#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 -0.36 -1.42 1.61 0.15 -1.26 -5.08 113.70 107.34 2k6w s SER 2 Ca 0.00 -0.27 -0.08 0.00 0.70 0.00 0.00 55.95 56.29 2k6w s SER 2 Cb 0.00 0.58 0.06 0.00 -1.71 0.00 0.00 66.02 64.95 2k6w s SER 2 CO 0.00 -1.02 2.46 0.49 1.20 0.00 0.00 173.24 176.37 2k6w n PHE 3 N -0.40 2.70 -1.92 3.44 3.72 -1.26 -4.95 117.46 118.78 2k6w n PHE 3 Ca -0.09 -2.92 -0.31 0.00 -0.05 0.00 0.00 57.45 54.08 2k6w n PHE 3 Cb 0.62 -2.13 0.01 0.00 -0.94 0.00 0.00 39.48 37.04 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 0.57 4.34 0.00 4.37 -4.23 -1.26 -5.08 115.64 114.35 2k6w s THR 4 Ca 0.56 0.89 0.00 0.00 -1.18 0.00 0.00 61.69 61.95 2k6w s THR 4 Cb 0.16 -3.63 0.00 0.00 1.34 0.00 0.00 72.50 70.37 2k6w s THR 4 CO -0.07 -0.87 0.00 1.21 -0.54 0.00 0.00 174.62 174.35 2k6w n GLU 5 N -2.50 0.00 -3.63 3.99 2.13 -1.26 -4.92 120.64 114.45 2k6w n GLU 5 Ca 0.07 0.00 -0.02 0.00 0.66 0.00 0.00 57.16 57.87 2k6w n GLU 5 Cb 0.54 0.00 -0.05 0.00 0.27 0.00 0.00 31.44 32.20 2k6w n GLU 5 CO 0.00 0.00 0.00 0.20 -0.41 0.00 0.00 177.13 176.92 2k6w s GLY 6 N 0.00 -0.67 0.09 8.31 0.00 -1.26 -0.90 107.32 112.89 2k6w s GLY 6 Ca 0.00 2.42 0.06 0.00 0.00 0.00 0.00 44.72 47.20 2k6w s GLY 6 CO 0.00 2.95 -0.07 0.66 0.00 0.00 0.00 173.10 176.64 2k6w s TRP 7 N 2.61 2.82 -0.02 1.90 -2.14 -1.25 -4.03 118.94 118.83 2k6w s TRP 7 Ca -0.07 -0.11 -0.13 0.00 2.66 0.00 0.00 56.10 58.46 2k6w s TRP 7 Cb -0.10 -1.48 -0.05 0.00 -3.10 0.00 0.00 33.47 28.73 2k6w s TRP 7 CO -0.19 0.43 0.36 0.08 -2.66 0.00 0.00 176.95 174.97 2k6w s VAL 8 N -1.21 5.12 -0.31 -0.66 1.01 0.19 -3.26 120.40 121.27 2k6w s VAL 8 Ca 0.22 0.70 -0.16 0.00 0.00 0.00 0.00 61.98 62.75 2k6w s VAL 8 Cb -0.11 -3.65 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 2k6w s VAL 8 CO 0.14 0.57 0.39 -0.60 0.00 0.00 0.00 175.10 175.61 2k6w s ARG 9 N -1.12 3.75 0.02 2.72 3.00 -1.26 -1.13 118.95 124.94 2k6w s ARG 9 Ca 0.23 -0.19 -0.30 0.00 -1.00 0.00 0.00 55.73 54.46 2k6w s ARG 9 Cb -0.16 -3.75 -0.06 0.00 0.00 0.00 0.00 34.95 30.98 2k6w s ARG 9 CO 0.12 -0.45 1.50 0.12 0.00 0.00 0.00 175.30 176.60 2k6w s PHE 10 N 2.11 2.64 -0.25 5.12 5.36 -0.65 -4.87 117.98 127.44 2k6w s PHE 10 Ca 0.14 0.60 -0.26 0.00 -0.96 0.00 0.00 56.93 56.46 2k6w s PHE 10 Cb -0.16 -3.78 0.07 0.00 -0.34 0.00 0.00 43.02 38.81 2k6w s PHE 10 CO 0.11 -3.03 0.74 -1.12 -1.46 0.00 0.00 175.22 170.47 2k6w s SER 11 N 2.17 -0.72 -1.44 6.13 0.01 -1.26 -4.85 113.70 113.74 2k6w s SER 11 Ca 0.68 1.33 -0.11 0.00 1.31 0.00 0.00 55.95 59.16 2k6w s SER 11 Cb -0.34 1.33 0.05 0.00 0.21 0.00 0.00 66.02 67.26 2k6w s SER 11 CO 0.28 -0.28 2.36 -0.81 0.41 0.00 0.00 173.24 175.21 2k6w n PRO 12 N 2.47 3.51 -4.63 12.44 -0.04 -1.26 -4.70 135.00 142.80 2k6w n PRO 12 Ca -0.14 -2.84 -0.28 0.00 -0.04 0.00 0.00 63.50 60.19 2k6w n PRO 12 Cb 0.55 -2.98 -0.10 0.00 -0.04 0.00 0.00 33.50 30.93 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 1.96 2.55 0.52 0.55 0.00 -1.26 -5.02 107.32 106.62 2k6w s GLY 13 Ca 0.52 -2.00 0.31 0.00 0.00 0.00 0.00 44.72 43.55 2k6w s GLY 13 CO -0.06 -2.09 1.93 -0.56 0.00 0.00 0.00 173.10 172.32 2k6w h PRO 14 N 1.74 0.00 -3.68 2.90 0.13 -1.94 -3.45 132.00 127.69 2k6w h PRO 14 Ca -0.44 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.63 2k6w h PRO 14 Cb 1.25 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.29 2k6w h PRO 14 CO 0.79 0.04 -0.14 0.54 -0.23 0.00 0.00 178.00 179.00 2k6w s ASN 15 N -5.83 -0.08 0.07 1.44 4.22 -1.26 -1.97 114.94 111.53 2k6w s ASN 15 Ca 0.01 -0.93 -0.11 0.00 -2.14 0.00 0.00 52.86 49.70 2k6w s ASN 15 Cb 0.09 0.57 0.01 0.00 1.28 0.00 0.00 41.25 43.20 2k6w s ASN 15 CO 0.57 -1.12 0.23 0.00 -2.04 0.00 0.00 177.10 174.75 2k6w s ALA 16 N -4.02 -0.42 -0.33 3.54 0.00 -1.23 -4.97 121.76 114.34 2k6w s ALA 16 Ca 0.22 -0.35 -0.15 0.00 0.00 0.00 0.00 51.96 51.68 2k6w s ALA 16 Cb -0.00 0.42 -0.02 0.00 0.00 0.00 0.00 23.12 23.52 