#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k6z n SER 2 N 0.00 0.63 -4.82 1.61 7.64 -1.26 -5.13 113.62 112.28 2k6z n SER 2 Ca 0.00 -1.50 -0.33 0.00 1.01 0.00 0.00 58.87 58.05 2k6z n SER 2 Cb 0.00 -0.23 -0.07 0.00 -1.01 0.00 0.00 64.21 62.90 2k6z n SER 2 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 2k6z s PHE 3 N -0.89 3.32 -1.91 1.43 0.08 -1.26 -4.43 117.98 114.31 2k6z s PHE 3 Ca 0.26 1.55 0.00 0.00 0.12 0.00 0.00 56.93 58.86 2k6z s PHE 3 Cb -0.02 -2.80 0.00 0.00 -0.57 0.00 0.00 43.02 39.63 2k6z s PHE 3 CO 0.17 -0.09 0.00 0.25 -0.10 0.00 0.00 175.22 175.45 2k6z n THR 4 N -0.64 -0.46 -1.28 0.64 -2.24 0.23 -4.91 114.28 105.62 2k6z n THR 4 Ca 0.06 0.00 -0.37 0.00 -2.27 0.00 0.00 64.05 61.48 2k6z n THR 4 Cb 0.54 -2.38 -0.02 0.00 -2.10 0.00 0.00 70.33 66.36 2k6z n THR 4 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2k6z n GLU 5 N -2.66 3.25 -4.10 -0.78 1.02 -1.23 -4.84 120.64 111.31 2k6z n GLU 5 Ca -0.22 -2.13 -0.22 0.00 -0.02 0.00 0.00 57.16 54.57 2k6z n GLU 5 Cb 0.67 -2.82 -0.04 0.00 -0.02 0.00 0.00 31.44 29.22 2k6z n GLU 5 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 2k6z s GLY 6 N 2.61 1.39 0.10 0.62 0.00 -1.26 -3.85 107.32 106.93 2k6z s GLY 6 Ca 0.61 -1.40 -0.21 0.00 0.00 0.00 0.00 44.72 43.73 2k6z s GLY 6 CO -0.05 -1.43 0.51 0.66 0.00 0.00 0.00 173.10 172.78 2k6z s TRP 7 N -2.11 -0.40 0.03 1.90 -2.14 -0.99 -4.14 118.94 111.09 2k6z s TRP 7 Ca 0.33 0.28 -0.06 0.00 2.66 0.00 0.00 56.10 59.31 2k6z s TRP 7 Cb -0.08 0.38 -0.05 0.00 -3.10 0.00 0.00 33.47 30.62 2k6z s TRP 7 CO 0.25 -0.71 0.28 0.08 -2.66 0.00 0.00 176.95 174.19 2k6z s VAL 8 N -3.15 5.29 0.00 -0.66 1.01 0.10 -1.63 120.40 121.36 2k6z s VAL 8 Ca -0.01 0.12 0.00 0.00 0.00 0.00 0.00 61.98 62.09 2k6z s VAL 8 Cb -0.00 -3.58 0.00 0.00 0.00 0.00 0.00 36.38 32.80 2k6z s VAL 8 CO -0.07 0.32 0.00 0.54 0.00 0.00 0.00 175.10 175.88 2k6z n ARG 9 N 0.96 1.04 -4.22 2.72 5.12 -0.87 -1.53 116.66 119.88 2k6z n ARG 9 Ca -0.10 0.00 -0.20 0.00 -1.93 0.00 0.00 57.85 55.62 2k6z n ARG 9 Cb 0.53 0.00 -0.12 0.00 -1.16 0.00 0.00 32.46 31.71 2k6z n ARG 9 CO 0.00 0.00 0.00 0.12 -1.93 0.00 0.00 177.63 175.82 2k6z s PHE 10 N 0.00 1.43 -0.23 -1.55 5.36 -0.20 -4.27 117.98 118.52 2k6z s PHE 10 Ca 0.00 -0.46 -0.28 0.00 -0.96 0.00 0.00 56.93 55.24 2k6z s PHE 10 Cb 0.00 -0.79 0.14 0.00 -0.34 0.00 0.00 43.02 42.03 2k6z s PHE 10 CO 0.00 0.12 1.10 0.45 -1.46 0.00 0.00 175.22 175.43 2k6z s SER 11 N -1.89 -0.33 0.44 6.13 0.15 -1.26 -4.87 113.70 112.07 2k6z s SER 11 Ca 0.02 0.50 0.25 0.00 0.70 0.00 0.00 55.95 57.41 2k6z s SER 11 Cb -0.09 0.46 0.72 0.00 -1.71 0.00 0.00 66.02 65.39 2k6z s SER 11 CO 0.03 -0.20 1.74 1.55 1.20 0.00 0.00 173.24 177.56 2k6z h PRO 12 N 3.16 0.00 0.00 5.44 0.13 -1.92 -3.46 132.00 135.35 2k6z h PRO 12 Ca -0.22 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 2k6z h PRO 12 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 2k6z h PRO 12 CO 0.21 0.15 0.00 0.41 -0.23 0.00 0.00 178.00 178.55 2k6z n GLY 13 N 0.57 2.32 0.00 1.56 0.00 -1.26 -4.94 105.19 103.45 2k6z n GLY 13 Ca 0.02 -1.96 0.16 0.00 0.00 0.00 0.00 46.02 44.23 2k6z n GLY 13 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k6z n PRO 14 N -1.60 0.95 -3.89 1.61 -0.04 -1.26 -5.01 135.00 125.75 2k6z n PRO 14 Ca 0.00 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.37 2k6z n PRO 14 Cb 0.00 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 31.89 2k6z n PRO 14 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2k6z s ASN 15 N -2.05 0.07 0.36 3.54 2.20 -1.26 -1.49 114.94 116.30 2k6z s ASN 15 Ca 0.46 -0.74 0.05 0.00 -0.94 0.00 0.00 52.86 51.70 2k6z s ASN 15 Cb 0.22 0.39 -0.02 0.00 -2.00 0.00 0.00 41.25 39.84 2k6z s ASN 15 CO 0.38 -0.81 0.19 0.00 -2.94 0.00 0.00 177.10 173.91 2k6z n ALA 16 N -0.14 0.59 -2.79 3.54 0.00 0.55 -4.74 120.51 117.52 2k6z n ALA 16 Ca -0.12 -1.91 -0.15 0.00 0.00 0.00 0.00 53.44 51.27 2k6z n ALA 16 Cb 0.63 1.38 -0.12 0.00 0.00 0.00 0.00 19.45 21.34 2k6z n ALA 16 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2k6z s ALA 17 N -3.13 0.66 0.03 0.00 0.00 -1.26 -0.63 121.76 117.42 2k6z s ALA 17 Ca 0.26 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.59 2k6z s ALA 17 Cb 0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 2k6z s ALA 17 CO 0.19 0.06 -0.05 0.00 0.00 0.00 0.00 175.76 175.96 2k6z s ALA 18 N -0.97 0.30 -0.07 0.00 0.00 -0.20 -2.05 121.76 118.77 2k6z s ALA 18 Ca -0.05 -0.59 0.03 0.00 0.00 0.00 0.00 51.96 51.35 2k6z s ALA 18 Cb -0.08 0.08 -0.02 