62 2k6w s TYR 19 Ca 0.13 0.65 -0.22 0.00 -0.37 0.00 0.00 57.07 57.25 2k6w s TYR 19 Cb -0.15 -2.11 0.12 0.00 -0.40 0.00 0.00 41.96 39.42 2k6w s TYR 19 CO 0.07 0.15 0.95 -0.48 -1.57 0.00 0.00 175.55 174.68 2k6w s LEU 20 N -3.60 -0.54 0.40 -1.29 0.05 -1.21 -3.02 118.68 109.47 2k6w s LEU 20 Ca 0.44 0.98 -0.22 0.00 0.05 0.00 0.00 54.13 55.38 2k6w s LEU 20 Cb -0.11 1.97 -0.10 0.00 -2.05 0.00 0.00 46.19 45.90 2k6w s LEU 20 CO 0.30 -0.16 0.96 -0.89 -0.55 0.00 0.00 176.35 176.01 2k6w s THR 21 N 0.63 4.26 -0.19 5.48 2.01 -1.26 -0.50 115.64 126.07 2k6w s THR 21 Ca -0.01 1.54 -0.19 0.00 0.31 0.00 0.00 61.69 63.34 2k6w s THR 21 Cb -0.05 -3.70 0.05 0.00 0.01 0.00 0.00 72.50 68.81 2k6w s THR 21 CO -0.09 -0.17 0.54 -0.22 -0.69 0.00 0.00 174.62 173.99 2k6w s LEU 22 N -2.87 -0.07 -0.07 4.42 1.98 -0.23 -4.56 118.68 117.27 2k6w s LEU 22 Ca 0.59 1.03 -0.04 0.00 -2.89 0.00 0.00 54.13 52.82 2k6w s LEU 22 Cb -0.13 1.88 0.03 0.00 0.66 0.00 0.00 46.19 48.63 2k6w s LEU 22 CO 0.17 -0.22 0.17 -1.83 -1.89 0.00 0.00 176.35 172.75 2k6w s GLU 23 N 0.13 0.14 -0.44 1.98 -1.05 -1.26 -0.37 118.70 117.83 2k6w s GLU 23 Ca -0.01 0.36 -0.20 0.00 -0.15 0.00 0.00 54.97 54.97 2k6w s GLU 23 Cb -0.04 -0.10 0.03 0.00 -0.44 0.00 0.00 34.13 33.58 2k6w s GLU 23 CO 0.01 -0.13 0.62 1.21 0.95 0.00 0.00 175.26 177.92 2k6w s ASN 24 N 0.92 6.30 0.00 0.83 2.47 -0.28 -4.96 114.94 120.22 2k6w s ASN 24 Ca -0.07 -0.43 0.29 0.00 0.42 0.00 0.00 52.86 53.06 2k6w s ASN 24 Cb -0.09 -2.31 1.24 0.00 -1.45 0.00 0.00 41.25 38.65 2k6w s ASN 24 CO -0.05 -0.77 1.93 -0.81 -3.72 0.00 0.00 177.10 173.68 2k6w n PRO 25 N 6.18 0.01 -1.70 0.43 -0.04 -1.26 -1.47 135.00 137.14 2k6w n PRO 25 Ca -0.03 0.00 -0.29 0.00 -0.04 0.00 0.00 63.50 63.14 2k6w n PRO 25 Cb 0.48 -1.50 0.16 0.00 -0.04 0.00 0.00 33.50 32.59 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 -2.99 1.65 0.00 0.55 0.00 -1.26 -4.57 107.32 100.71 2k6w s GLY 26 Ca 0.14 -0.85 0.19 0.00 0.00 0.00 0.00 44.72 44.19 2k6w s GLY 26 CO 0.52 -0.19 1.21 1.22 0.00 0.00 0.00 173.10 175.87 2k6w n ASP 27 N -3.79 2.92 -4.62 1.64 8.00 -1.26 -2.01 116.55 117.42 2k6w n ASP 27 Ca 0.11 -1.86 -0.25 0.00 0.71 0.00 0.00 54.79 53.50 2k6w n ASP 27 Cb 0.60 -0.14 -0.09 0.00 -0.02 0.00 0.00 41.12 41.47 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 -1.38 2.96 0.55 0.64 0.05 -1.26 -4.81 118.68 115.43 2k6w s LEU 28 Ca 0.28 -1.00 -0.09 0.00 0.05 0.00 0.00 54.13 53.37 2k6w s LEU 28 Cb 0.17 -1.33 -0.04 0.00 -2.05 0.00 0.00 46.19 42.94 2k6w s LEU 28 CO 0.25 -0.22 0.92 -2.16 -0.55 0.00 0.00 176.35 174.58 2k6w s PRO 29 N -3.70 3.61 0.16 1.48 0.04 -1.26 -3.81 135.00 131.52 2k6w s PRO 29 Ca 0.34 0.54 0.05 0.00 0.04 0.00 0.00 61.00 61.98 2k6w s PRO 29 Cb -0.00 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.28 2k6w s PRO 29 CO 0.19 -0.38 0.11 -0.51 0.04 0.00 0.00 177.00 176.45 2k6w s LEU 30 N -4.86 3.72 -0.12 -3.56 1.43 -0.05 -4.94 118.68 110.30 2k6w s LEU 30 Ca 0.52 -0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 53.41 2k6w s LEU 30 Cb -0.11 -2.34 0.06 0.00 0.03 0.00 0.00 46.19 43.83 2k6w s LEU 30 CO 0.48 0.08 0.13 -0.60 0.23 0.00 0.00 176.35 176.66 2k6w s ARG 31 N -3.03 0.05 -0.29 1.70 3.52 -1.26 -0.20 118.95 119.43 2k6w s ARG 31 Ca 0.30 0.25 -0.14 0.00 -0.13 0.00 0.00 55.73 56.01 2k6w s ARG 31 Cb -0.10 -1.00 -0.03 0.00 -1.56 0.00 