2k6w s ALA 16 CO 0.08 -0.46 0.38 0.00 0.00 0.00 0.00 175.76 175.76 2k6w s ALA 17 N -3.24 3.51 0.32 0.00 0.00 -1.26 -1.11 121.76 119.98 2k6w s ALA 17 Ca 0.00 -1.11 0.04 0.00 0.00 0.00 0.00 51.96 50.89 2k6w s ALA 17 Cb 0.02 -2.81 -0.02 0.00 0.00 0.00 0.00 23.12 20.30 2k6w s ALA 17 CO -0.08 -1.00 0.48 0.00 0.00 0.00 0.00 175.76 175.16 2k6w s ALA 18 N 2.07 3.95 0.15 0.00 0.00 -0.04 -4.51 121.76 123.38 2k6w s ALA 18 Ca 0.13 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 50.89 2k6w s ALA 18 Cb -0.16 -1.86 -0.04 0.00 0.00 0.00 0.00 23.12 21.06 2k6w s ALA 18 CO 0.12 0.01 0.01 0.71 0.00 0.00 0.00 175.76 176.61 2k6w s TYR 19 N -2.19 1.07 -0.01 0.00 2.02 -1.20 -1.39 117.35 115.64 2k6w s TYR 19 Ca 0.41 -1.07 -0.29 0.00 -0.37 0.00 0.00 57.07 55.75 2k6w s TYR 19 Cb -0.09 -0.61 0.10 0.00 -0.40 0.00 0.00 41.96 40.95 2k6w s TYR 19 CO 0.32 -0.29 0.87 -0.48 -1.57 0.00 0.00 175.55 174.40 2k6w s LEU 20 N -3.12 -0.38 0.26 -1.29 2.34 -1.25 -3.97 118.68 111.26 2k6w s LEU 20 Ca 0.22 0.05 -0.29 0.00 0.06 0.00 0.00 54.13 54.17 2k6w s LEU 20 Cb 0.06 2.06 -0.09 0.00 -0.56 0.00 0.00 46.19 47.66 2k6w s LEU 20 CO 0.02 -0.62 0.94 -0.89 -1.06 0.00 0.00 176.35 174.74 2k6w s THR 21 N -2.96 4.12 -0.06 5.48 2.01 -0.08 -0.73 115.64 123.42 2k6w s THR 21 Ca 0.04 2.00 0.02 0.00 0.31 0.00 0.00 61.69 64.05 2k6w s THR 21 Cb -0.01 -4.22 0.02 0.00 0.01 0.00 0.00 72.50 68.29 2k6w s THR 21 CO -0.08 0.39 -0.10 -0.22 -0.69 0.00 0.00 174.62 173.92 2k6w s LEU 22 N -1.46 1.54 -0.14 4.42 1.98 0.09 -4.84 118.68 120.28 2k6w s LEU 22 Ca 0.44 -0.24 -0.00 0.00 -2.89 0.00 0.00 54.13 51.43 2k6w s LEU 22 Cb -0.24 -0.69 -0.01 0.00 0.66 0.00 0.00 46.19 45.91 2k6w s LEU 22 CO 0.29 0.00 -0.12 -1.83 -1.89 0.00 0.00 176.35 172.80 2k6w s GLU 23 N 0.74 3.39 -0.44 1.98 1.03 -1.26 -0.78 118.70 123.36 2k6w s GLU 23 Ca -0.14 -0.68 -0.24 0.00 0.03 0.00 0.00 54.97 53.94 2k6w s GLU 23 Cb -0.15 -2.66 0.02 0.00 -0.80 0.00 0.00 34.13 30.54 2k6w s GLU 23 CO 0.03 0.19 0.85 1.21 -1.33 0.00 0.00 175.26 176.20 2k6w s ASN 24 N 0.42 6.48 0.00 0.83 2.47 -0.26 -4.95 114.94 119.94 2k6w s ASN 24 Ca -0.10 0.09 0.26 0.00 0.42 0.00 0.00 52.86 53.54 2k6w s ASN 24 Cb -0.16 -2.42 0.78 0.00 -1.45 0.00 0.00 41.25 38.00 2k6w s ASN 24 CO 0.05 -0.94 1.60 -0.81 -3.72 0.00 0.00 177.10 173.28 2k6w n PRO 25 N 6.85 0.07 -2.63 0.43 -0.04 -1.26 -1.81 135.00 136.61 2k6w n PRO 25 Ca 0.04 -0.03 -0.23 0.00 -0.04 0.00 0.00 63.50 63.24 2k6w n PRO 25 Cb 0.48 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.48 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 -2.95 1.71 0.00 0.55 0.00 -1.26 -4.64 107.32 100.73 2k6w s GLY 26 Ca 0.13 -1.11 0.29 0.00 0.00 0.00 0.00 44.72 44.03 2k6w s GLY 26 CO 0.63 -0.84 1.82 1.22 0.00 0.00 0.00 173.10 175.92 2k6w n ASP 27 N -2.39 1.07 -4.62 1.64 8.00 -1.26 -2.32 116.55 116.67 2k6w n ASP 27 Ca 0.06 -1.24 -0.24 0.00 0.71 0.00 0.00 54.79 54.08 2k6w n ASP 27 Cb 0.59 0.01 -0.08 0.00 -0.02 0.00 0.00 41.12 41.62 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 -2.11 3.11 0.45 0.64 0.05 -1.26 -4.79 118.68 114.76 2k6w s LEU 28 Ca 0.37 -0.67 -0.18 0.00 0.05 0.00 0.00 54.13 53.70 2k6w s LEU 28 Cb 0.21 -1.65 -0.09 0.00 -2.05 0.00 0.00 46.19 42.60 2k6w s LEU 28 CO 0.38 0.02 0.93 -2.16 -0.55 0.00 0.00 176.35 174.96 2k6w s PRO 29 N -3.56 4.09 0.16 1.48 0.04 -1.26 -4.22 135.00 131.73 2k6w s PRO 29 Ca 0.31 0.98 0.03 0.00 0.04 0.00 0.00 61.00 62.36 2k6w s PRO 29 Cb -0.07 -2.20 -0.03 0.00 0.04 0.00 0.00 34.50 32.24 2k6w s PRO 29 CO 0.19 -0.09 0.27 -0.51 0.04 0.00 0.00 177.00 176.90 2k6w s LEU 30 N -3.49 4.25 -0.20 -3.56 1.43 -0.08 -4.98 118.68 112.05 2k6w s LEU 30 Ca 0.59 0.10 -0.02 0.00 -1.03 0.00 0.00 54.13 53.78 2k6w s LEU 30 Cb -0.09 -2.82 0.06 0.00 0.03 0.00 0.00 46.19 43.36 2k6w s LEU 30 CO 0.21 0.04 0.01 -0.60 0.23 0.00 0.00 176.35 176.23 2k6w s ARG 31 N -3.32 0.92 -0.39 1.70 3.52 -1.26 -0.79 118.95 119.34 2k6w s ARG 31 Ca 