0.00 0.00 0.00 0.00 23.12 23.11 2k6z s ALA 18 CO 0.00 -0.08 -0.17 0.71 0.00 0.00 0.00 175.76 176.23 2k6z s TYR 19 N -1.24 2.66 0.05 0.00 2.02 -0.65 -2.15 117.35 118.04 2k6z s TYR 19 Ca -0.11 -0.43 0.08 0.00 -0.37 0.00 0.00 57.07 56.23 2k6z s TYR 19 Cb -0.09 -1.68 -0.03 0.00 -0.40 0.00 0.00 41.96 39.76 2k6z s TYR 19 CO -0.00 -0.02 -0.20 -0.51 -1.57 0.00 0.00 175.55 173.25 2k6z s LEU 20 N -0.30 2.54 -0.20 -1.29 2.01 -1.26 -2.33 118.68 117.84 2k6z s LEU 20 Ca 0.02 -0.48 0.01 0.00 0.01 0.00 0.00 54.13 53.69 2k6z s LEU 20 Cb -0.13 -1.47 0.05 0.00 0.01 0.00 0.00 46.19 44.65 2k6z s LEU 20 CO 0.03 0.25 -0.09 -0.89 1.01 0.00 0.00 176.35 176.65 2k6z s THR 21 N -0.93 1.58 0.42 5.49 2.01 -1.25 -1.25 115.64 121.70 2k6z s THR 21 Ca 0.14 -1.03 0.04 0.00 0.31 0.00 0.00 61.69 61.15 2k6z s THR 21 Cb -0.10 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.66 2k6z s THR 21 CO 0.05 0.11 0.05 -0.76 -0.69 0.00 0.00 174.62 173.37 2k6z s LEU 22 N 1.41 2.34 0.05 4.42 2.01 -0.39 -0.60 118.68 127.92 2k6z s LEU 22 Ca -0.02 -1.52 -0.07 0.00 0.01 0.00 0.00 54.13 52.53 2k6z s LEU 22 Cb -0.17 -0.54 -0.01 0.00 0.01 0.00 0.00 46.19 45.48 2k6z s LEU 22 CO -0.08 -0.71 0.14 -1.61 1.01 0.00 0.00 176.35 175.11 2k6z s GLU 23 N -3.80 0.67 -0.53 1.70 2.02 -1.26 0.16 118.70 117.66 2k6z s GLU 23 Ca 0.25 -0.76 -0.15 0.00 0.02 0.00 0.00 54.97 54.33 2k6z s GLU 23 Cb 0.06 0.27 0.13 0.00 0.10 0.00 0.00 34.13 34.68 2k6z s GLU 23 CO 0.12 -0.18 0.47 1.21 0.02 0.00 0.00 175.26 176.90 2k6z s ASN 24 N -2.27 6.11 0.24 -0.19 3.84 -0.38 -4.84 114.94 117.45 2k6z s ASN 24 Ca -0.03 -1.79 0.26 0.00 0.21 0.00 0.00 52.86 51.51 2k6z s ASN 24 Cb 0.00 -2.17 0.79 0.00 -0.55 0.00 0.00 41.25 39.32 2k6z s ASN 24 CO -0.06 -0.82 1.76 1.55 -2.79 0.00 0.00 177.10 176.74 2k6z h PRO 25 N 8.81 0.00 0.00 0.43 0.13 -1.94 -0.54 132.00 138.89 2k6z h PRO 25 Ca -0.28 0.00 -0.36 0.00 -0.87 0.00 0.00 66.00 64.48 2k6z h PRO 25 Cb 1.10 0.00 0.13 0.00 0.13 0.00 0.00 31.00 32.35 2k6z h PRO 25 CO 1.00 0.00 0.29 0.41 -0.23 0.00 0.00 178.00 179.47 2k6z n GLY 26 N 1.13 -0.94 0.28 1.56 0.00 -1.26 -4.77 105.19 101.20 2k6z n GLY 26 Ca 0.05 -1.78 0.03 0.00 0.00 0.00 0.00 46.02 44.32 2k6z n GLY 26 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k6z n