0.00 34.95 32.26 2k6w s ARG 31 CO 0.22 -0.49 0.34 -1.17 -0.81 0.00 0.00 175.30 173.39 2k6w s LEU 32 N 2.22 4.16 -0.01 -0.88 2.96 0.76 -1.32 118.68 126.58 2k6w s LEU 32 Ca 0.04 0.07 0.05 0.00 -0.22 0.00 0.00 54.13 54.06 2k6w s LEU 32 Cb -0.14 -2.34 -0.07 0.00 0.50 0.00 0.00 46.19 44.14 2k6w s LEU 32 CO -0.07 -0.21 0.10 1.33 -1.32 0.00 0.00 176.35 176.18 2k6w n VAL 33 N 5.15 0.00 -2.54 1.68 0.24 0.39 -1.22 118.33 122.02 2k6w n VAL 33 Ca -0.10 -0.10 0.00 0.00 -2.04 0.00 0.00 64.34 62.10 2k6w n VAL 33 Cb 0.51 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 33.27 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 2.24 2.34 3.67 7.63 0.00 -1.13 -4.81 105.19 115.13 2k6w n GLY 34 Ca -0.01 -0.84 -0.11 0.00 0.00 0.00 0.00 46.02 45.06 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 -0.18 -0.11 4.61 0.00 -1.26 -1.31 121.76 122.51 2k6w s ALA 35 Ca 0.00 -1.00 -0.24 0.00 0.00 0.00 0.00 51.96 50.72 2k6w s ALA 35 Cb 0.00 0.91 0.06 0.00 0.00 0.00 0.00 23.12 24.08 2k6w s ALA 35 CO 0.00 -0.91 0.58 1.03 0.00 0.00 0.00 175.76 176.46 2k6w s ARG 36 N -2.91 0.85 0.05 0.00 1.81 0.24 -4.86 118.95 114.13 2k6w s ARG 36 Ca 0.21 0.39 -0.04 0.00 -1.72 0.00 0.00 55.73 54.57 2k6w s ARG 36 Cb -0.03 0.40 -0.02 0.00 -0.45 0.00 0.00 34.95 34.85 2k6w s ARG 36 CO 0.14 -0.21 0.06 -0.08 -0.68 0.00 0.00 175.30 174.53 2k6w s THR 37 N -0.66 0.17 0.37 0.02 -1.32 -1.26 0.01 115.64 112.96 2k6w s THR 37 Ca -0.07 -1.38 0.25 0.00 -1.21 0.00 0.00 61.69 59.28 2k6w s THR 37 Cb -0.03 -1.19 0.26 0.00 -1.51 0.00 0.00 72.50 70.04 2k6w s THR 37 CO 0.05 -0.76 2.00 1.55 -2.21 0.00 0.00 174.62 175.26 2k6w h PRO 38 N 3.34 0.00 -0.12 7.08 0.13 -2.00 -3.36 132.00 137.07 2k6w h PRO 38 Ca -0.33 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.80 2k6w h PRO 38 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2k6w h PRO 38 CO 0.57 0.16 0.00 1.33 -0.23 0.00 0.00 178.00 179.83 2k6w n VAL 39 N -3.67 0.14 -3.64 1.56 0.24 -1.26 -4.67 118.33 107.04 2k6w n VAL 39 Ca -0.02 -0.33 -0.14 0.00 -2.04 0.00 0.00 64.34 61.81 2k6w n VAL 39 Cb 0.29 0.46 -0.07 0.00 -1.47 0.00 0.00 33.84 33.05 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 -1.86 -1.20 0.00 2.33 0.00 -1.26 -0.70 121.76 119.07 2k6w s ALA 40 Ca 0.34 0.63 0.00 0.00 0.00 0.00 0.00 51.96 52.93 2k6w s ALA 40 Cb 0.19 0.19 0.00 0.00 0.00 0.00 0.00 23.12 23.50 2k6w s ALA 40 CO 0.29 -0.39 0.00 -1.91 0.00 0.00 0.00 175.76 173.75 2k6w n GLU 41 N 0.80 0.00 -2.53 0.00 4.07 -0.12 -4.68 120.64 118.18 2k6w n GLU 41 Ca -0.19 0.00 -0.43 0.00 -0.06 0.00 0.00 57.16 56.48 2k6w n GLU 41 Cb 0.58 -0.08 -0.02 0.00 -0.06 0.00 0.00 31.44 31.86 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 4.06 -0.10 5.31 3.52 -0.83 -4.95 118.95 125.96 2k6w s ARG 42 Ca 0.00 1.24 -0.00 0.00 -0.13 0.00 0.00 55.73 56.84 2k6w s ARG 42 Cb 0.00 -3.78 -0.03 0.00 -1.56 0.00 0.00 34.95 29.58 2k6w s ARG 42 CO 0.00 -0.92 -0.08 0.54 -0.81 0.00 0.00 175.30 174.02 2k6w s VAL 43 N 3.84 3.53 -0.01 7.11 0.11 -1.26 -0.66 120.40 133.06 2k6w s VAL 43 Ca 0.50 -0.52 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 2k6w s VAL 43 Cb -0.15 -2.47 -0.00 0.00 -1.53 0.00 0.00 36.38 32.22 2k6w s VAL 43 CO 0.17 0.55 -0.07 -1.61 -3.33 0.00 0.00 175.10 170.82 2k6w s GLU 44 N -0.21 0.61 -0.47 1.54 2.02 -0.19 -4.88 118.70 117.12 2k6w s GLU 44 Ca 0.02 -0.23 -0.26 0.00 0.02 0.00 0.00 54.97 54.53 2k6w s GLU 44 Cb -0.13 -0.60 0.03 0.00 0.10 0.00 0.00 34.13 33.53 2k6w s GLU 44 CO 0.03 0.11 0.95 -1.17 0.02 0.00 0.00 175.26 175.20 2k6w s LEU 45 N 0.02 3.96 0.18 1.80 2.96 -1.26 -0.35 118.68 125.99 2k6w s LEU 45 Ca 0.00 0.14 0.08 0.00 -0.22 0.00 0.00 54.13 54.14 2k6w s LEU 45 Cb -0.05 -3.23 -0.04 0.00 0.50 0.00 0.00 46.19 43.37 2k6w s LEU 45 CO -0.00 -1.08 -0.07 -1.00 -1.32 0.00 0.00 176.35 172.87 2k6w s HIS 46 N 3.85 2.68 0.33 5.38 3.76 0.05 -0.52 115.29 130.83 2k6w s HIS 46 Ca 0.38 -0.20 0.07 0.00 -0.15 0.00 0.00 55.06 55.17 2k6w s HIS 46 Cb -0.10 -1.31 -0.03 0.00 1.11 0.00 0.00 32.58 32.25 2k6w s HIS 46 CO 0.27 0.51 0.28 -1.83 -0.85 0.00 0.00 174.74 173.12 2k6w s GLU 47 N -2.84 2.72 -0.20 1.40 -1.05 0.13 -0.78 118.70 118.08 2k6w s GLU 47 Ca 0.25 -1.30 -0.01 0.00 -0.15 0.00 0.00 54.97 53.77 2k6w s GLU 47 Cb -0.09 -2.47 0.05 0.00 -0.44 0.00 0.00 34.13 31.19 2k6w s GLU 47 CO 0.16 0.10 -0.02 0.99 0.95 0.00 0.00 175.26 177.44 2k6w s THR 48 N -2.30 1.01 0.18 1.83 2.01 -0.08 -3.06 115.64 115.22 2k6w s THR 48 Ca 0.41 -0.78 0.08 0.00 0.31 0.00 0.00 61.69 61.71 2k6w s THR 48 Cb -0.06 -1.34 -0.04 0.00 0.01 0.00 0.00 72.50 71.07 2k6w s THR 48 CO 0.26 -0.07 -0.05 0.72 -0.69 0.00 0.00 174.62 174.80 2k6w s PHE 49 N 1.65 2.74 0.24 4.92 -0.12 0.03 -3.52 117.98 123.92 2k6w s PHE 49 Ca -0.02 -0.18 0.04 0.00 -0.05 0.00 0.00 56.93 56.72 2k6w s PHE 49 Cb -0.17 -1.32 -0.03 0.00 -0.63 0.00 0.00 43.02 40.86 2k6w s PHE 49 CO -0.07 0.52 0.38 0.00 -0.05 0.00 0.00 175.22 176.00 2k6w s MET 50 N -2.92 3.45 -0.18 1.99 0.23 -1.26 -1.49 119.30 119.11 2k6w s MET 50 Ca 0.26 -0.66 -0.29 0.00 -1.03 0.00 0.00 55.69 53.98 2k6w s MET 50 Cb -0.09 -2.86 0.12 0.00 -1.53 0.00 0.00 34.83 30.46 2k6w s MET 50 CO 0.17 0.40 0.96 0.50 -2.03 0.00 0.00 175.02 175.02 2k6w s ARG 51 N -3.91 0.63 -0.04 3.16 3.00 -0.28 -4.95 118.95 116.57 2k6w s ARG 51 Ca 0.35 0.31 -0.02 0.00 -1.00 0.00 0.00 55.73 55.37 2k6w s ARG 51 Cb -0.09 0.30 -0.04 0.00 0.00 0.00 0.00 34.95 35.12 2k6w s ARG 51 CO 0.30 -0.17 0.09 -2.00 0.00 0.00 0.00 175.30 173.52 2k6w s GLU 52 N -0.71 3.15 -0.18 5.12 2.56 -1.26 -0.30 118.70 127.07 2k6w s GLU 52 Ca -0.01 -0.40 -0.12 0.00 0.00 0.00 0.00 54.97 54.44 2k6w s GLU 52 Cb -0.02 -2.93 0.06 0.00 2.00 0.00 0.00 34.13 33.24 2k6w s GLU 52 CO 0.00 0.68 0.46 0.54 -0.56 0.00 0.00 175.26 176.39 2k6w s VAL 53 N -1.13 -0.01 0.00 3.70 0.11 0.35 -4.86 120.40 118.55 2k6w s VAL 53 Ca 0.20 0.05 0.00 0.00 -2.93 0.00 0.00 61.98 59.31 2k6w s VAL 53 Cb -0.12 -0.67 0.00 0.00 -1.53 0.00 0.00 36.38 34.06 2k6w s VAL 53 CO 0.11 0.02 0.00 1.21 -3.33 0.00 0.00 175.10 173.11 2k6w n GLU 54 N 3.83 -0.75 -0.88 1.54 2.13 -1.26 -1.02 120.64 124.23 2k6w n GLU 54 Ca -0.20 0.19 0.00 0.00 0.66 0.00 0.00 57.16 57.81 2k6w n GLU 54 Cb 0.56 -4.04 0.00 0.00 0.27 0.00 0.00 31.44 28.23 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 -1.10 0.75 3.89 8.31 0.00 -1.26 -5.07 105.19 110.71 2k6w n GLY 55 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.12 3.37 0.31 1.61 1.02 -0.18 -5.07 119.74 120.67 2k6w s LYS 56 Ca 0.00 -0.43 -0.16 0.00 0.02 0.00 0.00 55.97 55.40 2k6w s LYS 56 Cb 0.00 -3.02 -0.09 0.00 -0.52 0.00 0.00 37.83 34.20 2k6w s LYS 56 CO 0.00 0.63 0.74 -1.59 -0.92 0.00 0.00 175.35 174.21 2k6w s LYS 57 N -2.30 4.04 0.02 1.68 -2.85 -1.26 -0.50 119.74 118.57 2k6w s LYS 57 Ca 0.32 0.71 -0.19 0.00 -1.00 0.00 0.00 55.97 55.81 2k6w s LYS 57 Cb -0.13 -2.48 0.04 0.00 -2.06 0.00 0.00 37.83 33.20 2k6w s LYS 57 CO 0.24 0.18 0.42 0.54 0.10 0.00 0.00 175.35 176.83 2k6w s VAL 58 N -1.93 0.05 0.19 1.79 0.11 0.58 -4.92 120.40 116.27 2k6w s VAL 58 Ca 0.53 -0.41 0.08 0.00 -2.93 0.00 0.00 61.98 59.25 2k6w s VAL 58 Cb -0.11 -0.87 -0.04 0.00 -1.53 0.00 0.00 36.38 33.83 2k6w s VAL 58 CO 0.18 -0.22 -0.04 -0.04 -3.33 0.00 0.00 175.10 171.65 2k6w s MET 59 N -2.02 2.26 0.35 1.54 -1.94 -1.26 -1.12 119.30 117.11 2k6w s MET 59 Ca -0.08 -1.22 -0.12 0.00 -1.71 0.00 0.00 55.69 52.56 2k6w s MET 59 Cb -0.02 -2.25 0.03 0.00 2.01 0.00 0.00 34.83 34.60 2k6w s MET 59 CO 0.01 0.43 0.67 0.20 -0.01 0.00 0.00 175.02 176.32 2k6w s GLY 60 N -3.02 0.69 0.19 -0.03 0.00 -0.55 -5.01 107.32 99.59 2k6w s GLY 60 Ca 0.27 -0.96 0.09 0.00 0.00 0.00 0.00 44.72 44.12 2k6w s GLY 60 CO 0.17 -0.53 -0.17 1.06 0.00 0.00 0.00 173.10 173.64 2k6w s MET 61 N -2.79 1.34 0.05 2.90 -1.94 -1.26 -0.79 119.30 116.81 2k6w s MET 61 Ca 0.20 -1.52 -0.03 0.00 -1.71 0.00 0.00 55.69 52.62 2k6w s MET 61 Cb -0.03 -1.28 -0.02 0.00 2.01 0.00 0.00 34.83 35.50 2k6w s MET 61 CO 0.14 0.24 0.04 1.03 -0.01 0.00 0.00 175.02 176.45 2k6w s ARG 62 N -3.24 0.60 0.40 2.03 3.00 -1.17 -5.00 118.95 115.58 2k6w s ARG 62 Ca 0.20 -0.98 -0.27 0.00 0.00 0.00 0.00 55.73 54.69 2k6w s ARG 62 Cb -0.03 0.22 -0.09 0.00 0.00 0.00 0.00 34.95 35.05 2k6w s ARG 62 CO 0.08 -0.14 1.38 -1.25 0.00 0.00 0.00 175.30 175.37 2k6w s PRO 63 N -3.25 3.99 0.15 3.54 0.04 -1.26 -0.69 135.00 137.51 2k6w s PRO 63 Ca 0.01 2.33 0.06 0.00 0.04 0.00 0.00 61.00 63.44 2k6w s PRO 63 Cb 0.03 -2.83 -0.04 0.00 0.04 0.00 0.00 34.50 31.70 2k6w s PRO 63 CO -0.08 -0.54 0.05 0.14 0.04 0.00 0.00 177.00 176.61 2k6w s VAL 64 N -1.19 4.09 0.28 -0.36 -7.23 0.32 -4.85 120.40 111.45 2k6w s VAL 64 Ca 0.56 -1.18 0.08 0.00 -1.81 0.00 0.00 61.98 59.63 2k6w s VAL 64 Cb -0.42 -3.04 -0.01 0.00 0.56 0.00 0.00 36.38 33.48 2k6w s VAL 64 CO 0.55 -0.05 1.63 1.55 -0.31 0.00 0.00 175.10 178.48 2k6w h PRO 65 N 2.80 0.13 0.00 4.82 0.13 -1.97 -3.44 132.00 134.46 2k6w h PRO 65 Ca -0.47 -0.08 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2k6w h PRO 65 Cb 1.19 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2k6w h PRO 65 CO 0.61 0.64 0.00 1.97 -0.23 0.00 0.00 178.00 180.99 2k6w n PHE 66 N -3.90 0.00 -4.79 1.56 1.16 -1.26 -4.88 117.46 105.34 2k6w n PHE 66 Ca -0.02 0.00 -0.30 0.00 -1.87 0.00 0.00 57.45 55.26 2k6w n PHE 66 Cb 0.57 0.00 -0.14 0.00 -1.61 0.00 0.00 39.48 38.29 2k6w n PHE 66 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2k6w s LEU 67 N 0.00 2.24 0.04 5.98 1.02 -0.36 -4.99 118.68 122.61 2k6w s LEU 67 Ca 0.00 -0.60 -0.02 0.00 0.02 0.00 0.00 54.13 53.53 2k6w s LEU 67 Cb 0.00 -1.30 -0.02 0.00 0.02 0.00 0.00 46.19 44.88 2k6w s LEU 67 CO 0.00 0.25 0.01 -1.83 0.02 0.00 0.00 176.35 174.80 2k6w s GLU 68 N -1.40 0.51 -0.02 1.70 -1.05 -1.26 -0.17 118.70 117.00 2k6w s GLU 68 Ca 0.12 -0.88 0.00 0.00 -0.15 0.00 0.00 54.97 54.07 2k6w s GLU 68 Cb -0.10 0.19 0.02 0.00 -0.44 0.00 0.00 34.13 33.80 2k6w s GLU 68 CO 0.03 -0.10 0.01 0.08 0.95 0.00 0.00 175.26 176.23 2k6w s VAL 69 N -2.73 0.03 0.91 1.83 1.01 0.72 -4.99 120.40 117.18 2k6w s VAL 69 Ca -0.04 