#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 0.69 0.00 1.61 0.01 -1.26 -5.07 113.70 109.68 2k6w s SER 2 Ca 0.00 -0.86 0.00 0.00 1.31 0.00 0.00 55.95 56.40 2k6w s SER 2 Cb 0.00 0.13 0.00 0.00 0.21 0.00 0.00 66.02 66.36 2k6w s SER 2 CO 0.00 -0.46 0.56 2.22 0.41 0.00 0.00 173.24 175.97 2k6w n PHE 3 N 0.48 0.00 -3.64 2.43 1.16 -1.26 -5.13 117.46 111.50 2k6w n PHE 3 Ca -0.16 -0.27 -0.23 0.00 -1.87 0.00 0.00 57.45 54.93 2k6w n PHE 3 Cb 0.59 0.38 -0.17 0.00 -1.61 0.00 0.00 39.48 38.67 2k6w n PHE 3 CO 0.00 0.00 0.00 0.95 -1.87 0.00 0.00 176.76 175.84 2k6w s THR 4 N 0.00 -0.11 0.00 1.97 -4.23 -1.26 -5.11 115.64 106.90 2k6w s THR 4 Ca 0.00 0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.66 2k6w s THR 4 Cb 0.00 -0.35 0.00 0.00 1.34 0.00 0.00 72.50 73.49 2k6w s THR 4 CO 0.00 -0.04 0.00 1.21 -0.54 0.00 0.00 174.62 175.25 2k6w n GLU 5 N 5.29 0.36 -4.11 3.99 2.13 -1.26 -4.78 120.64 122.27 2k6w n GLU 5 Ca -0.05 0.00 -0.13 0.00 0.66 0.00 0.00 57.16 57.64 2k6w n GLU 5 Cb 0.50 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 32.14 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 1.27 0.04 8.31 0.00 -1.26 -0.52 107.32 115.15 2k6w s GLY 6 Ca 0.00 -1.43 -0.20 0.00 0.00 0.00 0.00 44.72 43.09 2k6w s GLY 6 CO 0.00 -1.04 0.47 0.66 0.00 0.00 0.00 173.10 173.19 2k6w s TRP 7 N -3.68 -0.35 -0.01 1.90 -2.14 -0.26 -4.34 118.94 110.07 2k6w s TRP 7 Ca 0.31 0.38 -0.05 0.00 2.66 0.00 0.00 56.10 59.40 2k6w s TRP 7 Cb 0.02 0.28 -0.04 0.00 -3.10 0.00 0.00 33.47 30.62 2k6w s TRP 7 CO 0.15 -0.60 0.23 0.08 -2.66 0.00 0.00 176.95 174.16 2k6w s VAL 8 N -2.34 5.36 -0.30 -0.66 1.01 0.23 -2.08 120.40 121.61 2k6w s VAL 8 Ca -0.06 0.06 -0.20 0.00 0.00 0.00 0.00 61.98 61.77 2k6w s VAL 8 Cb -0.01 -3.55 -0.01 0.00 0.00 0.00 0.00 36.38 32.82 2k6w s VAL 8 CO -0.01 0.37 0.62 -0.60 0.00 0.00 0.00 175.10 175.48 2k6w s ARG 9 N -1.78 3.91 0.10 2.72 6.06 -0.13 -1.41 118.95 128.41 2k6w s ARG 9 Ca 0.27 0.30 -0.36 0.00 -2.50 0.00 0.00 55.73 53.43 2k6w s ARG 9 Cb -0.13 -3.72 -0.16 0.00 0.06 0.00 0.00 34.95 30.99 2k6w s ARG 9 CO 0.16 -0.56 1.35 0.34 -2.50 0.00 0.00 175.30 174.09 2k6w n PHE 10 N 5.86 1.56 -3.64 5.12 7.35 0.06 -4.39 117.46 129.38 2k6w n PHE 10 Ca -0.01 0.61 -0.05 0.00 -0.76 0.00 0.00 57.45 57.24 2k6w n PHE 10 Cb 0.49 -2.34 -0.07 0.00 0.35 0.00 0.00 39.48 37.91 2k6w n PHE 10 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 2k6w s SER 11 N 0.48 -0.79 -1.42 -2.13 0.01 -1.26 -4.86 113.70 103.72 2k6w s SER 11 Ca 0.83 1.26 -0.11 0.00 1.31 0.00 0.00 55.95 59.24 2k6w s SER 11 Cb -0.92 1.34 0.06 0.00 0.21 0.00 0.00 66.02 66.71 2k6w s SER 11 CO 0.46 -0.20 2.28 -0.81 0.41 0.00 0.00 173.24 175.39 2k6w n PRO 12 N 4.13 3.43 -2.67 12.44 -0.04 -1.26 -1.88 135.00 149.15 2k6w n PRO 12 Ca -0.19 -2.90 -0.07 0.00 -0.04 0.00 0.00 63.50 60.30 2k6w n PRO 12 Cb 0.58 -3.02 -0.01 0.00 -0.04 0.00 0.00 33.50 31.01 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 3.35 2.64 0.09 0.55 0.00 -1.26 -4.89 105.19 105.67 2k6w n GLY 13 Ca 0.54 -1.48 0.13 0.00 0.00 0.00 0.00 46.02 45.21 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 -5.16 1.61 0.13 -1.91 -3.32 132.00 123.34 2k6w h PRO 14 Ca -0.13 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.65 2k6w h PRO 14 Cb 0.55 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 31.52 2k6w h PRO 14 CO 0.17 0.00 -0.73 -0.80 -0.23 0.00 0.00 178.00 176.41 2k6w s ASN 15 N -4.48 1.83 0.00 1.44 -0.87 -1.26 -0.66 114.94 110.94 2k6w s ASN 15 Ca 0.09 -0.92 0.00 0.00 -1.57 0.00 0.00 52.86 50.45 2k6w s ASN 15 Cb 0.12 -0.03 0.00 0.00 -0.02 0.00 0.00 41.25 41.33 2k6w s ASN 15 CO 0.65 -0.26 0.00 0.00 -2.57 0.00 0.00 177.10 174.92 2k6w n ALA 16 N 0.12 0.00 -2.18 0.60 0.00 -0.17 -4.87 120.51 114.02 2k6w n ALA 16 Ca -0.13 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.24 2k6w n ALA 16 Cb 0.59 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.95 