ASP 27 N -3.52 1.84 -4.78 1.61 8.00 -1.26 -3.35 116.55 115.09 2k6z n ASP 27 Ca 0.14 -1.50 -0.27 0.00 0.71 0.00 0.00 54.79 53.87 2k6z n ASP 27 Cb 0.48 -0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.48 2k6z n ASP 27 CO 0.00 0.00 0.00 -1.48 -0.39 0.00 0.00 177.20 175.33 2k6z s LEU 28 N -0.67 3.74 0.38 0.64 0.05 -1.26 -4.78 118.68 116.77 2k6z s LEU 28 Ca 0.09 -0.14 -0.24 0.00 0.05 0.00 0.00 54.13 53.89 2k6z s LEU 28 Cb 0.06 -2.36 -0.10 0.00 -2.05 0.00 0.00 46.19 41.73 2k6z s LEU 28 CO 0.08 0.09 0.96 -2.16 -0.55 0.00 0.00 176.35 174.77 2k6z s PRO 29 N -2.95 4.36 -0.12 1.48 0.04 -1.26 -3.89 135.00 132.65 2k6z s PRO 29 Ca 0.30 1.27 -0.08 0.00 0.04 0.00 0.00 61.00 62.53 2k6z s PRO 29 Cb -0.10 -2.49 -0.04 0.00 0.04 0.00 0.00 34.50 31.91 2k6z s PRO 29 CO 0.22 0.07 0.16 -0.51 0.04 0.00 0.00 177.00 176.99 2k6z s LEU 30 N -2.64 4.38 -0.24 -3.56 1.43 -0.10 -4.93 118.68 113.02 2k6z s LEU 30 Ca 0.57 0.49 -0.02 0.00 -1.03 0.00 0.00 54.13 54.13 2k6z s LEU 30 Cb -0.15 -2.12 0.08 0.00 0.03 0.00 0.00 46.19 44.02 2k6z s LEU 30 CO 0.20 0.37 0.07 -0.60 0.23 0.00 0.00 176.35 176.62 2k6z s ARG 31 N -0.85 0.60 -0.48 1.70 6.06 -1.26 0.01 118.95 124.72 2k6z s ARG 31 Ca 0.15 -0.61 -0.16 0.00 -2.50 0.00 0.00 55.73 52.60 2k6z s ARG 31 Cb -0.12 -1.94 0.07 0.00 0.06 0.00 0.00 34.95 33.01 2k6z s ARG 31 CO 0.04 -0.79 0.44 -1.17 -2.50 0.00 0.00 175.30 171.32 2k6z s LEU 32 N 1.83 5.47 -0.07 -0.88 2.96 -0.02 -1.18 118.68 126.79 2k6z s LEU 32 Ca 0.03 -1.22 0.19 0.00 -0.22 0.00 0.00 54.13 52.91 2k6z s LEU 32 Cb -0.17 -2.24 -0.29 0.00 0.50 0.00 0.00 46.19 43.99 2k6z s LEU 32 CO -0.17 -0.69 0.34 1.33 -1.32 0.00 0.00 176.35 175.84 2k6z n VAL 33 N 5.29 0.34 -3.62 1.68 0.24 -0.22 -0.47 118.33 121.57 2k6z n VAL 33 Ca -0.11 -0.54 -0.07 0.00 -2.04 0.00 0.00 64.34 61.58 2k6z n VAL 33 Cb 0.44 -0.10 0.01 0.00 -1.47 0.00 0.00 33.84 32.72 2k6z n VAL 33 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2k6z n GLY 34 N 1.50 1.44 2.18 7.63 0.00 -1.09 -4.64 105.19 112.21 2k6z n GLY 34 Ca -0.11 -1.24 -0.14 0.00 0.00 0.00 0.00 46.02 44.53 2k6z n GLY 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k6z n ALA 35 N -1.27 0.48 -3.48 4.61 0.00 -1.26 -1.06 120.51 118.52 2k6z n ALA 35 Ca -0.12 -1.33 -0.09 0.00 0.00 