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 61.95 2k6w s VAL 69 Cb -0.01 -0.13 0.14 0.00 0.00 0.00 0.00 36.38 36.38 2k6w s VAL 69 CO -0.05 0.09 1.10 -2.16 0.00 0.00 0.00 175.10 174.07 2k6w s PRO 70 N 0.82 1.12 0.36 2.72 0.04 -1.26 -0.87 135.00 137.93 2k6w s PRO 70 Ca -0.07 0.63 -0.27 0.00 0.04 0.00 0.00 61.00 61.33 2k6w s PRO 70 Cb -0.10 -1.81 -0.12 0.00 0.04 0.00 0.00 34.50 32.51 2k6w s PRO 70 CO -0.02 -2.29 1.28 -0.35 0.04 0.00 0.00 177.00 175.66 2k6w n PRO 71 N -3.89 2.08 -0.65 0.56 -0.04 -1.25 -1.87 135.00 129.95 2k6w n PRO 71 Ca 0.06 0.73 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 2k6w n PRO 71 Cb 0.56 -2.34 0.00 0.00 -0.04 0.00 0.00 33.50 31.68 2k6w n PRO 71 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k6w n LYS 72 N 0.43 0.00 -2.31 0.54 4.76 -0.55 -4.94 118.16 116.09 2k6w n LYS 72 Ca 0.05 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.06 2k6w n LYS 72 Cb 0.37 -3.69 -0.02 0.00 -1.84 0.00 0.00 35.03 29.85 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 1.27 0.07 0.72 0.00 -0.78 -4.70 107.32 101.90 2k6w s GLY 73 Ca 0.00 0.16 -0.29 0.00 0.00 0.00 0.00 44.72 44.59 2k6w s GLY 73 CO 0.00 2.75 0.93 -1.60 0.00 0.00 0.00 173.10 175.18 2k6w s ARG 74 N 4.49 4.63 0.20 2.90 6.06 -1.26 -1.13 118.95 134.84 2k6w s ARG 74 Ca 0.62 1.37 -0.06 0.00 -2.50 0.00 0.00 55.73 55.15 2k6w s ARG 74 Cb -0.18 -3.39 -0.02 0.00 0.06 0.00 0.00 34.95 31.41 2k6w s ARG 74 CO 0.27 0.16 0.26 0.14 -2.50 0.00 0.00 175.30 173.63 2k6w s VAL 75 N 0.23 0.02 -0.30 7.11 -7.23 0.51 -4.99 120.40 115.74 2k6w s VAL 75 Ca 0.46 -1.71 -0.10 0.00 -1.81 0.00 0.00 61.98 58.82 2k6w s VAL 75 Cb -0.22 -2.27 0.16 0.00 0.56 0.00 0.00 36.38 34.61 2k6w s VAL 75 CO 0.28 -0.08 0.77 -0.70 -0.31 0.00 0.00 175.10 175.06 2k6w s GLU 76 N -4.08 0.46 -1.23 4.82 2.12 -1.26 -1.07 118.70 118.46 2k6w s GLU 76 Ca 0.29 1.06 -0.18 0.00 0.36 0.00 0.00 54.97 56.51 2k6w s GLU 76 Cb 0.04 0.63 -0.02 0.00 0.26 0.00 0.00 34.13 35.04 2k6w s GLU 76 CO 0.08 -0.25 2.03 1.28 -0.54 0.00 0.00 175.26 177.87 2k6w n LEU 77 N 5.31 5.46 -4.81 2.70 4.32 0.34 -4.74 117.00 125.57 2k6w n LEU 77 Ca -0.09 -3.69 -0.34 0.00 -0.02 0.00 0.00 56.01 51.87 2k6w n LEU 77 Cb 0.51 -1.54 -0.07 0.00 -1.62 0.00 0.00 43.42 40.70 2k6w n LEU 77 CO -0.03 0.29 0.62 -1.59 -1.22 0.00 0.00 177.39 175.46 2k6w s LYS 78 N 4.14 4.32 0.15 3.23 -2.85 -1.14 -3.32 119.74 124.28 2k6w s LYS 78 Ca 0.53 1.14 -0.17 0.00 -1.00 0.00 0.00 55.97 56.47 2k6w s LYS 78 Cb 0.11 -2.42 0.05 0.00 -2.06 0.00 0.00 37.83 33.51 2k6w s LYS 78 CO 0.02 0.10 1.75 -1.00 0.10 0.00 0.00 175.35 176.31 2k6w h PRO 79 N 2.40 0.24 -5.84 1.78 0.13 -1.94 0.20 132.00 128.96 2k6w h PRO 79 Ca -0.48 -0.01 -0.60 0.00 -0.87 0.00 0.00 66.00 64.03 2k6w h PRO 79 Cb 1.18 -0.05 -0.12 0.00 0.13 0.00 0.00 31.00 32.14 2k6w h PRO 79 CO 0.63 0.16 0.65 0.20 -0.23 0.00 0.00 178.00 179.40 2k6w s GLY 80 N -2.70 1.31 0.00 1.56 0.00 -1.26 -4.43 107.32 101.80 2k6w s GLY 80 Ca -0.13 -1.41 0.00 0.00 0.00 0.00 0.00 44.72 43.18 2k6w s GLY 80 CO 0.71 2.16 0.00 0.61 0.00 0.00 0.00 173.10 176.57 2k6w n GLY 81 N 5.21 0.38 3.24 0.20 0.00 -1.05 -5.03 105.19 108.15 2k6w n GLY 81 Ca 0.01 -0.17 -0.10 0.00 0.00 0.00 0.00 46.02 45.76 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 0.01 0.01 1.61 1.51 0.03 -0.91 117.35 119.62 2k6w s TYR 82 Ca 0.00 -0.35 -0.28 0.00 -1.01 