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 -1.07 0.43 0.08 0.00 0.00 -1.26 -0.97 121.76 118.96 2k6w s ALA 17 Ca 0.00 -1.14 -0.08 0.00 0.00 0.00 0.00 51.96 50.73 2k6w s ALA 17 Cb 0.00 0.38 -0.00 0.00 0.00 0.00 0.00 23.12 23.50 2k6w s ALA 17 CO 0.00 -0.41 0.18 0.00 0.00 0.00 0.00 175.76 175.53 2k6w s ALA 18 N -3.93 -0.22 -0.02 0.00 0.00 0.04 -0.96 121.76 116.67 2k6w s ALA 18 Ca 0.09 -0.57 -0.29 0.00 0.00 0.00 0.00 51.96 51.18 2k6w s ALA 18 Cb 0.07 0.43 0.08 0.00 0.00 0.00 0.00 23.12 23.71 2k6w s ALA 18 CO -0.09 -0.47 0.73 0.71 0.00 0.00 0.00 175.76 176.64 2k6w s TYR 19 N -3.59 -0.56 0.09 0.00 1.51 -0.89 -1.40 117.35 112.51 2k6w s TYR 19 Ca 0.03 0.81 -0.26 0.00 -1.01 0.00 0.00 57.07 56.64 2k6w s TYR 19 Cb 0.04 0.46 0.08 0.00 -0.11 0.00 0.00 41.96 42.42 2k6w s TYR 19 CO -0.09 -0.61 0.67 -0.48 -1.11 0.00 0.00 175.55 173.92 2k6w s LEU 20 N -1.61 -0.55 -0.80 -1.29 2.34 -1.26 -1.10 118.68 114.40 2k6w s LEU 20 Ca -0.06 0.15 -0.26 0.00 0.06 0.00 0.00 54.13 54.03 2k6w s LEU 20 Cb -0.00 2.49 0.02 0.00 -0.56 0.00 0.00 46.19 48.14 2k6w s LEU 20 CO 0.02 -0.83 1.45 -0.89 -1.06 0.00 0.00 176.35 175.03 2k6w s THR 21 N -3.09 3.70 0.26 5.48 2.01 0.32 -1.07 115.64 123.26 2k6w s THR 21 Ca -0.01 0.03 -0.13 0.00 0.31 0.00 0.00 61.69 61.89 2k6w s THR 21 Cb -0.01 -4.76 -0.08 0.00 0.01 0.00 0.00 72.50 67.66 2k6w s THR 21 CO -0.08 -1.69 0.64 -0.22 -0.69 0.00 0.00 174.62 172.58 2k6w s LEU 22 N 6.28 4.16 0.18 4.42 0.20 -0.22 -4.86 118.68 128.83 2k6w s LEU 22 Ca 0.44 1.13 -0.11 0.00 0.69 0.00 0.00 54.13 56.28 2k6w s LEU 22 Cb -0.06 -3.79 0.00 0.00 -0.43 0.00 0.00 46.19 41.91 2k6w s LEU 22 CO 0.08 -0.10 0.36 -1.83 -0.29 0.00 0.00 176.35 174.58 2k6w s GLU 23 N -2.71 1.24 -0.32 1.98 -1.05 -1.26 -0.28 118.70 116.29 2k6w s GLU 23 Ca 0.49 -1.09 0.03 0.00 -0.15 0.00 0.00 54.97 54.25 2k6w s GLU 23 Cb -0.12 0.42 0.09 0.00 -0.44 0.00 0.00 34.13 34.09 2k6w s GLU 23 CO 0.19 -0.48 0.03 1.21 0.95 0.00 0.00 175.26 177.16 2k6w s ASN 24 N -2.95 4.66 0.00 0.83 2.47 -0.01 -4.97 114.94 114.97 2k6w s ASN 24 Ca 0.15 -2.00 0.27 0.00 0.42 0.00 0.00 52.86 51.70 2k6w s ASN 24 Cb 0.02 -1.56 1.37 0.00 -1.45 0.00 0.00 41.25 39.63 2k6w s ASN 24 CO -0.00 -0.35 1.92 -0.81 -3.72 0.00 0.00 177.10 174.14 2k6w n PRO 25 N 4.32 0.40 -1.73 0.43 -0.04 -1.26 -1.10 135.00 136.02 2k6w n PRO 25 Ca 0.01 0.03 -0.22 0.00 -0.04 0.00 0.00 63.50 63.28 2k6w n PRO 25 Cb 0.42 -1.50 0.14 0.00 -0.04 0.00 0.00 33.50 32.52 2k6w n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k6w n GLY 26 N 1.00 -0.75 0.38 0.55 0.00 -1.26 -4.64 105.19 100.46 2k6w n GLY 26 Ca 0.13 -1.80 0.04 0.00 0.00 0.00 0.00 46.02 44.39 2k6w n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k6w n ASP 27 N -3.44 1.91 -4.59 1.61 8.00 -1.26 -2.17 116.55 116.61 2k6w n ASP 27 Ca 0.13 -1.48 -0.24 0.00 0.71 0.00 0.00 54.79 53.92 2k6w n ASP 27 Cb 0.46 -0.03 -0.09 0.00 -0.02 0.00 0.00 41.12 41.45 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 -0.78 2.95 0.55 0.64 0.05 -1.26 -4.81 118.68 116.01 2k6w s LEU 28 Ca 0.12 -0.90 -0.12 0.00 0.05 0.00 0.00 54.13 53.28 2k6w s LEU 28 Cb 0.08 -1.40 -0.05 0.00 -2.05 0.00 0.00 46.19 42.77 2k6w s LEU 28 CO 0.11 -0.10 0.96 -2.16 -0.55 0.00 0.00 176.35 174.61 2k6w s PRO 29 N -3.65 3.71 0.07 1.48 0.04 -1.26 -3.97 135.00 131.42 2k6w s PRO 29 Ca 0.33 0.71 0.04 0.00 0.04 0.00 0.00 61.00 62.11 2k6w s PRO 29 Cb -0.03 -2.17 -0.04 0.00 0.04 0.00 0.00 34.50 32.30 2k6w s PRO 29 CO 0.18 -0.38 0.02 -0.51 0.04 0.00 0.00 177.00 176.35 2k6w s LEU 30 N -4.67 3.56 -0.25 -3.56 1.43 -0.02 -4.94 118.68 110.22 2k6w s LEU 30 Ca 0.55 -0.11 0.02 0.00 -1.03 0.00 0.00 54.13 53.56 2k6w s LEU 30 Cb -0.11 -2.23 0.06 0.00 0.03 0.00 0.00 46.19 43.94 2k6w s LEU 30 CO 0.44 0.19 -0.11 -0.60 0.23 0.00 0.00 176.35 176.51 2k6w s ARG 31 N -2.20 2.17 -0.09 1.70 3.52 -1.26 -0.37 118.95 122.42 2k6w s ARG 31 Ca 0.26 -1.24 -0.27 0.00 -0.13 0.00 