0.00 0.00 53.44 51.90 2k6z n ALA 35 Cb 0.43 1.06 -0.03 0.00 0.00 0.00 0.00 19.45 20.90 2k6z n ALA 35 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k6z s ARG 36 N -2.93 1.52 -0.26 0.00 0.52 -0.20 -4.80 118.95 112.80 2k6z s ARG 36 Ca 0.26 -0.90 -0.32 0.00 -0.52 0.00 0.00 55.73 54.24 2k6z s ARG 36 Cb 0.01 0.55 0.17 0.00 0.52 0.00 0.00 34.95 36.21 2k6z s ARG 36 CO 0.18 -0.67 1.32 -0.08 0.02 0.00 0.00 175.30 176.07 2k6z s THR 37 N -3.89 0.00 -2.13 0.02 -1.32 -1.26 -0.63 115.64 106.42 2k6z s THR 37 Ca 0.10 0.00 0.31 0.00 -1.21 0.00 0.00 61.69 60.89 2k6z s THR 37 Cb -0.03 -1.00 0.77 0.00 -1.51 0.00 0.00 72.50 70.74 2k6z s THR 37 CO 0.00 0.00 2.06 -0.81 -2.21 0.00 0.00 174.62 173.67 2k6z n PRO 38 N 0.31 1.19 -0.55 7.08 -0.04 -1.26 -4.12 135.00 137.60 2k6z n PRO 38 Ca 0.01 -0.31 0.04 0.00 -0.04 0.00 0.00 63.50 63.19 2k6z n PRO 38 Cb 0.58 -1.49 0.20 0.00 -0.04 0.00 0.00 33.50 32.75 2k6z n PRO 38 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 2k6z n VAL 39 N -0.64 2.27 -3.52 0.52 0.24 -1.26 -4.66 118.33 111.29 2k6z n VAL 39 Ca 0.22 -2.76 -0.13 0.00 -2.04 0.00 0.00 64.34 59.63 2k6z n VAL 39 Cb 0.20 -0.27 -0.04 0.00 -1.47 0.00 0.00 33.84 32.26 2k6z n VAL 39 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2k6z s ALA 40 N -3.13 -1.41 -0.03 2.33 0.00 -1.26 -3.02 121.76 115.24 2k6z s ALA 40 Ca 0.39 0.51 0.12 0.00 0.00 0.00 0.00 51.96 52.98 2k6z s ALA 40 Cb 0.36 0.61 0.01 0.00 0.00 0.00 0.00 23.12 24.10 2k6z s ALA 40 CO -0.01 -0.63 1.40 1.49 0.00 0.00 0.00 175.76 178.01 2k6z h GLU 41 N 2.40 0.00 -2.44 0.00 4.57 0.19 -3.45 114.58 115.85 2k6z h GLU 41 Ca -0.32 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 57.77 2k6z h GLU 41 Cb 1.25 0.00 -0.20 0.00 -0.16 0.00 0.00 28.75 29.65 2k6z h GLU 41 CO 0.41 0.68 -0.01 1.03 -1.18 0.00 0.00 179.01 179.93 2k6z s ARG 42 N -2.92 0.88 -0.44 1.92 1.81 -0.53 -5.02 118.95 114.65 2k6z s ARG 42 Ca 0.03 0.11 0.06 0.00 -1.72 0.00 0.00 55.73 54.21 2k6z s ARG 42 Cb 0.09 0.41 0.32 0.00 -0.45 0.00 0.00 34.95 35.32 2k6z s ARG 42 CO 0.77 -0.26 1.16 1.55 -0.68 0.00 0.00 175.30 177.85 2k6z n VAL 43 N 1.17 0.00 -3.34 3.52 3.14 -1.24 -0.45 118.33 121.14 2k6z n VAL 43 Ca -0.20 -1.43 -0.38 0.00 -2.96 0.00 0.00 64.34 59.37 2k6z n VAL 43 Cb 