0.34 -0.54 -0.18 0.00 -0.13 0.00 0.00 55.73 55.22 2k6w s ARG 31 Cb -0.11 -2.17 0.01 0.00 -1.56 0.00 0.00 34.95 31.12 2k6w s ARG 31 CO 0.28 -0.61 0.48 -1.17 -0.81 0.00 0.00 175.30 173.47 2k6w s LEU 32 N 1.74 4.57 -0.00 -0.88 2.96 0.33 -1.42 118.68 125.98 2k6w s LEU 32 Ca -0.02 -0.34 0.16 0.00 -0.22 0.00 0.00 54.13 53.71 2k6w s LEU 32 Cb -0.17 -2.50 -0.18 0.00 0.50 0.00 0.00 46.19 43.84 2k6w s LEU 32 CO -0.07 -0.54 0.64 1.33 -1.32 0.00 0.00 176.35 176.39 2k6w n VAL 33 N 5.47 0.00 -3.18 1.68 0.24 0.63 -0.21 118.33 122.96 2k6w n VAL 33 Ca -0.06 -0.15 0.00 0.00 -2.04 0.00 0.00 64.34 62.09 2k6w n VAL 33 Cb 0.48 0.90 0.00 0.00 -1.47 0.00 0.00 33.84 33.75 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 1.40 -0.90 3.17 7.63 0.00 -1.19 -4.63 105.19 110.67 2k6w n GLY 34 Ca 0.02 -0.78 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 2k6w n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6w n ALA 35 N 0.00 -0.12 -3.47 4.61 0.00 -1.26 -1.15 120.51 119.13 2k6w n ALA 35 Ca 0.00 -1.60 -0.14 0.00 0.00 0.00 0.00 53.44 51.70 2k6w n ALA 35 Cb 0.00 1.29 -0.08 0.00 0.00 0.00 0.00 19.45 20.66 2k6w n ALA 35 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2k6w s ARG 36 N -2.86 0.70 0.06 0.00 3.52 -0.52 -4.88 118.95 114.97 2k6w s ARG 36 Ca 0.30 0.71 -0.15 0.00 -0.13 0.00 0.00 55.73 56.45 2k6w s ARG 36 Cb -0.00 0.34 0.03 0.00 -1.56 0.00 0.00 34.95 33.75 2k6w s ARG 36 CO 0.21 -0.10 0.35 -0.08 -0.81 0.00 0.00 175.30 174.87 2k6w s THR 37 N 0.11 0.08 -0.41 4.11 -1.32 -1.26 -0.47 115.64 116.48 2k6w s THR 37 Ca -0.01 -0.63 0.26 0.00 -1.21 0.00 0.00 61.69 60.10 2k6w s THR 37 Cb -0.04 -1.01 0.32 0.00 -1.51 0.00 0.00 72.50 70.26 2k6w s THR 37 CO 0.02 -0.34 1.77 1.55 -2.21 0.00 0.00 174.62 175.40 2k6w h PRO 38 N 2.97 0.00 0.00 7.08 0.13 -2.00 -3.36 132.00 136.81 2k6w h PRO 38 Ca -0.32 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.71 2k6w h PRO 38 Cb 1.21 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 2k6w h PRO 38 CO 0.46 0.00 -0.85 -0.39 -0.23 0.00 0.00 178.00 176.99 2k6w h VAL 39 N 0.00 0.48 -3.82 1.56 -1.51 -1.91 -3.41 116.25 107.64 2k6w h VAL 39 Ca 0.00 -1.78 -0.38 0.00 -1.23 0.00 0.00 66.70 63.32 2k6w h VAL 39 Cb 0.66 2.07 -0.20 0.00 -2.13 0.00 0.00 31.29 31.69 2k6w h VAL 39 CO 0.00 0.27 -0.76 0.00 -1.23 0.00 0.00 177.57 175.85 2k6w s ALA 40 N -3.05 1.17 0.00 5.19 0.00 -1.26 -2.46 121.76 121.35 2k6w s ALA 40 Ca 0.01 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 50.88 2k6w s ALA 40 Cb 0.08 -0.05 0.00 0.00 0.00 0.00 0.00 23.12 23.15 2k6w s ALA 40 CO 0.77 0.08 0.00 -1.91 0.00 0.00 0.00 175.76 174.70 2k6w n GLU 41 N 0.96 0.00 -2.65 0.00 4.07 -0.22 -4.65 120.64 118.15 2k6w n GLU 41 Ca -0.19 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.50 2k6w n GLU 41 Cb 0.56 -0.05 -0.03 0.00 -0.06 0.00 0.00 31.44 31.85 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 3.57 0.22 5.31 3.52 -0.53 -4.92 118.95 126.11 2k6w s ARG 42 Ca 0.00 -1.23 -0.30 0.00 -0.13 0.00 0.00 55.73 54.07 2k6w s ARG 42 Cb 0.00 -5.21 -0.08 0.00 -1.56 0.00 0.00 34.95 28.10 2k6w s ARG 42 CO 0.00 -2.10 1.10 0.54 -0.81 0.00 0.00 175.30 174.03 2k6w s VAL 43 N 4.48 3.71 -0.00 7.11 0.11 -1.26 -1.76 120.40 132.79 2k6w s VAL 43 Ca 0.42 1.56 0.01 0.00 -2.93 0.00 0.00 61.98 61.05 2k6w s VAL 43 Cb -0.02 -3.99 -0.00 0.00 -1.53 0.00 0.00 36.38 30.84 2k6w s VAL 43 CO -0.09 0.31 -0.04 -1.61 -3.33 0.00 0.00 175.10 170.34 2k6w s GLU 44 N -0.77 0.30 -0.21 1.54 2.02 -0.29 -4.92 118.70 116.36 2k6w s GLU 44 Ca 0.48 -0.13 -0.22 0.00 0.02 0.00 0.00 54.97 55.12 2k6w s GLU 44 Cb -0.30 -0.29 -0.02 0.00 0.10 0.00 0.00 34.13 33.62 2k6w s GLU 44 CO 0.37 0.08 0.68 -1.17 0.02 0.00 0.00 175.26 175.24 2k6w s LEU 45 N -0.09 4.12 0.20 1.80 0.20 -1.26 -0.23 118.68 123.42 2k6w s LEU 45 Ca 0.01 0.87 0.07 0.00 0.69 0.00 0.00 54.13 55.77 2k6w s LEU 45 Cb -0.01 -2.96 -0.04 0.00 -0.43 0.00 0.00 46.19 42.74 2k6w s