0.00 55.73 54.35 2k6w s ARG 31 Cb -0.12 -2.80 -0.02 0.00 -1.56 0.00 0.00 34.95 30.45 2k6w s ARG 31 CO 0.18 -0.55 0.87 -1.17 -0.81 0.00 0.00 175.30 173.82 2k6w s LEU 32 N 1.17 4.28 -0.00 -0.88 2.96 0.16 -0.16 118.68 126.21 2k6w s LEU 32 Ca -0.07 1.38 0.00 0.00 -0.22 0.00 0.00 54.13 55.22 2k6w s LEU 32 Cb -0.19 -3.35 -0.00 0.00 0.50 0.00 0.00 46.19 43.15 2k6w s LEU 32 CO -0.06 -0.30 0.02 1.33 -1.32 0.00 0.00 176.35 176.02 2k6w n VAL 33 N 4.24 0.00 -3.29 1.68 0.24 0.68 -0.56 118.33 121.32 2k6w n VAL 33 Ca 0.04 -0.44 0.00 0.00 -2.04 0.00 0.00 64.34 61.90 2k6w n VAL 33 Cb 0.50 0.95 0.00 0.00 -1.47 0.00 0.00 33.84 33.82 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 1.16 -0.74 3.48 7.63 0.00 -1.14 -4.79 105.19 110.78 2k6w n GLY 34 Ca 0.00 -0.80 -0.15 0.00 0.00 0.00 0.00 46.02 45.07 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 0.86 -0.27 4.61 0.00 -1.26 -1.37 121.76 123.33 2k6w s ALA 35 Ca 0.00 -1.57 -0.25 0.00 0.00 0.00 0.00 51.96 50.14 2k6w s ALA 35 Cb 0.00 1.17 0.08 0.00 0.00 0.00 0.00 23.12 24.37 2k6w s ALA 35 CO 0.00 -0.78 0.78 -0.98 0.00 0.00 0.00 175.76 174.78 2k6w s ARG 36 N -3.02 0.77 -0.03 0.00 1.70 -0.68 -4.80 118.95 112.89 2k6w s ARG 36 Ca 0.31 0.93 -0.08 0.00 -0.47 0.00 0.00 55.73 56.42 2k6w s ARG 36 Cb -0.00 0.37 0.01 0.00 -0.57 0.00 0.00 34.95 34.76 2k6w s ARG 36 CO 0.21 -0.09 0.18 -0.08 -1.08 0.00 0.00 175.30 174.44 2k6w s THR 37 N 0.38 0.05 0.36 4.99 -1.32 -1.26 -0.93 115.64 117.91 2k6w s THR 37 Ca 0.00 -0.42 0.31 0.00 -1.21 0.00 0.00 61.69 60.38 2k6w s THR 37 Cb -0.05 -0.40 0.33 0.00 -1.51 0.00 0.00 72.50 70.87 2k6w s THR 37 CO -0.01 -0.23 2.08 1.55 -2.21 0.00 0.00 174.62 175.80 2k6w h PRO 38 N 4.79 0.00 0.00 7.08 0.13 -1.99 -3.16 132.00 138.85 2k6w h PRO 38 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.84 2k6w h PRO 38 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 2k6w h PRO 38 CO 0.40 0.09 0.00 1.33 -0.23 0.00 0.00 178.00 179.58 2k6w n VAL 39 N -3.41 0.00 -3.97 1.56 0.24 -1.26 -4.78 118.33 106.71 2k6w n VAL 39 Ca -0.01 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.06 2k6w n VAL 39 Cb 0.25 -0.57 -0.06 0.00 -1.47 0.00 0.00 33.84 31.98 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 -2.00 3.68 0.00 2.33 0.00 -1.20 -0.93 121.76 123.64 2k6w s ALA 40 Ca 0.40 -1.94 0.00 0.00 0.00 0.00 0.00 51.96 50.42 2k6w s ALA 40 Cb 0.18 -0.69 0.00 0.00 0.00 0.00 0.00 23.12 22.61 2k6w s ALA 40 CO 0.31 -0.10 0.00 -1.91 0.00 0.00 0.00 175.76 174.05 2k6w n GLU 41 N -1.29 0.00 -1.86 0.00 2.13 -0.19 -4.50 120.64 114.93 2k6w n GLU 41 Ca -0.01 0.00 -0.29 0.00 0.66 0.00 0.00 57.16 57.52 2k6w n GLU 41 Cb 0.62 0.00 0.09 0.00 0.27 0.00 0.00 31.44 32.42 2k6w n GLU 41 CO 0.00 0.00 0.00 -0.98 -0.41 0.00 0.00 177.13 175.74 2k6w s ARG 42 N 0.17 1.98 -0.03 5.31 1.70 -1.25 -4.97 118.95 121.87 2k6w s ARG 42 Ca 0.00 0.17 0.01 0.00 -0.47 0.00 0.00 55.73 55.44 2k6w s ARG 42 Cb 0.00 -1.95 0.02 0.00 -0.57 0.00 0.00 34.95 32.45 2k6w s ARG 42 CO 0.00 -1.60 -0.02 0.54 -1.08 0.00 0.00 175.30 173.14 2k6w s VAL 43 N -3.53 0.31 -0.11 4.99 0.11 -1.26 -2.75 120.40 118.16 2k6w s VAL 43 Ca 0.62 -0.03 0.03 0.00 -2.93 0.00 0.00 61.98 59.67 2k6w s VAL 43 Cb -0.11 -0.35 0.00 0.00 -1.53 0.00 0.00 36.38 34.38 2k6w s VAL 43 CO 0.50 0.16 -0.23 -1.61 -3.33 0.00 0.00 175.10 170.58 2k6w s GLU 44 N 0.74 3.04 -0.23 1.54 2.02 -0.53 -4.71 118.70 120.57 2k6w s GLU 44 Ca -0.08 -0.87 -0.28 0.00 0.02 0.00 0.00 54.97 53.76 2k6w s GLU 44 Cb -0.11 -2.35 0.01 0.00 0.10 0.00 0.00 34.13 31.78 2k6w s GLU 44 CO -0.01 0.12 0.97 -1.17 0.02 0.00 0.00 175.26 175.20 2k6w s LEU 45 N 0.49 4.10 0.15 1.80 0.20 -1.26 -0.71 118.68 123.44 2k6w s LEU 45 Ca -0.15 1.28 0.07 0.00 0.69 0.00 0.00 54.13 56.01 2k6w s LEU 45 Cb -0.17 -3.43 -0.04 0.00 -0.43 0.00 0.00 46.19 42.12 2k6w s LEU 45 CO 0.06 -0.62 -0.00 -1.00 -0.29 0.00 0.00 176.35 174.49 2k6w s HIS 46 N 3.07 2.88 0.53 5.38 