0.57 1.42 -0.06 0.00 -1.06 0.00 0.00 33.84 34.70 2k6z n VAL 43 CO 0.00 0.00 0.00 -1.61 -6.46 0.00 0.00 176.83 168.76 2k6z s GLU 44 N 0.24 4.20 -0.18 1.45 8.01 -0.97 -4.31 118.70 127.15 2k6z s GLU 44 Ca 0.22 0.52 -0.26 0.00 0.01 0.00 0.00 54.97 55.46 2k6z s GLU 44 Cb 0.30 -3.34 -0.01 0.00 -4.31 0.00 0.00 34.13 26.77 2k6z s GLU 44 CO -0.06 0.40 0.89 -1.17 0.01 0.00 0.00 175.26 175.33 2k6z s LEU 45 N -0.20 4.16 0.12 1.80 2.96 -1.26 -0.87 118.68 125.40 2k6z s LEU 45 Ca 0.27 1.25 0.10 0.00 -0.22 0.00 0.00 54.13 55.52 2k6z s LEU 45 Cb -0.17 -3.33 -0.04 0.00 0.50 0.00 0.00 46.19 43.16 2k6z s LEU 45 CO 0.13 -0.46 -0.25 -1.00 -1.32 0.00 0.00 176.35 173.45 2k6z s HIS 46 N 2.38 2.11 0.70 5.38 3.76 0.13 -0.64 115.29 129.12 2k6z s HIS 46 Ca 0.40 -0.39 -0.04 0.00 -0.15 0.00 0.00 55.06 54.88 2k6z s HIS 46 Cb -0.16 -1.14 0.09 0.00 1.11 0.00 0.00 32.58 32.48 2k6z s HIS 46 CO 0.12 0.30 0.98 -1.83 -0.85 0.00 0.00 174.74 173.46 2k6z s GLU 47 N -2.05 1.92 -0.02 1.40 -1.05 0.14 -0.77 118.70 118.28 2k6z s GLU 47 Ca 0.12 -0.70 -0.00 0.00 -0.15 0.00 0.00 54.97 54.24 2k6z s GLU 47 Cb -0.10 -2.27 0.03 0.00 -0.44 0.00 0.00 34.13 31.36 2k6z s GLU 47 CO 0.06 -1.32 0.03 0.99 0.95 0.00 0.00 175.26 175.97 2k6z s THR 48 N -3.17 -0.06 0.30 1.83 2.01 0.11 -3.27 115.64 113.39 2k6z s THR 48 Ca 0.63 0.22 0.03 0.00 0.31 0.00 0.00 61.69 62.88 2k6z s THR 48 Cb -0.08 -0.08 -0.04 0.00 0.01 0.00 0.00 72.50 72.31 2k6z s THR 48 CO 0.44 0.09 0.14 0.72 -0.69 0.00 0.00 174.62 175.32 2k6z s PHE 49 N 1.08 1.61 0.01 4.92 -0.12 -0.07 -4.49 117.98 120.91 2k6z s PHE 49 Ca -0.09 -1.30 0.08 0.00 -0.05 0.00 0.00 56.93 55.57 2k6z s PHE 49 Cb -0.13 -0.90 -0.02 0.00 -0.63 0.00 0.00 43.02 41.33 2k6z s PHE 49 CO -0.03 -0.44 -0.26 1.41 -0.05 0.00 0.00 175.22 175.85 2k6z s MET 50 N -3.87 1.94 0.09 1.99 -2.45 -1.26 -0.82 119.30 114.91 2k6z s MET 50 Ca 0.35 -0.98 0.02 0.00 -1.25 0.00 0.00 55.69 53.83 2k6z s MET 50 Cb 0.06 -1.97 -0.04 0.00 1.25 0.00 0.00 34.83 34.13 2k6z s MET 50 CO 0.16 0.53 -0.07 1.03 1.05 0.00 0.00 175.02 177.72 2k6z s ARG 51 N -0.85 0.77 0.01 4.11 0.52 -0.08 -4.95 118.95 118.49 2k6z s ARG 51 Ca 0.10 -1.19 -0.07 0.00 -0.52 0.00 0.00 55.73 54.05 2k6z s ARG 51 Cb -0.10 -0.27 -0.05 0.00 0.52 0.00 0.00 34.95 35.05 2k6z