LEU 45 CO -0.00 -0.35 0.05 -1.00 -0.29 0.00 0.00 176.35 174.77 2k6w s HIS 46 N 2.22 2.92 0.49 5.38 3.76 0.18 -1.22 115.29 129.02 2k6w s HIS 46 Ca 0.30 -0.12 0.05 0.00 -0.15 0.00 0.00 55.06 55.14 2k6w s HIS 46 Cb -0.16 -1.38 0.05 0.00 1.11 0.00 0.00 32.58 32.20 2k6w s HIS 46 CO 0.10 0.54 0.40 -0.85 -0.85 0.00 0.00 174.74 174.08 2k6w n GLU 47 N -0.45 0.75 -3.59 1.40 0.28 -0.18 -1.09 120.64 117.76 2k6w n GLU 47 Ca -0.09 -3.04 -0.29 0.00 -0.16 0.00 0.00 57.16 53.58 2k6w n GLU 47 Cb 0.56 0.27 -0.15 0.00 1.43 0.00 0.00 31.44 33.55 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 -2.41 0.15 0.26 3.84 2.01 0.84 -3.68 115.64 116.65 2k6w s THR 48 Ca 0.31 -0.86 -0.06 0.00 0.31 0.00 0.00 61.69 61.38 2k6w s THR 48 Cb -0.02 -1.11 -0.06 0.00 0.01 0.00 0.00 72.50 71.32 2k6w s THR 48 CO 0.19 -0.68 0.54 0.72 -0.69 0.00 0.00 174.62 174.70 2k6w s PHE 49 N 1.99 3.47 0.39 4.92 -0.71 0.28 -4.52 117.98 123.79 2k6w s PHE 49 Ca 0.09 0.68 -0.06 0.00 -1.04 0.00 0.00 56.93 56.60 2k6w s PHE 49 Cb -0.16 -2.13 -0.05 0.00 -1.21 0.00 0.00 43.02 39.47 2k6w s PHE 49 CO -0.32 0.21 0.69 0.00 -1.34 0.00 0.00 175.22 174.46 2k6w s MET 50 N -3.32 3.63 -0.04 1.99 0.23 -1.26 -0.47 119.30 120.05 2k6w s MET 50 Ca 0.44 0.16 -0.29 0.00 -1.03 0.00 0.00 55.69 54.97 2k6w s MET 50 Cb -0.11 -2.49 0.09 0.00 -1.53 0.00 0.00 34.83 30.79 2k6w s MET 50 CO 0.28 0.00 0.78 -0.98 -2.03 0.00 0.00 175.02 173.07 2k6w s ARG 51 N -4.09 0.94 0.90 3.16 1.70 -0.37 -4.89 118.95 116.30 2k6w s ARG 51 Ca 0.47 0.03 -0.13 0.00 -0.47 0.00 0.00 55.73 55.62 2k6w s ARG 51 Cb -0.10 0.44 0.17 0.00 -0.57 0.00 0.00 34.95 34.89 2k6w s ARG 51 CO 0.36 -0.33 1.25 -1.21 -1.08 0.00 0.00 175.30 174.28 2k6w s GLU 52 N -1.87 1.02 0.00 3.89 0.41 -1.26 -0.55 118.70 120.33 2k6w s GLU 52 Ca -0.04 -0.40 0.00 0.00 -0.41 0.00 0.00 54.97 54.11 2k6w s GLU 52 Cb -0.00 -1.93 0.00 0.00 -1.78 0.00 0.00 34.13 30.42 2k6w s GLU 52 CO 0.01 -2.14 0.00 0.28 -0.49 0.00 0.00 175.26 172.93 2k6w n VAL 53 N -3.56 0.00 -0.99 2.63 0.31 -0.18 -4.80 118.33 111.75 2k6w n VAL 53 Ca 0.14 0.00 -0.30 0.00 -0.01 0.00 0.00 64.34 64.16 2k6w n VAL 53 Cb 0.60 0.00 -0.03 0.00 -0.91 0.00 0.00 33.84 33.50 2k6w n VAL 53 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 2k6w n GLU 54 N 0.00 2.33 -0.68 5.55 2.13 -1.26 -4.41 120.64 124.30 2k6w n GLU 54 Ca 0.00 -1.74 0.00 0.00 0.66 0.00 0.00 57.16 56.08 2k6w n GLU 54 Cb 0.00 -2.66 0.00 0.00 0.27 0.00 0.00 31.44 29.05 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 3.89 0.18 3.45 8.31 0.00 -1.26 -4.95 105.19 114.81 2k6w n GLY 55 Ca 0.52 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 46.21 2k6w n GLY 55 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k6w s LYS 56 N -0.96 3.56 -0.04 1.61 -2.85 -1.26 -5.09 119.74 114.70 2k6w s LYS 56 Ca 0.00 -0.58 -0.04 0.00 -1.00 0.00 0.00 55.97 54.35 2k6w s LYS 56 Cb 0.00 -2.81 -0.04 0.00 -2.06 0.00 0.00 37.83 32.92 2k6w s LYS 56 CO 0.00 0.23 0.17 -1.59 0.10 0.00 0.00 175.35 174.25 2k6w s LYS 57 N 0.37 3.42 0.15 1.78 0.00 -1.26 -1.01 119.74 123.19 2k6w s LYS 57 Ca -0.07 -0.27 -0.14 0.00 0.00 0.00 0.00 55.97 55.48 2k6w s LYS 57 Cb -0.15 -3.11 0.02 0.00 0.00 0.00 0.00 37.83 34.59 2k6w s LYS 57 CO 0.04 0.70 0.39 0.08 0.00 0.00 0.00 175.35 176.57 2k6w s VAL 58 N -1.24 0.06 0.75 1.79 1.01 0.28 -4.99 120.40 118.07 2k6w s VAL 58 Ca 0.24 -0.83 -0.08 0.00 0.00 0.00 0.00 61.98 61.31 2k6w s VAL 58 Cb -0.12 -1.41 0.08 0.00 0.00 0.00 0.00 36.38 34.93 2k6w s VAL 58 CO 0.14 -0.29 1.07 0.00 0.00 0.00 0.00 175.10 176.02 2k6w s MET 59 N -3.86 1.96 -0.05 2.72 0.23 -1.26 -1.24 119.30 117.80 2k6w s MET 59 Ca 0.07 -0.27 -0.23 0.00 -1.03 0.00 0.00 55.69 54.23 2k6w s MET 59 Cb 0.02 -2.11 0.05 0.00 -1.53 0.00 0.00 34.83 31.26 2k6w s MET 59 CO -0.07 -1.44 0.51 0.20 -2.03 0.00 0.00 175.02 172.19 2k6w s GLY 60 N -4.58 -0.38 0.19 3.16 0.00 0.38 -4.85 107.32 101.23 2k6w s GLY 60 Ca 0.62 0.93 0.08 0.00 0.00 