3.76 -0.21 -1.30 115.29 129.41 2k6w s HIS 46 Ca 0.41 -0.11 0.04 0.00 -0.15 0.00 0.00 55.06 55.26 2k6w s HIS 46 Cb -0.15 -1.43 0.04 0.00 1.11 0.00 0.00 32.58 32.16 2k6w s HIS 46 CO 0.07 0.50 0.74 -1.83 -0.85 0.00 0.00 174.74 173.36 2k6w s GLU 47 N -2.72 2.49 -0.38 1.40 -1.05 0.49 -1.51 118.70 117.41 2k6w s GLU 47 Ca 0.27 -1.09 0.01 0.00 -0.15 0.00 0.00 54.97 54.00 2k6w s GLU 47 Cb -0.10 -2.58 0.13 0.00 -0.44 0.00 0.00 34.13 31.14 2k6w s GLU 47 CO 0.18 -0.68 0.19 0.99 0.95 0.00 0.00 175.26 176.89 2k6w s THR 48 N -2.66 0.90 0.09 1.83 2.01 -0.09 -2.52 115.64 115.20 2k6w s THR 48 Ca 0.58 -2.00 -0.03 0.00 0.31 0.00 0.00 61.69 60.55 2k6w s THR 48 Cb -0.09 -1.65 -0.05 0.00 0.01 0.00 0.00 72.50 70.72 2k6w s THR 48 CO 0.37 -0.86 0.30 0.72 -0.69 0.00 0.00 174.62 174.46 2k6w s PHE 49 N 0.90 3.50 0.23 4.92 -0.71 -0.20 -4.49 117.98 122.13 2k6w s PHE 49 Ca 0.16 0.43 -0.30 0.00 -1.04 0.00 0.00 56.93 56.18 2k6w s PHE 49 Cb -0.22 -1.90 -0.09 0.00 -1.21 0.00 0.00 43.02 39.60 2k6w s PHE 49 CO -0.07 0.52 0.97 1.41 -1.34 0.00 0.00 175.22 176.71 2k6w s MET 50 N -2.50 4.81 -0.29 1.99 1.75 -1.26 -0.60 119.30 123.20 2k6w s MET 50 Ca 0.37 1.54 -0.04 0.00 -1.25 0.00 0.00 55.69 56.30 2k6w s MET 50 Cb -0.13 -3.28 0.16 0.00 2.84 0.00 0.00 34.83 34.43 2k6w s MET 50 CO 0.25 0.44 0.58 -0.98 -0.65 0.00 0.00 175.02 174.66 2k6w s ARG 51 N -1.09 0.53 0.29 4.11 1.70 -0.78 -4.90 118.95 118.82 2k6w s ARG 51 Ca 0.42 1.11 -0.07 0.00 -0.47 0.00 0.00 55.73 56.73 2k6w s ARG 51 Cb -0.27 0.54 -0.06 0.00 -0.57 0.00 0.00 34.95 34.60 2k6w s ARG 51 CO 0.33 -0.46 0.59 -1.21 -1.08 0.00 0.00 175.30 173.47 2k6w s GLU 52 N 2.82 3.69 -0.08 3.89 8.01 -1.26 -1.92 118.70 133.85 2k6w s GLU 52 Ca 0.10 0.13 -0.03 0.00 0.01 0.00 0.00 54.97 55.18 2k6w s GLU 52 Cb -0.14 -2.61 0.05 0.00 -4.31 0.00 0.00 34.13 27.12 2k6w s GLU 52 CO -0.19 0.20 0.16 0.08 0.01 0.00 0.00 175.26 175.51 2k6w s VAL 53 N -2.07 -0.22 0.00 2.63 1.01 -0.07 -4.79 120.40 116.88 2k6w s VAL 53 Ca 0.46 0.32 0.00 0.00 0.00 0.00 0.00 61.98 62.75 2k6w s VAL 53 Cb -0.11 -0.29 0.00 0.00 0.00 0.00 0.00 36.38 35.99 2k6w s VAL 53 CO 0.28 0.13 0.00 1.21 0.00 0.00 0.00 175.10 176.72 2k6w n GLU 54 N 5.08 -0.91 -0.32 2.72 2.13 -1.26 -1.06 120.64 127.03 2k6w n GLU 54 Ca -0.10 0.23 0.00 0.00 0.66 0.00 0.00 57.16 57.95 2k6w n GLU 54 Cb 0.50 -4.00 0.00 0.00 0.27 0.00 0.00 31.44 28.22 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 -1.03 1.23 3.84 8.31 0.00 -1.26 -5.07 105.19 111.21 2k6w n GLY 55 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.42 3.99 0.11 1.61 1.02 -0.22 -5.03 119.74 120.82 2k6w s LYS 56 Ca 0.00 0.50 -0.30 0.00 0.02 0.00 0.00 55.97 56.19 2k6w s LYS 56 Cb 0.00 -3.05 -0.06 0.00 -0.52 0.00 0.00 37.83 34.20 2k6w s LYS 56 CO 0.00 0.55 1.14 0.21 -0.92 0.00 0.00 175.35 176.33 2k6w s LYS 57 N -1.64 4.52 0.27 1.68 2.47 -1.26 -0.89 119.74 124.88 2k6w s LYS 57 Ca 0.33 1.72 -0.09 0.00 -1.56 0.00 0.00 55.97 56.38 2k6w s LYS 57 Cb -0.16 -3.32 -0.01 0.00 -1.46 0.00 0.00 37.83 32.88 2k6w s LYS 57 CO 0.18 -0.09 0.43 0.08 0.16 0.00 0.00 175.35 176.12 2k6w s VAL 58 N 0.42 0.00 0.16 4.02 1.01 -0.81 -4.92 120.40 120.29 2k6w s VAL 58 Ca 0.54 -1.53 0.06 0.00 0.00 0.00 0.00 61.98 61.04 2k6w s VAL 58 Cb -0.29 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.67 2k6w s VAL 58 CO 0.32 0.00 -0.12 -0.32 0.00 0.00 0.00 175.10 174.98 2k6w s MET 59 N -3.76 1.14 0.32 2.72 1.75 -1.26 -1.87 119.30 118.34 2k6w s MET 59 Ca 0.27 -1.46 0.02 0.00 -1.25 0.00 0.00 55.69 53.27 2k6w s MET 59 Cb 0.00 -0.81 -0.02 0.00 2.84 0.00 0.00 34.83 36.84 2k6w s MET 59 CO 0.12 0.12 0.34 0.20 -0.65 0.00 0.00 175.02 175.16 2k6w s GLY 60 N -3.11 1.87 0.04 2.11 0.00 0.23 -4.86 107.32 103.60 2k6w s GLY 60 Ca 0.17 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 43.10 2k6w s GLY 60 CO 0.03 -1.26 -0.04 1.06 0.00 0.00 0.00 173.10 172.89 2k6w s MET 61 N -3.38 0.50 -0.24 2.90 -1.94 -1.26 -1.04 119.30 114.85 2k6w s MET 61 Ca 0.36 -0.92 -0.27 0.00 -1.71 0.00 0.00 55.69 53.15 2k6w s MET 61 Cb 0.02 0.05 0.13 0.00 2.01 0.00 0.00 34.83 37.04 2k6w s MET 61 CO 0.23 -0.05 1.08 0.50 -0.01 0.00 0.00 175.02 176.76 2k6w s ARG 62 N -2.57 0.47 0.62 2.03 3.52 -1.05 -4.96 118.95 117.01 2k6w s ARG 62 Ca -0.04 0.36 -0.18 0.00 -0.13 0.00 0.00 55.73 55.74 2k6w s ARG 62 Cb -0.02 0.23 -0.02 0.00 -1.56 0.00 0.00 34.95 33.57 2k6w s ARG 62 CO -0.04 -0.10 1.20 -1.25 -0.81 0.00 0.00 175.30 174.30 2k6w s PRO 63 N -0.32 2.83 0.26 5.12 0.04 -1.26 -0.38 135.00 141.29 2k6w s PRO 63 Ca 0.02 1.80 0.12 0.00 0.04 0.00 0.00 61.00 62.97 2k6w s PRO 63 Cb -0.03 -1.91 -0.05 0.00 0.04 0.00 0.00 34.50 32.55 2k6w s PRO 63 CO -0.04 -1.31 -0.19 0.14 0.04 0.00 0.00 177.00 175.63 2k6w s VAL 64 N -1.69 2.53 0.11 -0.36 -7.23 -0.42 -4.79 120.40 108.56 2k6w s VAL 64 Ca 0.76 -2.31 0.28 0.00 -1.81 0.00 0.00 61.98 58.91 2k6w s VAL 64 Cb -0.30 -2.31 0.31 0.00 0.56 0.00 0.00 36.38 34.64 2k6w s VAL 64 CO 0.35 -0.35 1.90 1.55 -0.31 0.00 0.00 175.10 178.24 2k6w h PRO 65 N 2.40 0.00 -1.51 4.82 0.13 -1.96 -3.45 132.00 132.43 2k6w h PRO 65 Ca -0.41 0.00 0.33 0.00 -0.87 0.00 0.00 66.00 65.05 2k6w h PRO 65 Cb 1.25 0.00 -0.11 0.00 0.13 0.00 0.00 31.00 32.27 2k6w h PRO 65 CO 0.58 0.12 0.85 -0.59 -0.23 0.00 0.00 178.00 178.73 2k6w s PHE 66 N -3.67 -0.03 0.42 1.56 -0.12 -1.26 -4.84 117.98 110.04 2k6w s PHE 66 Ca 0.01 -0.07 0.05 0.00 -0.05 0.00 0.00 56.93 56.87 2k6w s PHE 66 Cb 0.10 0.55 -0.06 0.00 -0.63 0.00 0.00 43.02 42.97 2k6w s PHE 66 CO 0.60 -0.26 0.02 -0.51 -0.05 0.00 0.00 175.22 175.01 2k6w s LEU 67 N -3.09 2.63 0.15 -1.99 1.43 0.28 -5.02 118.68 113.08 2k6w s LEU 67 Ca 0.16 -1.44 -0.17 0.00 -1.03 0.00 0.00 54.13 51.64 2k6w s LEU 67 Cb 0.04 -0.77 0.04 0.00 0.03 0.00 0.00 46.19 45.53 2k6w s LEU 67 CO -0.04 -0.58 0.47 -1.83 0.23 0.00 0.00 176.35 174.61 2k6w s GLU 68 N -3.77 1.20 -0.15 1.70 -1.05 -1.26 -0.66 118.70 114.71 2k6w s GLU 68 Ca 0.28 -0.73 -0.12 0.00 -0.15 0.00 0.00 54.97 54.26 2k6w s GLU 68 Cb 0.08 0.50 0.04 0.00 -0.44 0.00 0.00 34.13 34.31 2k6w s GLU 68 CO 0.14 -0.49 0.38 0.08 0.95 0.00 0.00 175.26 176.32 2k6w s VAL 69 N -3.82 -0.01 0.98 1.83 1.01 0.50 -4.94 120.40 115.95 2k6w s VAL 69 Ca 0.05 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 61.94 2k6w s VAL 69 Cb 0.01 -0.55 0.18 0.00 0.00 0.00 0.00 36.38 36.01 2k6w s VAL 69 CO -0.09 0.02 1.11 -2.16 0.00 0.00 0.00 175.10 173.97 2k6w s PRO 70 N 0.62 0.61 0.44 2.72 0.04 -1.26 -0.84 135.00 137.33 2k6w s PRO 70 Ca -0.03 0.41 -0.25 0.00 0.04 0.00 0.00 61.00 61.16 2k6w s PRO 70 Cb -0.05 -1.77 -0.08 0.00 0.04 0.00 0.00 34.50 32.64 2k6w s PRO 70 CO -0.04 -2.58 1.42 -1.25 0.04 0.00 0.00 177.00 174.59 2k6w s PRO 71 N -5.08 3.72 0.00 0.56 0.04 -1.25 -2.49 135.00 130.49 2k6w s PRO 71 Ca 0.65 2.41 0.00 0.00 0.04 0.00 0.00 61.00 64.10 2k6w s PRO 71 Cb -0.17 -2.67 0.00 0.00 0.04 0.00 0.00 34.50 31.69 2k6w s PRO 71 CO 0.56 -0.79 0.00 1.63 0.04 0.00 0.00 177.00 178.44 2k6w n LYS 72 N -0.15 -1.02 -2.74 4.56 4.76 -0.26 -4.95 118.16 118.36 2k6w n LYS 72 Ca 0.05 0.25 -0.43 0.00 -2.87 0.00 0.00 58.31 55.32 2k6w n LYS 72 Cb 0.42 -4.37 -0.03 0.00 -1.84 0.00 0.00 35.03 29.20 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 1.57 -0.11 0.72 0.00 -1.04 -4.84 107.32 101.62 2k6w s GLY 73 Ca 0.00 -0.27 -0.10 0.00 0.00 0.00 0.00 44.72 44.34 2k6w s GLY 73 CO 0.00 2.11 0.23 1.09 0.00 0.00 0.00 173.10 176.53 2k6w s ARG 74 N 3.53 3.78 -0.09 2.90 1.04 -1.26 -0.83 118.95 128.03 2k6w s ARG 74 Ca 0.41 0.04 -0.04 0.00 -1.04 0.00 0.00 55.73 55.09 2k6w s ARG 74 Cb -0.12 -3.26 0.04 0.00 -2.04 0.00 0.00 34.95 29.57 2k6w s ARG 74 CO 0.17 0.62 0.20 0.14 -0.04 0.00 0.00 175.30 176.38 2k6w s VAL 75 N -0.64 -0.06 -0.15 4.99 -7.23 0.62 -4.99 120.40 112.94 2k6w s VAL 75 Ca 0.17 0.17 -0.25 0.00 -1.81 0.00 0.00 61.98 60.26 2k6w s VAL 75 Cb -0.13 -0.32 -0.02 0.00 