s ARG 51 CO 0.00 0.01 0.28 -2.00 0.02 0.00 0.00 175.30 173.61 2k6z s GLU 52 N -3.22 3.61 -0.05 3.54 2.56 -1.26 -0.37 118.70 123.50 2k6z s GLU 52 Ca 0.06 -0.03 -0.02 0.00 0.00 0.00 0.00 54.97 54.99 2k6z s GLU 52 Cb 0.01 -3.08 0.04 0.00 2.00 0.00 0.00 34.13 33.09 2k6z s GLU 52 CO -0.03 0.65 0.12 0.14 -0.56 0.00 0.00 175.26 175.58 2k6z s VAL 53 N -1.28 -0.05 -0.24 3.70 -7.23 -0.41 -4.92 120.40 109.97 2k6z s VAL 53 Ca 0.27 0.18 0.00 0.00 -1.81 0.00 0.00 61.98 60.62 2k6z s VAL 53 Cb -0.13 -0.20 0.00 0.00 0.56 0.00 0.00 36.38 36.61 2k6z s VAL 53 CO 0.15 0.07 0.00 -0.62 -0.31 0.00 0.00 175.10 174.40 2k6z n GLU 54 N 4.14 -1.72 -1.18 4.82 1.02 -1.26 -0.64 120.64 125.82 2k6z n GLU 54 Ca -0.26 0.53 0.00 0.00 -0.02 0.00 0.00 57.16 57.41 2k6z n GLU 54 Cb 0.52 -4.86 0.00 0.00 -0.02 0.00 0.00 31.44 27.08 2k6z n GLU 54 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k6z n GLY 55 N 0.41 0.67 2.96 0.62 0.00 -1.26 -5.08 105.19 103.50 2k6z n GLY 55 Ca -0.02 -0.74 -0.28 0.00 0.00 0.00 0.00 46.02 44.97 2k6z n GLY 55 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6z s LYS 56 N -2.51 1.89 -0.27 1.61 -0.14 0.19 -5.13 119.74 115.39 2k6z s LYS 56 Ca 0.00 -0.40 -0.22 0.00 -1.36 0.00 0.00 55.97 53.99 2k6z s LYS 56 Cb 0.00 -1.83 -0.01 0.00 -1.68 0.00 0.00 37.83 34.31 2k6z s LYS 56 CO 0.00 -0.25 0.70 -1.59 -0.76 0.00 0.00 175.35 173.45 2k6z s LYS 57 N 1.59 4.06 -0.00 1.68 0.00 -1.26 -1.29 119.74 124.51 2k6z s LYS 57 Ca 0.05 0.58 0.01 0.00 0.00 0.00 0.00 55.97 56.61 2k6z s LYS 57 Cb -0.13 -3.68 -0.00 0.00 0.00 0.00 0.00 37.83 34.02 2k6z s LYS 57 CO -0.09 -0.51 -0.04 0.08 0.00 0.00 0.00 175.35 174.78 2k6z s VAL 58 N 2.67 0.36 0.69 1.79 1.01 0.50 -4.99 120.40 122.43 2k6z s VAL 58 Ca 0.29 -0.19 -0.08 0.00 0.00 0.00 0.00 61.98 61.99 2k6z s VAL 58 Cb -0.15 -0.30 0.04 0.00 0.00 0.00 0.00 36.38 35.96 2k6z s VAL 58 CO 0.10 0.10 1.03 -0.04 0.00 0.00 0.00 175.10 176.28 2k6z s MET 59 N -0.09 2.49 0.26 2.72 -1.94 -1.26 -0.90 119.30 120.58 2k6z s MET 59 Ca 0.02 0.01 -0.09 0.00 -1.71 0.00 0.00 55.69 53.92 2k6z s MET 59 Cb -0.02 -2.13 0.03 0.00 2.01 0.00 0.00 34.83 34.72 2k6z s MET 59 CO -0.00 -1.11 0.49 0.41 -0.01 0.00 0.00 175.02 174.80 2k6z n GLY 60 N -2.91 1.47 3.41 -0.03 0.00 -0.00 -4.85 105.19 