0.00 0.00 57.07 55.43 2k6w s TYR 82 Cb 0.00 0.05 0.10 0.00 -0.11 0.00 0.00 41.96 41.99 2k6w s TYR 82 CO 0.00 -0.57 0.82 -3.38 -1.11 0.00 0.00 175.55 171.31 2k6w s HIS 83 N -3.53 -0.41 -0.31 2.71 -3.43 0.04 -2.87 115.29 107.48 2k6w s HIS 83 Ca 0.02 0.33 -0.15 0.00 -0.80 0.00 0.00 55.06 54.46 2k6w s HIS 83 Cb 0.03 0.53 -0.02 0.00 -1.43 0.00 0.00 32.58 31.68 2k6w s HIS 83 CO -0.09 -0.60 0.36 -0.06 -2.00 0.00 0.00 174.74 172.35 2k6w s PHE 84 N -2.96 3.22 -0.13 0.38 0.08 -0.48 -0.77 117.98 117.31 2k6w s PHE 84 Ca 0.03 0.15 -0.29 0.00 0.12 0.00 0.00 56.93 56.94 2k6w s PHE 84 Cb -0.01 -2.63 -0.02 0.00 -0.57 0.00 0.00 43.02 39.79 2k6w s PHE 84 CO -0.08 -0.35 1.25 -1.64 -0.10 0.00 0.00 175.22 174.30 2k6w s MET 85 N 2.05 4.27 -0.39 0.44 -1.94 0.53 -1.24 119.30 123.01 2k6w s MET 85 Ca 0.13 1.67 -0.08 0.00 -1.71 0.00 0.00 55.69 55.70 2k6w s MET 85 Cb -0.16 -3.70 0.07 0.00 2.01 0.00 0.00 34.83 33.04 2k6w s MET 85 CO 0.11 -0.63 0.20 -0.51 -0.01 0.00 0.00 175.02 174.18 2k6w s LEU 86 N 3.12 4.88 -0.22 -0.03 1.43 0.08 -1.02 118.68 126.92 2k6w s LEU 86 Ca 0.55 -1.41 -0.06 0.00 -1.03 0.00 0.00 54.13 52.18 2k6w s LEU 86 Cb -0.23 -1.94 -0.02 0.00 0.03 0.00 0.00 46.19 44.03 2k6w s LEU 86 CO 0.17 -0.46 0.02 -0.76 0.23 0.00 0.00 176.35 175.54 2k6w s LEU 87 N 1.40 3.31 -0.03 1.79 2.01 0.17 -1.33 118.68 126.00 2k6w s LEU 87 Ca 0.02 -0.21 -0.00 0.00 0.01 0.00 0.00 54.13 53.95 2k6w s LEU 87 Cb -0.22 -1.86 0.00 0.00 0.01 0.00 0.00 46.19 44.13 2k6w s LEU 87 CO 0.02 0.03 0.00 0.61 1.01 0.00 0.00 176.35 178.02 2k6w n GLY 88 N 4.49 -2.82 3.67 -3.19 0.00 -0.57 -1.96 105.19 104.80 2k6w n GLY 88 Ca -0.17 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.24 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 -0.18 4.16 0.20 0.99 1.43 -1.22 -0.94 118.68 123.10 2k6w s LEU 89 Ca 0.00 1.36 0.24 0.00 -1.03 0.00 0.00 54.13 54.71 2k6w s LEU 89 Cb -0.00 -3.47 0.91 0.00 0.03 0.00 0.00 46.19 43.66 2k6w s LEU 89 CO 0.06 -0.55 1.73 0.29 0.23 0.00 0.00 176.35 178.12 2k6w n LYS 90 N 5.72 0.19 -3.64 1.70 5.02 0.12 -4.74 118.16 122.53 2k6w n LYS 90 Ca 0.09 0.30 -0.14 0.00 -2.02 0.00 0.00 58.31 56.54 2k6w n LYS 90 Cb 0.47 -1.78 -0.08 0.00 -0.02 0.00 0.00 35.03 33.62 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 -3.18 0.78 0.34 1.97 1.70 -1.22 -4.98 118.95 114.36 2k6w s ARG 91 Ca 0.08 0.72 -0.27 0.00 -0.47 0.00 0.00 55.73 55.78 2k6w s ARG 91 Cb 0.11 0.38 -0.09 0.00 -0.57 0.00 0.00 34.95 34.78 2k6w s ARG 91 CO 0.47 -0.13 1.16 -1.25 -1.08 0.00 0.00 175.30 174.46 2k6w s PRO 92 N 0.00 4.36 -1.26 3.89 0.04 -1.26 -4.91 135.00 135.87 2k6w s PRO 92 Ca -0.02 1.87 -0.15 0.00 0.04 0.00 0.00 61.00 62.74 2k6w s PRO 92 Cb -0.04 -2.95 0.13 0.00 0.04 0.00 0.00 34.50 31.68 2k6w s PRO 92 CO 0.03 -0.06 1.61 1.28 0.04 0.00 0.00 177.00 179.89 2k6w n LEU 93 N 0.65 5.28 -4.74 -3.56 4.32 -0.32 -4.90 117.00 113.74 2k6w n LEU 93 Ca 0.01 -4.27 -0.30 0.00 -0.02 0.00 0.00 56.01 51.43 2k6w n LEU 93 Cb 0.45 -1.66 0.12 0.00 -1.62 0.00 0.00 43.42 40.71 2k6w n LEU 93 CO 0.53 0.58 0.68 -0.54 -1.22 0.00 0.00 177.39 177.42 2k6w s LYS 94 N 2.50 1.65 0.23 3.23 1.02 -1.26 -0.90 119.74 126.21 2k6w s LYS 94 Ca 0.47 0.99 -0.31 0.00 0.02 0.00 0.00 55.97 57.14 2k6w s LYS 94 Cb 0.01 -1.84 -0.11 0.00 -0.52 0.00 0.00 37.83 35.37 2k6w s LYS 94 CO 0.03 -2.01 1.55 0.00 -0.92 0.00 0.00 