0.00 0.00 44.72 46.35 2k6w s GLY 60 CO 0.46 0.65 -0.03 1.06 0.00 0.00 0.00 173.10 175.24 2k6w s MET 61 N -1.09 2.28 -0.05 2.90 -1.94 -1.26 -0.56 119.30 119.58 2k6w s MET 61 Ca -0.11 -1.21 -0.30 0.00 -1.71 0.00 0.00 55.69 52.36 2k6w s MET 61 Cb -0.03 -2.26 0.11 0.00 2.01 0.00 0.00 34.83 34.66 2k6w s MET 61 CO 0.07 0.43 0.94 -0.98 -0.01 0.00 0.00 175.02 175.47 2k6w s ARG 62 N -3.04 0.73 0.67 2.03 1.70 -1.24 -5.00 118.95 114.80 2k6w s ARG 62 Ca 0.27 -0.22 -0.15 0.00 -0.47 0.00 0.00 55.73 55.16 2k6w s ARG 62 Cb -0.09 0.34 0.01 0.00 -0.57 0.00 0.00 34.95 34.64 2k6w s ARG 62 CO 0.18 -0.31 1.14 -1.25 -1.08 0.00 0.00 175.30 173.97 2k6w s PRO 63 N -2.80 2.66 0.19 3.89 0.05 -1.26 -1.01 135.00 136.71 2k6w s PRO 63 Ca 0.05 1.50 0.09 0.00 0.05 0.00 0.00 61.00 62.69 2k6w s PRO 63 Cb -0.01 -1.92 -0.04 0.00 0.05 0.00 0.00 34.50 32.57 2k6w s PRO 63 CO -0.07 -1.38 -0.19 0.14 0.05 0.00 0.00 177.00 175.55 2k6w s VAL 64 N -2.22 1.96 -0.25 -0.36 -7.23 -0.36 -4.82 120.40 107.13 2k6w s VAL 64 Ca 0.69 -2.04 0.27 0.00 -1.81 0.00 0.00 61.98 59.10 2k6w s VAL 64 Cb -0.23 -1.97 0.30 0.00 0.56 0.00 0.00 36.38 35.04 2k6w s VAL 64 CO 0.42 -0.34 1.82 1.55 -0.31 0.00 0.00 175.10 178.23 2k6w h PRO 65 N 3.02 0.00 -1.12 4.82 0.13 -1.94 -3.43 132.00 133.47 2k6w h PRO 65 Ca -0.42 0.00 0.36 0.00 -0.87 0.00 0.00 66.00 65.08 2k6w h PRO 65 Cb 1.22 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.19 2k6w h PRO 65 CO 0.53 0.00 0.95 -0.59 -0.23 0.00 0.00 178.00 178.67 2k6w s PHE 66 N -3.47 -0.02 0.44 1.56 -0.12 -1.26 -4.79 117.98 110.32 2k6w s PHE 66 Ca 0.03 -0.01 0.06 0.00 -0.05 0.00 0.00 56.93 56.96 2k6w s PHE 66 Cb 0.09 0.51 -0.05 0.00 -0.63 0.00 0.00 43.02 42.94 2k6w s PHE 66 CO 0.43 -0.07 0.09 -0.51 -0.05 0.00 0.00 175.22 175.11 2k6w s LEU 67 N -2.76 2.82 0.14 -1.99 1.43 0.71 -5.00 118.68 114.04 2k6w s LEU 67 Ca 0.14 -1.33 -0.17 0.00 -1.03 0.00 0.00 54.13 51.74 2k6w s LEU 67 Cb 0.05 -1.05 0.04 0.00 0.03 0.00 0.00 46.19 45.26 2k6w s LEU 67 CO -0.05 -0.61 0.44 -1.83 0.23 0.00 0.00 176.35 174.54 2k6w s GLU 68 N -3.84 1.16 -0.11 1.70 -1.05 -1.26 -0.51 118.70 114.78 2k6w s GLU 68 Ca 0.31 -0.73 -0.06 0.00 -0.15 0.00 0.00 54.97 54.35 2k6w s GLU 68 Cb 0.06 0.49 0.05 0.00 -0.44 0.00 0.00 34.13 34.28 2k6w s GLU 68 CO 0.16 -0.47 0.26 0.08 0.95 0.00 0.00 175.26 176.24 2k6w s VAL 69 N -3.82 -0.04 0.76 1.83 1.01 0.03 -4.95 120.40 115.22 2k6w s VAL 69 Ca 0.04 0.15 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 2k6w s VAL 69 Cb 0.01 -0.40 0.05 0.00 0.00 0.00 0.00 36.38 36.04 2k6w s VAL 69 CO -0.10 0.06 1.08 -2.16 0.00 0.00 0.00 175.10 173.98 2k6w s PRO 70 N 1.28 2.38 0.31 2.72 0.04 -1.26 -0.90 135.00 139.58 2k6w s PRO 70 Ca -0.09 0.82 -0.30 0.00 0.04 0.00 0.00 61.00 61.48 2k6w s PRO 70 Cb -0.10 -1.94 -0.11 0.00 0.04 0.00 0.00 34.50 32.39 2k6w s PRO 70 CO -0.09 -1.46 1.55 -1.25 0.04 0.00 0.00 177.00 175.80 2k6w s PRO 71 N -5.07 4.14 0.00 0.56 0.04 -1.26 -1.97 135.00 131.43 2k6w s PRO 71 Ca 0.60 2.55 0.00 0.00 0.04 0.00 0.00 61.00 64.19 2k6w s PRO 71 Cb -0.15 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.37 2k6w s PRO 71 CO 0.55 -0.58 0.00 1.63 0.04 0.00 0.00 177.00 178.63 2k6w n LYS 72 N 1.78 -0.41 -2.57 4.56 4.01 -0.75 -4.95 118.16 119.84 2k6w n LYS 72 Ca 0.06 0.10 -0.43 0.00 -0.51 0.00 0.00 58.31 57.54 2k6w n LYS 72 Cb 0.38 -4.22 -0.02 0.00 -0.51 0.00 0.00 35.03 30.66 2k6w n LYS 72 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 2k6w s GLY 73 N -2.00 1.50 -0.18 0.72 0.00 -0.83 -4.84 107.32 101.69 2k6w s GLY 73 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 44.72 44.64 2k6w s GLY 73 CO 0.00 2.38 0.08 -1.60 0.00 0.00 0.00 173.10 173.95 2k6w s ARG 74 N 3.81 3.99 0.02 2.90 3.52 -1.26 -1.10 118.95 130.83 2k6w s ARG 74 Ca 0.49 -0.31 -0.11 0.00 -0.13 0.00 0.00 55.73 55.66 2k6w s ARG 74 Cb -0.14 -3.25 0.01 0.00 -1.56 0.00 0.00 34.95 30.02 2k6w s ARG 74 CO 0.18 0.30 0.24 0.14 -0.81 