0.56 0.00 0.00 36.38 36.47 2k6w s VAL 75 CO 0.06 0.07 0.83 -1.61 -0.31 0.00 0.00 175.10 174.14 2k6w s GLU 76 N 1.29 4.33 0.51 4.82 8.01 -1.26 -1.06 118.70 135.33 2k6w s GLU 76 Ca -0.09 1.04 -0.23 0.00 0.01 0.00 0.00 54.97 55.70 2k6w s GLU 76 Cb -0.11 -3.56 -0.06 0.00 -4.31 0.00 0.00 34.13 26.09 2k6w s GLU 76 CO -0.07 -0.28 1.34 -0.51 0.01 0.00 0.00 175.26 175.75 2k6w s LEU 77 N 1.98 3.94 -0.22 1.80 1.02 -0.23 -4.96 118.68 122.01 2k6w s LEU 77 Ca 0.39 2.73 -0.19 0.00 0.02 0.00 0.00 54.13 57.08 2k6w s LEU 77 Cb -0.17 -4.18 0.06 0.00 0.02 0.00 0.00 46.19 41.91 2k6w s LEU 77 CO 0.14 -1.37 0.57 -1.59 0.02 0.00 0.00 176.35 174.11 2k6w s LYS 78 N -2.76 0.66 0.46 1.70 -2.85 -0.61 -4.32 119.74 112.01 2k6w s LYS 78 Ca 0.68 0.82 0.22 0.00 -1.00 0.00 0.00 55.97 56.68 2k6w s LYS 78 Cb -0.39 0.30 1.11 0.00 -2.06 0.00 0.00 37.83 36.78 2k6w s LYS 78 CO 0.48 -0.09 1.95 -1.00 0.10 0.00 0.00 175.35 176.79 2k6w h PRO 79 N 5.45 0.00 -5.03 1.78 0.13 -1.96 0.47 132.00 132.83 2k6w h PRO 79 Ca -0.29 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 64.15 2k6w h PRO 79 Cb 1.17 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.13 2k6w h PRO 79 CO 0.15 0.22 0.98 0.20 -0.23 0.00 0.00 178.00 179.33 2k6w s GLY 80 N -4.25 1.99 0.00 1.56 0.00 -1.26 -4.64 107.32 100.73 2k6w s GLY 80 Ca -0.02 -2.87 0.00 0.00 0.00 0.00 0.00 44.72 41.83 2k6w s GLY 80 CO 0.64 2.06 0.00 0.61 0.00 0.00 0.00 173.10 176.41 2k6w n GLY 81 N 5.28 -0.26 3.28 0.20 0.00 -0.98 -5.07 105.19 107.65 2k6w n GLY 81 Ca 0.27 0.11 -0.14 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.31 0.12 1.61 2.02 0.12 -0.92 117.35 119.99 2k6w s TYR 82 Ca 0.00 0.62 -0.17 0.00 -0.37 0.00 0.00 57.07 57.15 2k6w s TYR 82 Cb 0.00 0.14 0.04 0.00 -0.40 0.00 0.00 41.96 41.74 2k6w s TYR 82 CO 0.00 -0.34 0.41 -3.38 -1.57 0.00 0.00 175.55 170.67 2k6w s HIS 83 N -0.77 -0.23 -0.29 2.71 -3.43 -0.57 -1.58 115.29 111.13 2k6w s HIS 83 Ca -0.09 -0.05 -0.16 0.00 -0.80 0.00 0.00 55.06 53.97 2k6w s HIS 83 Cb -0.04 0.27 -0.03 0.00 -1.43 0.00 0.00 32.58 31.35 2k6w s HIS 83 CO 0.03 -0.69 0.43 -0.06 -2.00 0.00 0.00 174.74 172.45 2k6w s PHE 84 N -3.63 3.23 -0.20 0.38 0.08 -0.49 -1.04 117.98 116.31 2k6w s PHE 84 Ca 0.02 0.38 -0.21 0.00 0.12 0.00 0.00 56.93 57.24 2k6w s PHE 84 Cb 0.01 -2.68 -0.02 0.00 -0.57 0.00 0.00 43.02 39.76 2k6w s PHE 84 CO -0.11 -0.32 0.63 1.41 -0.10 0.00 0.00 175.22 176.74 2k6w s MET 85 N 2.18 4.20 -0.23 0.44 -2.45 0.11 -0.78 119.30 122.77 2k6w s MET 85 Ca 0.17 0.62 -0.08 0.00 -1.25 0.00 0.00 55.69 55.15 2k6w s MET 85 Cb -0.16 -3.58 -0.03 0.00 1.25 0.00 0.00 34.83 32.31 2k6w s MET 85 CO 0.11 -0.26 0.08 -0.51 1.05 0.00 0.00 175.02 175.48 2k6w s LEU 86 N 1.97 3.57 0.15 4.11 2.01 -0.15 -1.45 118.68 128.89 2k6w s LEU 86 Ca 0.29 -0.12 0.11 0.00 0.01 0.00 0.00 54.13 54.41 2k6w s LEU 86 Cb -0.16 -1.95 -0.04 0.00 0.01 0.00 0.00 46.19 44.06 2k6w s LEU 86 CO 0.10 0.02 -0.25 -0.22 1.01 0.00 0.00 176.35 177.01 2k6w s LEU 87 N 1.31 2.37 -1.39 1.79 0.20 -1.11 -1.00 118.68 120.85 2k6w s LEU 87 Ca 0.05 -0.79 -0.08 0.00 0.69 0.00 0.00 54.13 53.99 2k6w s LEU 87 Cb -0.15 -1.13 0.03 0.00 -0.43 0.00 0.00 46.19 44.51 2k6w s LEU 87 CO 0.04 0.13 1.03 0.61 -0.29 0.00 0.00 176.35 177.87 2k6w n GLY 88 N 0.65 -0.47 3.65 7.98 0.00 -0.92 -1.02 105.19 115.06 2k6w n GLY 88 Ca -0.16 0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 2k6w n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k6w n LEU 89 N -4.69 2.93 0.00 0.99 4.77 0.16 -2.26 117.00 118.90 2k6w n LEU 89 Ca -0.06 1.14 0.07 0.00 -0.03 0.00 0.00 56.01 57.14 2k6w n LEU 89 Cb 0.58 -1.40 0.34 0.00 -2.33 0.00 0.00 43.42 40.60 2k6w n LEU 89 CO 0.69 -1.01 0.74 0.29 -1.33 0.00 0.00 177.39 176.77 2k6w n LYS 90 N 0.41 0.02 -3.55 3.23 4.76 -0.10 -4.78 118.16 118.15 2k6w n LYS 90 Ca 0.07 0.22 -0.11 0.00 -2.87 0.00 0.00 58.31 55.63 2k6w n LYS 90 Cb 0.36 -1.50 -0.05 0.00 -1.84 0.00 0.00 35.03 