175.35 174.00 2k6w s ALA 95 N -2.91 3.74 -0.47 5.17 0.00 -1.26 -2.73 121.76 123.30 2k6w s ALA 95 Ca 0.63 1.44 -0.00 0.00 0.00 0.00 0.00 51.96 54.02 2k6w s ALA 95 Cb -0.18 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.32 2k6w s ALA 95 CO 0.57 -0.84 0.39 0.41 0.00 0.00 0.00 175.76 176.29 2k6w n GLY 96 N 2.87 0.13 3.46 0.00 0.00 -1.25 -5.09 105.19 105.30 2k6w n GLY 96 Ca 0.10 -0.26 -0.22 0.00 0.00 0.00 0.00 46.02 45.65 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 -4.54 1.63 0.06 1.61 0.41 -1.11 -5.03 118.70 111.73 2k6w s GLU 97 Ca 0.00 -1.87 0.03 0.00 -0.41 0.00 0.00 54.97 52.72 2k6w s GLU 97 Cb -0.00 -1.07 -0.03 0.00 -1.78 0.00 0.00 34.13 31.25 2k6w s GLU 97 CO 0.28 -0.07 -0.09 -1.21 -0.49 0.00 0.00 175.26 173.68 2k6w s GLU 98 N -3.80 0.66 -0.08 1.61 2.02 -1.26 -0.23 118.70 117.62 2k6w s GLU 98 Ca 0.33 -0.92 -0.01 0.00 0.02 0.00 0.00 54.97 54.40 2k6w s GLU 98 Cb 0.07 -0.41 0.03 0.00 0.10 0.00 0.00 34.13 33.91 2k6w s GLU 98 CO 0.14 0.07 -0.03 0.08 0.02 0.00 0.00 175.26 175.54 2k6w s VAL 99 N -1.77 0.59 0.44 2.63 1.01 0.73 -4.96 120.40 119.07 2k6w s VAL 99 Ca -0.04 -0.03 -0.21 0.00 0.00 0.00 0.00 61.98 61.70 2k6w s VAL 99 Cb -0.07 -0.69 -0.10 0.00 0.00 0.00 0.00 36.38 35.52 2k6w s VAL 99 CO 0.00 0.29 0.98 -1.61 0.00 0.00 0.00 175.10 174.76 2k6w s GLU 100 N 1.77 4.13 -0.15 2.72 2.02 -1.26 -1.32 118.70 126.60 2k6w s GLU 100 Ca 0.03 1.20 -0.07 0.00 0.02 0.00 0.00 54.97 56.15 2k6w s GLU 100 Cb -0.13 -2.19 0.06 0.00 0.10 0.00 0.00 34.13 31.98 2k6w s GLU 100 CO -0.05 -0.13 0.34 -1.17 0.02 0.00 0.00 175.26 174.27 2k6w s LEU 101 N -3.20 -0.14 -0.47 1.80 0.20 -0.66 -4.16 118.68 112.04 2k6w s LEU 101 Ca 0.63 0.76 -0.21 0.00 0.69 0.00 0.00 54.13 55.99 2k6w s LEU 101 Cb -0.12 1.05 0.03 0.00 -0.43 0.00 0.00 46.19 46.73 2k6w s LEU 101 CO 0.16 -0.21 0.70 -1.81 -0.29 0.00 0.00 176.35 174.90 2k6w s ASP 102 N 1.86 6.32 0.05 3.68 1.01 0.10 -0.48 116.67 129.22 2k6w s ASP 102 Ca -0.05 -0.42 -0.30 0.00 0.71 0.00 0.00 52.55 52.48 2k6w s ASP 102 Cb -0.10 -2.34 -0.04 0.00 1.01 0.00 0.00 42.92 41.44 2k6w s ASP 102 CO -0.11 -0.88 1.04 -0.76 0.21 0.00 0.00 175.17 174.66 2k6w s LEU 103 N 3.01 4.40 -0.25 1.23 1.02 -0.15 -0.60 118.68 127.34 2k6w s LEU 103 Ca 0.23 1.80 -0.10 0.00 0.02 0.00 0.00 54.13 56.09 2k6w s LEU 103 Cb -0.15 -3.58 -0.05 0.00 0.02 0.00 0.00 46.19 42.44 2k6w s LEU 103 CO 0.18 -0.27 0.15 -0.76 0.02 0.00 0.00 176.35 175.67 2k6w s LEU 104 N 0.71 3.93 -0.06 1.79 1.43 -0.43 -1.89 118.68 124.16 2k6w s LEU 104 Ca 0.52 0.00 0.04 0.00 -1.03 0.00 0.00 54.13 53.67 2k6w s LEU 104 Cb -0.24 -2.07 -0.02 0.00 0.03 0.00 0.00 46.19 43.89 2k6w s LEU 104 CO 0.29 0.01 -0.18 -0.36 0.23 0.00 0.00 176.35 176.35 2k6w s PHE 105 N 1.39 2.63 -1.23 0.29 0.40 -0.46 -0.46 117.98 120.53 2k6w s PHE 105 Ca 0.07 -0.38 -0.18 0.00 -0.60 0.00 0.00 56.93 55.83 2k6w s PHE 105 Cb -0.15 -1.65 -0.02 0.00 0.51 0.00 0.00 43.02 41.72 2k6w s PHE 105 CO 0.07 0.01 2.02 0.00 0.70 0.00 0.00 175.22 178.02 2k6w n ALA 106 N 2.66 4.17 0.00 5.36 0.00 -0.43 -3.73 120.51 128.54 2k6w n ALA 106 Ca -0.17 -3.64 0.00 0.00 0.00 0.00 0.00 53.44 49.63 2k6w n ALA 106 Cb 0.52 -3.57 0.00 0.00 0.00 0.00 0.00 19.45 16.40 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 4.66 0.00 2.20 0.00 0.00 -1.26 -4.84 105.19 105.95 2k6w n GLY 107 Ca 