0.00 0.00 175.30 175.35 2k6w s VAL 75 N 0.30 0.09 -0.18 7.11 -7.23 0.04 -4.99 120.40 115.54 2k6w s VAL 75 Ca 0.04 -0.70 -0.09 0.00 -1.81 0.00 0.00 61.98 59.42 2k6w s VAL 75 Cb -0.12 -0.75 -0.05 0.00 0.56 0.00 0.00 36.38 36.02 2k6w s VAL 75 CO -0.00 -0.39 0.10 -1.61 -0.31 0.00 0.00 175.10 172.89 2k6w s GLU 76 N -2.02 4.03 -1.08 4.82 8.01 -1.26 -0.73 118.70 130.47 2k6w s GLU 76 Ca -0.09 -0.27 -0.23 0.00 0.01 0.00 0.00 54.97 54.39 2k6w s GLU 76 Cb -0.03 -3.31 -0.12 0.00 -4.31 0.00 0.00 34.13 26.36 2k6w s GLU 76 CO -0.01 0.33 1.94 1.28 0.01 0.00 0.00 175.26 178.81 2k6w n LEU 77 N 3.39 3.08 -4.80 1.80 4.32 0.09 -4.83 117.00 120.05 2k6w n LEU 77 Ca -0.17 -3.04 -0.35 0.00 -0.02 0.00 0.00 56.01 52.43 2k6w n LEU 77 Cb 0.52 -1.60 -0.07 0.00 -1.62 0.00 0.00 43.42 40.66 2k6w n LEU 77 CO 0.36 -1.71 0.61 -1.59 -1.22 0.00 0.00 177.39 173.84 2k6w s LYS 78 N 6.37 4.37 0.16 3.23 -2.85 -1.08 -3.93 119.74 126.01 2k6w s LYS 78 Ca 0.67 1.15 -0.19 0.00 -1.00 0.00 0.00 55.97 56.61 2k6w s LYS 78 Cb 0.02 -2.55 0.06 0.00 -2.06 0.00 0.00 37.83 33.30 2k6w s LYS 78 CO 0.14 0.17 1.66 -1.00 0.10 0.00 0.00 175.35 176.42 2k6w h PRO 79 N 2.66 -0.07 -3.65 1.78 0.13 -1.94 0.91 132.00 131.83 2k6w h PRO 79 Ca -0.48 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 63.94 2k6w h PRO 79 Cb 1.19 0.02 -0.05 0.00 0.13 0.00 0.00 31.00 32.28 2k6w h PRO 79 CO 0.64 -0.05 3.03 0.41 -0.23 0.00 0.00 178.00 181.80 2k6w n GLY 80 N -1.31 4.50 0.00 1.56 0.00 -1.26 -4.16 105.19 104.51 2k6w n GLY 80 Ca 0.01 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2k6w n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6w n GLY 81 N 3.63 -2.29 3.48 -0.02 0.00 -0.84 -4.97 105.19 104.18 2k6w n GLY 81 Ca 0.55 0.74 -0.14 0.00 0.00 0.00 0.00 46.02 47.17 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 -0.61 -0.07 1.61 2.02 0.26 -0.11 117.35 120.44 2k6w s TYR 82 Ca 0.00 1.36 -0.31 0.00 -0.37 0.00 0.00 57.07 57.76 2k6w s TYR 82 Cb 0.00 0.25 0.12 0.00 -0.40 0.00 0.00 41.96 41.92 2k6w s TYR 82 CO 0.00 -0.38 0.99 -3.38 -1.57 0.00 0.00 175.55 171.21 2k6w s HIS 83 N -0.16 -0.28 -0.26 2.71 -3.43 -0.25 -2.63 115.29 110.99 2k6w s HIS 83 Ca -0.04 0.21 -0.13 0.00 -0.80 0.00 0.00 55.06 54.30 2k6w s HIS 83 Cb -0.03 0.52 -0.04 0.00 -1.43 0.00 0.00 32.58 31.60 2k6w s HIS 83 CO 0.03 -0.42 0.29 -0.06 -2.00 0.00 0.00 174.74 172.57 2k6w s PHE 84 N -2.74 3.26 -0.14 0.38 0.08 -0.49 -0.65 117.98 117.70 2k6w s PHE 84 Ca 0.06 0.31 -0.29 0.00 0.12 0.00 0.00 56.93 57.13 2k6w s PHE 84 Cb -0.01 -2.46 -0.01 0.00 -0.57 0.00 0.00 43.02 39.97 2k6w s PHE 84 CO -0.07 -0.14 1.05 -1.64 -0.10 0.00 0.00 175.22 174.33 2k6w s MET 85 N 1.73 4.36 -1.02 0.44 -1.94 0.68 -0.86 119.30 122.69 2k6w s MET 85 Ca 0.12 1.43 -0.05 0.00 -1.71 0.00 0.00 55.69 55.47 2k6w s MET 85 Cb -0.15 -3.58 0.26 0.00 2.01 0.00 0.00 34.83 33.36 2k6w s MET 85 CO 0.09 -0.44 1.00 1.28 -0.01 0.00 0.00 175.02 176.94 2k6w n LEU 86 N 5.47 5.01 -4.70 -0.03 4.77 -0.27 -1.14 117.00 126.11 2k6w n LEU 86 Ca 0.10 -5.09 -0.42 0.00 -0.03 0.00 0.00 56.01 50.57 2k6w n LEU 86 Cb 0.47 -1.30 -0.03 0.00 -2.33 0.00 0.00 43.42 40.24 2k6w n LEU 86 CO 0.53 1.47 0.76 -0.76 -1.33 0.00 0.00 177.39 178.05 2k6w s LEU 87 N -1.44 4.33 -0.12 2.23 2.01 -0.72 -3.51 118.68 121.46 2k6w s LEU 87 Ca 0.30 1.68 -0.02 0.00 0.01 0.00 0.00 54.13 56.10 2k6w s LEU 87 Cb -0.08 -3.57 0.00 0.00 0.01 0.00 0.00 46.19 42.56 2k6w s LEU 87 CO -0.09 -0.37 0.13 0.61 1.01 0.00 0.00 176.35 177.65 2k6w n GLY 88 N 3.03 -0.65 3.56 -3.19 0.00 -0.83 -1.46 105.19 105.65 2k6w n GLY 88 Ca 0.08 0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.90 3.41 0.00 0.99 1.02 -1.25 -1.05 118.68 119.89 2k6w s LEU 89 Ca 0.02 -1.24 0.00 0.00 0.02 0.00 0.00 54.13 52.94 2k6w s LEU 89 Cb -0.01 -2.57 0.00 0.00 0.02 0.00 0.00 46.19 43.64 2k6w s LEU 89 CO 0.16 -1.86 0.84 2.29 0.02 0.00 0.00 176.35 177.80 2k6w n LYS 90 N 8.88 0.00 -4.05 1.70 2.85 -1.03 -4.25 118.16 122.25 2k6w n LYS 90 Ca 0.35 0.35 -0.16 0.00 -1.05 0.00 0.00 58.31 57.80 2k6w n LYS 90 Cb 0.50 -1.60 -0.15 0.00 -0.65 0.00 0.00 35.03 33.12 2k6w n LYS 90 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 2k6w s ARG 91 N -2.69 0.38 0.34 -1.58 0.52 -1.08 -5.01 118.95 109.84 2k6w s ARG 91 Ca 0.00 -0.07 -0.27 0.00 -0.52 0.00 0.00 55.73 54.86 2k6w s ARG 91 Cb 0.00 -0.43 -0.09 0.00 0.52 0.00 0.00 34.95 34.94 2k6w s ARG 91 CO 0.00 -0.00 1.17 -1.25 0.02 0.00 0.00 175.30 175.24 2k6w s PRO 92 N 0.37 4.33 -1.18 3.54 0.04 -1.26 -4.84 135.00 135.99 2k6w s PRO 92 Ca -0.04 1.91 -0.16 0.00 0.04 0.00 0.00 61.00 62.75 2k6w s PRO 92 Cb -0.07 -2.94 0.14 0.00 0.04 0.00 0.00 34.50 31.67 2k6w s PRO 92 CO -0.01 -0.10 1.46 -0.51 0.04 0.00 0.00 177.00 177.88 2k6w s LEU 93 N -1.98 4.70 -0.39 -3.56 2.01 -1.26 -4.98 118.68 113.22 2k6w s LEU 93 Ca 0.51 -2.67 -0.28 0.00 0.01 0.00 0.00 54.13 51.69 2k6w s LEU 93 Cb -0.33 -2.45 -0.01 0.00 0.01 0.00 0.00 46.19 43.41 2k6w s LEU 93 CO 0.42 -0.92 1.69 -0.75 1.01 0.00 0.00 176.35 177.81 2k6w s LYS 94 N 2.49 3.32 -0.19 1.70 2.36 -1.26 -4.55 119.74 123.60 2k6w s LYS 94 Ca 0.44 1.19 -0.42 0.00 -2.55 0.00 0.00 55.97 54.63 2k6w s LYS 94 Cb -0.01 -4.17 -0.19 0.00 -1.05 0.00 0.00 37.83 32.41 2k6w s LYS 94 CO 0.00 -1.87 1.42 0.00 1.55 0.00 0.00 175.35 176.44 2k6w n ALA 95 N 10.14 -1.78 0.00 3.13 0.00 -1.26 -2.52 120.51 128.21 2k6w n ALA 95 Ca 0.21 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.16 2k6w n ALA 95 Cb 0.48 -1.96 0.00 0.00 0.00 0.00 0.00 19.45 17.97 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 2.99 2.34 3.96 0.00 0.00 -0.38 -5.00 105.19 109.10 2k6w n GLY 96 Ca 0.24 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.25 1.29 -0.14 1.61 0.41 -1.05 -4.75 118.70 115.82 2k6w s GLU 97 Ca 0.00 -0.75 -0.13 0.00 -0.41 0.00 0.00 54.97 53.68 2k6w s GLU 97 Cb 0.00 -2.12 -0.05 0.00 -1.78 0.00 0.00 34.13 30.19 2k6w s GLU 97 CO 0.00 -1.83 0.28 -1.21 -0.49 0.00 0.00 175.26 172.01 2k6w s GLU 98 N -5.46 4.12 -0.31 1.61 8.01 -1.26 -0.11 118.70 125.30 2k6w s GLU 98 Ca 0.69 0.08 -0.11 0.00 0.01 0.00 0.00 54.97 55.64 2k6w s GLU 98 Cb -0.05 -3.38 -0.02 0.00 -4.31 0.00 0.00 34.13 26.38 2k6w s GLU 98 CO 0.48 0.35 0.18 0.08 0.01 0.00 0.00 175.26 176.36 2k6w s VAL 99 N 0.12 4.89 0.32 2.63 1.01 0.64 -4.92 120.40 125.09 2k6w s VAL 99 Ca 0.16 -0.27 -0.26 0.00 0.00 0.00 0.00 61.98 61.61 2k6w s VAL 99 Cb -0.13 -3.47 -0.10 0.00 0.00 0.00 0.00 36.38 32.68 2k6w s VAL 99 CO 0.04 0.08 0.97 -1.61 0.00 0.00 0.00 175.10 174.58 2k6w s GLU 100 N 1.67 4.56 -0.21 2.72 2.02 -1.26 -1.22 118.70 126.97 2k6w s GLU 100 Ca 0.05 1.41 -0.06 0.00 0.02 0.00 0.00 54.97 56.39 2k6w s GLU 100 Cb -0.17 -2.84 0.10 0.00 0.10 0.00 0.00 34.13 31.32 2k6w s GLU 100 CO 0.08 0.24 0.42 -0.51 0.02 0.00 0.00 175.26 175.51 2k6w s LEU 101 N -2.00 -0.67 -0.85 1.80 1.43 -0.08 -4.17 118.68 114.15 2k6w s LEU 101 Ca 0.50 0.83 -0.24 0.00 -1.03 0.00 0.00 54.13 54.18 2k6w s LEU 101 Cb -0.21 1.33 0.05 0.00 0.03 0.00 0.00 46.19 47.39 2k6w s LEU 101 CO 0.26 -0.25 1.30 -1.81 0.23 0.00 0.00 176.35 176.09 2k6w s ASP 102 N 2.61 6.32 -0.15 2.29 1.01 0.38 -0.33 116.67 128.81 2k6w s ASP 102 Ca 0.02 -0.99 -0.29 0.00 0.71 0.00 0.00 52.55 52.00 2k6w s ASP 102 Cb -0.13 -2.54 -0.03 0.00 1.01 0.00 0.00 42.92 41.24 2k6w s ASP 102 CO -0.14 -1.62 1.41 -0.76 0.21 0.00 0.00 175.17 174.27 2k6w s LEU 103 N 5.06 4.18 -0.13 1.23 1.43 -0.48 -1.43 118.68 128.54 2k6w s LEU 103 Ca 0.38 1.81 -0.14 0.00 -1.03 0.00 0.00 54.13 55.14 2k6w s LEU 103 Cb -0.06 -3.54 -0.05 0.00 0.03 0.00 0.00 46.19 42.58 2k6w s LEU 103 CO 0.03 -0.88 0.33 -0.76 0.23 0.00 0.00 176.35 175.30 2k6w s LEU 104 N 3.87 4.29 0.05 1.79 1.43 -0.30 -1.39 118.68 128.42 2k6w s LEU 104 Ca 0.62 0.61 0.04 0.00 -1.03 0.00 0.00 54.13 54.38 2k6w s LEU 104 Cb -0.25 -2.43 -0.02 0.00 0.03 0.00 0.00 46.19 43.52 2k6w s LEU 104 CO 0.21 0.14 -0.13 -0.36 0.23 