32.01 2k6w n LYS 90 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2k6w s ARG 91 N -2.95 0.71 0.56 1.97 1.70 -1.26 -5.08 118.95 114.59 2k6w s ARG 91 Ca 0.08 0.07 -0.20 0.00 -0.47 0.00 0.00 55.73 55.22 2k6w s ARG 91 Cb 0.10 0.33 -0.05 0.00 -0.57 0.00 0.00 34.95 34.77 2k6w s ARG 91 CO 0.28 -0.24 1.20 -1.25 -1.08 0.00 0.00 175.30 174.21 2k6w s PRO 92 N -1.53 3.16 0.53 3.89 0.04 -1.25 -4.88 135.00 134.96 2k6w s PRO 92 Ca -0.02 1.81 -0.15 0.00 0.04 0.00 0.00 61.00 62.69 2k6w s PRO 92 Cb -0.00 -2.03 -0.07 0.00 0.04 0.00 0.00 34.50 32.43 2k6w s PRO 92 CO 0.01 -1.05 0.99 -0.51 0.04 0.00 0.00 177.00 176.47 2k6w s LEU 93 N -3.83 3.56 0.00 -3.56 2.01 -0.79 -4.89 118.68 111.17 2k6w s LEU 93 Ca 0.74 1.53 0.00 0.00 0.01 0.00 0.00 54.13 56.41 2k6w s LEU 93 Cb -0.30 -4.48 0.00 0.00 0.01 0.00 0.00 46.19 41.42 2k6w s LEU 93 CO 0.33 -0.63 0.00 1.17 1.01 0.00 0.00 176.35 178.23 2k6w n LYS 94 N -1.79 2.24 0.00 1.70 0.00 -1.26 -4.06 118.16 114.99 2k6w n LYS 94 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 58.31 58.37 2k6w n LYS 94 Cb 0.54 -0.98 0.00 0.00 0.00 0.00 0.00 35.03 34.59 2k6w n LYS 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k6w n ALA 95 N -1.70 0.00 -3.16 3.14 0.00 -1.26 -5.02 120.51 112.50 2k6w n ALA 95 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.30 2k6w n ALA 95 Cb 0.26 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.78 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 -1.95 -0.85 3.54 0.00 0.00 -0.63 -5.01 105.19 100.29 2k6w n GLY 96 Ca 0.00 0.42 -0.07 0.00 0.00 0.00 0.00 46.02 46.37 2k6w n GLY 96 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2k6w s GLU 97 N -4.50 0.86 0.29 1.61 -1.05 -1.26 -5.03 118.70 109.62 2k6w s GLU 97 Ca 0.33 -0.35 0.09 0.00 -0.15 0.00 0.00 54.97 54.89 2k6w s GLU 97 Cb -0.04 0.38 -0.04 0.00 -0.44 0.00 0.00 34.13 33.98 2k6w s GLU 97 CO 0.68 -0.38 0.04 -1.21 0.95 0.00 0.00 175.26 175.34 2k6w s GLU 98 N -3.12 2.33 -0.08 -4.83 2.02 -1.26 -0.12 118.70 113.62 2k6w s GLU 98 Ca 0.06 -1.45 -0.04 0.00 0.02 0.00 0.00 54.97 53.56 2k6w s GLU 98 Cb -0.01 -2.17 0.04 0.00 0.10 0.00 0.00 34.13 32.10 2k6w s GLU 98 CO -0.07 0.30 0.19 0.08 0.02 0.00 0.00 175.26 175.77 2k6w s VAL 99 N -2.35 -0.11 0.27 2.63 1.01 0.71 -4.86 120.40 117.71 2k6w s VAL 99 Ca 0.33 0.21 -0.29 0.00 0.00 0.00 0.00 61.98 62.22 2k6w s VAL 99 Cb -0.05 -0.30 -0.09 0.00 0.00 0.00 0.00 36.38 35.93 2k6w s VAL 99 CO 0.21 0.08 1.05 -1.61 0.00 0.00 0.00 175.10 174.83 2k6w s GLU 100 N 1.46 4.69 -0.12 2.72 2.02 -1.26 -1.10 118.70 127.11 2k6w s GLU 100 Ca -0.07 1.70 -0.08 0.00 0.02 0.00 0.00 54.97 56.54 2k6w s GLU 100 Cb -0.11 -3.19 0.04 0.00 0.10 0.00 0.00 34.13 30.96 2k6w s GLU 100 CO -0.07 0.30 0.29 -1.17 0.02 0.00 0.00 175.26 174.63 2k6w s LEU 101 N -1.41 0.61 -0.35 1.80 0.20 -0.73 -4.18 118.68 114.63 2k6w s LEU 101 Ca 0.44 0.61 -0.10 0.00 0.69 0.00 0.00 54.13 55.76 2k6w s LEU 101 Cb -0.30 0.97 0.01 0.00 -0.43 0.00 0.00 46.19 46.44 2k6w s LEU 101 CO 0.38 -0.13 0.18 -1.81 -0.29 0.00 0.00 176.35 174.68 2k6w s ASP 102 N 0.66 5.65 -0.22 3.68 1.11 -0.11 -0.38 116.67 127.07 2k6w s ASP 102 Ca -0.04 -0.82 -0.29 0.00 0.18 0.00 0.00 52.55 51.58 2k6w s ASP 102 Cb -0.05 -2.01 -0.01 0.00 1.07 0.00 0.00 42.92 41.92 2k6w s ASP 102 CO -0.04 -0.31 1.24 -0.76 1.18 0.00 0.00 175.17 176.48 2k6w s LEU 103 N 1.57 4.07 -0.25 1.23 1.43 0.47 -1.69 118.68 125.51 2k6w s LEU 103 Ca 0.03 1.49 -0.16 0.00 -1.03 0.00 0.00 54.13 54.45 2k6w s LEU 103 Cb -0.18 -3.54 -0.03 0.00 0.03 0.00 0.00 46.19 42.46 2k6w s LEU 103 CO 0.06 -0.85 0.44 -0.76 0.23 0.00 0.00 176.35 175.47 2k6w s LEU 104 N 3.73 4.07 -0.15 1.79 1.43 -0.47 -1.94 118.68 127.15 2k6w s LEU 104 Ca 0.54 0.45 0.01 0.00 -1.03 0.00 0.00 54.13 54.10 2k6w s LEU 104 Cb -0.19 -2.55 0.01 0.00 0.03 0.00 0.00 46.19 43.48 2k6w s LEU 104 CO 0.16 -0.20 -0.18 -0.36 0.23 0.00 0.00 176.35 176.00 2k6w s PHE 105 N 1.97 2.74 