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.42 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 0.16 3.21 -0.02 0.00 -1.25 -5.04 105.19 102.26 2k6w n GLY 108 Ca 0.00 -0.50 -0.26 0.00 0.00 0.00 0.00 46.02 45.26 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 -4.21 1.50 -0.01 1.61 3.01 -1.24 -5.09 119.74 115.31 2k6w s LYS 109 Ca 0.00 -0.75 0.01 0.00 -1.01 0.00 0.00 55.97 54.22 2k6w s LYS 109 Cb 0.00 -1.49 0.01 0.00 -1.01 0.00 0.00 37.83 35.34 2k6w s LYS 109 CO 0.00 0.40 -0.02 0.54 0.51 0.00 0.00 175.35 176.78 2k6w s VAL 110 N -0.55 0.21 -0.09 3.17 0.11 -1.26 -1.36 120.40 120.63 2k6w s VAL 110 Ca 0.07 -0.06 -0.04 0.00 -2.93 0.00 0.00 61.98 59.03 2k6w s VAL 110 Cb -0.08 -0.22 0.05 0.00 -1.53 0.00 0.00 36.38 34.60 2k6w s VAL 110 CO -0.00 0.09 0.19 -0.76 -3.33 0.00 0.00 175.10 171.29 2k6w s LEU 111 N 0.27 0.20 0.20 2.54 1.43 -0.79 -4.97 118.68 117.56 2k6w s LEU 111 Ca -0.02 0.41 -0.10 0.00 -1.03 0.00 0.00 54.13 53.39 2k6w s LEU 111 Cb -0.05 0.47 -0.07 0.00 0.03 0.00 0.00 46.19 46.57 2k6w s LEU 111 CO -0.01 -0.20 0.52 -1.59 0.23 0.00 0.00 176.35 175.30 2k6w s LYS 112 N 1.80 3.80 0.09 1.70 -2.85 -1.26 -0.98 119.74 122.03 2k6w s LYS 112 Ca -0.03 0.25 0.08 0.00 -1.00 0.00 0.00 55.97 55.27 2k6w s LYS 112 Cb -0.12 -2.72 -0.04 0.00 -2.06 0.00 0.00 37.83 32.90 2k6w s LYS 112 CO -0.07 0.37 -0.16 0.14 0.10 0.00 0.00 175.35 175.72 2k6w s VAL 113 N -1.74 2.93 -0.15 1.79 -7.23 0.37 -4.96 120.40 111.41 2k6w s VAL 113 Ca 0.45 -1.36 -0.06 0.00 -1.81 0.00 0.00 61.98 59.20 2k6w s VAL 113 Cb -0.12 -2.32 -0.04 0.00 0.56 0.00 0.00 36.38 34.47 2k6w s VAL 113 CO 0.21 0.17 0.04 0.68 -0.31 0.00 0.00 175.10 175.89 2k6w s VAL 114 N -1.09 4.61 -0.14 1.32 -7.23 -1.26 -1.66 120.40 114.95 2k6w s VAL 114 Ca 0.18 -0.11 -0.03 0.00 -1.81 0.00 0.00 61.98 60.21 2k6w s VAL 114 Cb -0.11 -3.03 0.05 0.00 0.56 0.00 0.00 36.38 33.85 2k6w s VAL 114 CO 0.09 0.51 0.04 -0.76 -0.31 0.00 0.00 175.10 174.67 2k6w s LEU 115 N -0.05 0.77 0.64 1.32 1.43 -0.44 -4.50 118.68 117.85 2k6w s LEU 115 Ca 0.05 -0.49 -0.13 0.00 -1.03 0.00 0.00 54.13 52.54 2k6w s LEU 115 Cb -0.12 -0.45 -0.02 0.00 0.03 0.00 0.00 46.19 45.62 2k6w s LEU 115 CO 0.01 -0.27 1.05 -2.16 0.23 0.00 0.00 176.35 175.20 2k6w s PRO 116 N 1.97 3.26 -0.20 1.29 0.04 -1.26 -0.19 135.00 139.91 2k6w s PRO 116 Ca 0.02 0.98 -0.10 0.00 0.04 0.00 0.00 61.00 61.94 2k6w s PRO 116 Cb -0.15 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.31 2k6w s PRO 116 CO -0.07 -0.84 0.12 0.08 0.04 0.00 0.00 177.00 176.33 2k6w s VAL 117 N -2.88 5.31 0.11 -0.36 1.01 0.68 -0.96 120.40 123.30 2k6w s VAL 117 Ca 0.59 0.15 -0.04 0.00 0.00 0.00 0.00 61.98 62.69 2k6w s VAL 117 Cb -0.13 -3.42 -0.03 0.00 0.00 0.00 0.00 36.38 32.80 2k6w s VAL 117 CO 0.48 0.44 0.09 -0.70 0.00 0.00 0.00 175.10 175.41 2k6w s GLU 118 N 0.38 0.86 -0.20 2.72 2.12 -1.13 -3.82 118.70 119.63 2k6w s GLU 118 Ca 0.07 -1.25 -0.05 0.00 0.36 0.00 0.00 54.97 54.11 2k6w s GLU 118 Cb -0.11 0.27 -0.16 0.00 0.26 0.00 0.00 34.13 34.39 2k6w s GLU 118 CO -0.02 -0.24 2.59 0.00 -0.54 0.00 0.00 175.26 177.05 2k6w n ALA 119 N -0.05 4.83 1.40 6.30 0.00 -1.26 -0.56 120.51 131.17 2k6w n ALA 119 Ca -0.10 -1.46 0.11 0.00 0.00 0.00 0.00 53.44 52.00 2k6w n ALA 119 Cb 0.63 -2.44 0.66 0.00 0.00 0.00 0.00 19.45 18.30 2k6w n ALA 119 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04