0.00 0.00 176.35 176.44 2k6w s PHE 105 N 0.16 1.12 0.30 0.29 0.08 -0.28 -0.27 117.98 119.38 2k6w s PHE 105 Ca 0.19 -0.39 -0.30 0.00 0.12 0.00 0.00 56.93 56.56 2k6w s PHE 105 Cb -0.14 -0.66 -0.12 0.00 -0.57 0.00 0.00 43.02 41.53 2k6w s PHE 105 CO 0.06 0.02 1.45 0.00 -0.10 0.00 0.00 175.22 176.65 2k6w n ALA 106 N 1.74 1.75 -2.46 5.36 0.00 -0.51 -2.69 120.51 123.70 2k6w n ALA 106 Ca -0.19 0.38 -0.05 0.00 0.00 0.00 0.00 53.44 53.58 2k6w n ALA 106 Cb 0.55 -2.35 0.03 0.00 0.00 0.00 0.00 19.45 17.68 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 1.63 0.24 1.75 0.00 0.00 -1.26 -4.35 105.19 103.20 2k6w n GLY 107 Ca 0.08 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.03 0.50 3.67 -0.02 0.00 -1.25 -5.07 105.19 102.00 2k6w n GLY 108 Ca -0.08 -0.89 -0.32 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.47 2.69 -0.14 1.61 3.01 -1.10 -5.06 119.74 118.29 2k6w s LYS 109 Ca 0.00 -0.69 -0.11 0.00 -1.01 0.00 0.00 55.97 54.15 2k6w s LYS 109 Cb 0.00 -2.61 0.04 0.00 -1.01 0.00 0.00 37.83 34.25 2k6w s LYS 109 CO 0.00 0.60 0.36 0.54 0.51 0.00 0.00 175.35 177.35 2k6w s VAL 110 N -1.14 -0.01 -0.22 3.17 0.11 -1.26 -1.13 120.40 119.92 2k6w s VAL 110 Ca 0.21 0.03 -0.01 0.00 -2.93 0.00 0.00 61.98 59.28 2k6w s VAL 110 Cb -0.12 -0.51 0.06 0.00 -1.53 0.00 0.00 36.38 34.29 2k6w s VAL 110 CO 0.12 0.01 -0.02 -0.76 -3.33 0.00 0.00 175.10 171.12 2k6w s LEU 111 N 0.47 2.09 -0.08 2.54 1.43 -0.49 -4.97 118.68 119.67 2k6w s LEU 111 Ca -0.02 -1.05 -0.28 0.00 -1.03 0.00 0.00 54.13 51.74 2k6w s LEU 111 Cb -0.04 -0.98 -0.02 0.00 0.03 0.00 0.00 46.19 45.18 2k6w s LEU 111 CO -0.02 -0.26 0.92 -1.59 0.23 0.00 0.00 176.35 175.63 2k6w s LYS 112 N 1.56 4.44 0.37 1.70 -2.85 -1.26 -1.38 119.74 122.31 2k6w s LYS 112 Ca -0.04 1.25 0.08 0.00 -1.00 0.00 0.00 55.97 56.27 2k6w s LYS 112 Cb -0.18 -3.51 -0.07 0.00 -2.06 0.00 0.00 37.83 32.01 2k6w s LYS 112 CO -0.07 -0.20 -0.02 0.14 0.10 0.00 0.00 175.35 175.31 2k6w s VAL 113 N 1.61 2.21 -0.04 1.79 -7.23 0.55 -4.94 120.40 114.35 2k6w s VAL 113 Ca 0.46 -2.05 0.05 0.00 -1.81 0.00 0.00 61.98 58.63 2k6w s VAL 113 Cb -0.19 -2.83 -0.02 0.00 0.56 0.00 0.00 36.38 33.90 2k6w s VAL 113 CO 0.20 -0.11 -0.18 0.54 -0.31 0.00 0.00 175.10 175.24 2k6w s VAL 114 N -2.63 2.73 -0.01 1.32 0.11 -1.26 -0.90 120.40 119.75 2k6w s VAL 114 Ca 0.34 -0.85 -0.00 0.00 -2.93 0.00 0.00 61.98 58.54 2k6w s VAL 114 Cb 0.05 -2.03 0.01 0.00 -1.53 0.00 0.00 36.38 32.88 2k6w s VAL 114 CO 0.18 0.59 0.01 -0.76 -3.33 0.00 0.00 175.10 171.79 2k6w s LEU 115 N -0.68 1.69 0.60 2.54 1.43 -0.36 -5.00 118.68 118.91 2k6w s LEU 115 Ca 0.11 0.02 -0.15 0.00 -1.03 0.00 0.00 54.13 53.07 2k6w s LEU 115 Cb -0.10 -0.01 -0.03 0.00 0.03 0.00 0.00 46.19 46.07 2k6w s LEU 115 CO 0.00 -0.04 1.06 -2.16 0.23 0.00 0.00 176.35 175.44 2k6w s PRO 116 N 0.34 3.25 -0.17 1.29 0.04 -1.26 -0.26 135.00 138.24 2k6w s PRO 116 Ca -0.03 1.21 -0.27 0.00 0.04 0.00 0.00 61.00 61.95 2k6w s PRO 116 Cb -0.04 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 2k6w s PRO 116 CO -0.01 -0.86 0.92 0.08 0.04 0.00 0.00 177.00 177.17 2k6w s VAL 117 N -2.47 4.81 0.23 -0.36 1.01 0.85 -0.63 120.40 123.83 2k6w s VAL 117 Ca 0.64 1.83 -0.18 0.00 0.00 0.00 0.00 61.98 64.26 2k6w s VAL 117 Cb -0.16 -4.22 0.02 0.00 0.00 0.00 0.00 36.38 32.02 2k6w s VAL 117 CO 0.38 -0.03 0.58 -1.61 0.00 0.00 0.00 175.10 174.42 2k6w s GLU 118 N 2.36 1.52 -0.68 2.72 0.41 -0.28 -1.25 118.70 123.50 2k6w s GLU 118 Ca 0.42 -0.93 0.02 0.00 -0.41 0.00 0.00 54.97 54.07 2k6w s GLU 118 Cb -0.17 0.54 0.17 0.00 -1.78 0.00 0.00 34.13 32.90 2k6w s GLU 118 CO 0.12 -0.66 0.48 0.00 -0.49 0.00 0.00 175.26 174.71 2k6w s ALA 119 N -3.90 3.73 -0.23 5.21 0.00 -1.26 -1.63 121.76 123.68 2k6w s ALA 119 Ca 0.11 -3.58 0.02 0.00 0.00 0.00 0.00 51.96 48.51 2k6w s ALA 119 Cb -0.02 -2.40 0.01 0.00 0.00 0.00 0.00 23.12 20.71 2k6w s ALA 119 CO 0.01 -2.09 0.56 0.54 0.00 0.00 0.00 175.76 174.78