0.00 0.29 0.08 -0.13 -0.23 117.98 122.71 2k6w s PHE 105 Ca 0.19 -1.24 0.00 0.00 0.12 0.00 0.00 56.93 56.00 2k6w s PHE 105 Cb -0.15 -1.87 0.00 0.00 -0.57 0.00 0.00 43.02 40.42 2k6w s PHE 105 CO 0.09 -0.58 0.00 0.00 -0.10 0.00 0.00 175.22 174.63 2k6w n ALA 106 N 4.16 0.00 -0.13 5.36 0.00 0.77 -1.20 120.51 129.48 2k6w n ALA 106 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 2k6w n ALA 106 Cb 0.51 -0.33 0.00 0.00 0.00 0.00 0.00 19.45 19.64 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 -1.57 0.83 0.00 0.00 0.00 -1.26 -4.98 105.19 98.21 2k6w n GLY 107 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -2.09 1.00 3.18 -0.02 0.00 -0.34 -5.11 105.19 101.81 2k6w n GLY 108 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2k6w n GLY 108 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2k6w s LYS 109 N 0.00 0.74 -0.12 1.61 2.47 -0.52 -5.05 119.74 118.87 2k6w s LYS 109 Ca 0.00 -0.77 -0.06 0.00 -1.56 0.00 0.00 55.97 53.57 2k6w s LYS 109 Cb 0.00 0.30 0.05 0.00 -1.46 0.00 0.00 37.83 36.72 2k6w s LYS 109 CO 0.00 -0.22 0.29 0.54 0.16 0.00 0.00 175.35 176.12 2k6w s VAL 110 N -3.07 -0.08 -0.09 4.02 0.11 -1.26 -0.96 120.40 119.06 2k6w s VAL 110 Ca -0.01 0.15 0.02 0.00 -2.93 0.00 0.00 61.98 59.21 2k6w s VAL 110 Cb 0.01 -0.45 -0.02 0.00 -1.53 0.00 0.00 36.38 34.40 2k6w s VAL 110 CO -0.07 0.06 -0.16 -0.76 -3.33 0.00 0.00 175.10 170.84 2k6w s LEU 111 N 1.42 2.58 0.04 2.54 2.01 -0.82 -4.96 118.68 121.50 2k6w s LEU 111 Ca -0.08 -0.33 -0.24 0.00 0.01 0.00 0.00 54.13 53.48 2k6w s LEU 111 Cb -0.10 -1.54 -0.06 0.00 0.01 0.00 0.00 46.19 44.50 2k6w s LEU 111 CO -0.10 0.23 0.73 -0.75 1.01 0.00 0.00 176.35 177.48 2k6w s LYS 112 N -0.05 4.46 0.34 1.70 2.20 -1.26 -0.40 119.74 126.73 2k6w s LYS 112 Ca -0.04 1.01 0.10 0.00 -0.36 0.00 0.00 55.97 56.67 2k6w s LYS 112 Cb -0.14 -3.35 -0.06 0.00 -1.51 0.00 0.00 37.83 32.76 2k6w s LYS 112 CO 0.04 0.32 -0.07 0.14 -0.36 0.00 0.00 175.35 175.42 2k6w s VAL 113 N -0.14 2.40 0.01 4.02 -7.23 0.49 -4.96 120.40 114.99 2k6w s VAL 113 Ca 0.37 -2.15 0.06 0.00 -1.81 0.00 0.00 61.98 58.46 2k6w s VAL 113 Cb -0.20 -2.67 -0.02 0.00 0.56 0.00 0.00 36.38 34.05 2k6w s VAL 113 CO 0.22 -0.22 -0.20 0.54 -0.31 0.00 0.00 175.10 175.14 2k6w s VAL 114 N -2.57 1.55 -0.01 1.32 0.11 -1.26 -1.77 120.40 117.77 2k6w s VAL 114 Ca 0.33 -0.98 0.01 0.00 -2.93 0.00 0.00 61.98 58.41 2k6w s VAL 114 Cb 0.01 -1.32 0.00 0.00 -1.53 0.00 0.00 36.38 33.54 2k6w s VAL 114 CO 0.17 0.31 -0.04 -0.76 -3.33 0.00 0.00 175.10 171.46 2k6w s LEU 115 N -0.78 1.91 0.41 2.54 1.43 -0.26 -4.88 118.68 119.05 2k6w s LEU 115 Ca 0.07 -0.07 -0.20 0.00 -1.03 0.00 0.00 54.13 52.90 2k6w s LEU 115 Cb -0.08 -0.23 -0.11 0.00 0.03 0.00 0.00 46.19 45.81 2k6w s LEU 115 CO 0.00 0.04 0.91 -2.16 0.23 0.00 0.00 176.35 175.37 2k6w s PRO 116 N 0.03 4.18 -0.24 1.29 0.04 -1.26 -0.21 135.00 138.84 2k6w s PRO 116 Ca 0.00 1.03 -0.22 0.00 0.04 0.00 0.00 61.00 61.86 2k6w s PRO 116 Cb -0.03 -2.23 -0.02 0.00 0.04 0.00 0.00 34.50 32.27 2k6w s PRO 116 CO -0.00 0.00 0.69 0.08 0.04 0.00 0.00 177.00 177.81 2k6w s VAL 117 N -2.15 4.95 0.09 -0.36 1.01 0.82 -0.60 120.40 124.16 2k6w s VAL 117 Ca 0.60 1.27 -0.04 0.00 0.00 0.00 0.00 61.98 63.82 2k6w s VAL 117 Cb -0.09 -3.99 -0.03 0.00 0.00 0.00 0.00 36.38 32.27 2k6w s VAL 117 CO 0.14 0.01 0.08 -1.61 0.00 0.00 0.00 175.10 173.72 2k6w s GLU 118 N 2.51 0.81 -0.20 2.72 2.02 -0.50 -1.60 118.70 124.46 2k6w s GLU 118 Ca 0.29 -1.21 -0.14 0.00 0.02 0.00 0.00 54.97 53.93 2k6w s GLU 118 Cb -0.15 0.27 -0.04 0.00 0.10 0.00 0.00 34.13 34.30 2k6w s GLU 118 CO 0.08 -0.22 0.31 0.00 0.02 0.00 0.00 175.26 175.45 2k6w s ALA 119 N -3.95 3.58 0.00 5.21 0.00 -1.26 -0.76 121.76 124.58 2k6w s ALA 119 Ca 0.12 -0.60 0.00 0.00 0.00 0.00 0.00 51.96 51.48 2k6w s ALA 119 Cb 0.07 -2.50 0.00 0.00 0.00 0.00 0.00 23.12 20.69 2k6w s ALA 119 CO -0.06 -0.18 0.00 0.54 0.00 0.00 0.00 175.76 176.07