102.28 2k6z n GLY 60 Ca 0.07 -1.22 -0.16 0.00 0.00 0.00 0.00 46.02 44.71 2k6z n GLY 60 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2k6z s MET 61 N -2.12 0.91 0.12 1.61 1.75 -1.26 -0.89 119.30 119.41 2k6z s MET 61 Ca 0.12 0.07 -0.22 0.00 -1.25 0.00 0.00 55.69 54.41 2k6z s MET 61 Cb -0.03 0.42 0.06 0.00 2.84 0.00 0.00 34.83 38.12 2k6z s MET 61 CO 0.09 -0.27 0.55 -0.98 -0.65 0.00 0.00 175.02 173.75 2k6z s ARG 62 N -1.26 1.18 0.58 4.11 1.70 -1.20 -5.00 118.95 119.06 2k6z s ARG 62 Ca -0.12 -0.44 -0.16 0.00 -0.47 0.00 0.00 55.73 54.55 2k6z s ARG 62 Cb -0.02 0.54 -0.04 0.00 -0.57 0.00 0.00 34.95 34.85 2k6z s ARG 62 CO 0.08 -0.48 1.04 -1.25 -1.08 0.00 0.00 175.30 173.61 2k6z s PRO 63 N -3.38 3.43 0.02 3.89 0.04 -1.26 -0.68 135.00 137.05 2k6z s PRO 63 Ca -0.00 1.14 -0.05 0.00 0.04 0.00 0.00 61.00 62.13 2k6z s PRO 63 Cb -0.00 -2.05 -0.01 0.00 0.04 0.00 0.00 34.50 32.48 2k6z s PRO 63 CO -0.09 -0.72 0.08 0.14 0.04 0.00 0.00 177.00 176.44 2k6z s VAL 64 N -2.52 0.12 -0.21 -0.36 -7.23 0.19 -4.77 120.40 105.61 2k6z s VAL 64 Ca 0.62 -0.97 0.18 0.00 -1.81 0.00 0.00 61.98 60.01 2k6z s VAL 64 Cb -0.15 -0.65 0.06 0.00 0.56 0.00 0.00 36.38 36.20 2k6z s VAL 64 CO 0.37 -0.53 1.26 1.55 -0.31 0.00 0.00 175.10 177.43 2k6z h PRO 65 N 4.02 0.00 -1.29 4.82 0.13 -1.94 -3.41 132.00 134.34 2k6z h PRO 65 Ca -0.32 0.00 0.33 0.00 -0.87 0.00 0.00 66.00 65.14 2k6z h PRO 65 Cb 1.19 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.17 2k6z h PRO 65 CO 0.46 0.27 0.89 -0.59 -0.23 0.00 0.00 178.00 178.80 2k6z s PHE 66 N -3.06 -0.04 0.17 1.56 -0.12 -1.26 -4.75 117.98 110.47 2k6z s PHE 66 Ca 0.02 -0.01 0.07 0.00 -0.05 0.00 0.00 56.93 56.96 2k6z s PHE 66 Cb 0.08 0.52 -0.04 0.00 -0.63 0.00 0.00 43.02 42.95 2k6z s PHE 66 CO 0.75 -0.16 0.00 -0.51 -0.05 0.00 0.00 175.22 175.25 2k6z s LEU 67 N -2.72 3.33 -0.02 -1.99 1.43 0.38 -4.97 118.68 114.11 2k6z s LEU 67 Ca 0.13 -0.38 0.05 0.00 -1.03 0.00 0.00 54.13 52.90 2k6z s LEU 67 Cb 0.04 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 2k6z s LEU 67 CO -0.05 0.09 -0.16 -0.70 0.23 0.00 0.00 176.35 175.77 2k6z s GLU 68 N -2.90 1.48 -0.05 1.70 2.56 -1.26 -0.84 118.70 119.39 2k6z s GLU 68 Ca 0.27 -0.58 -0.04 0.00 0.00 0.00 0.00 54.97 54.62 2k6z s GLU 68 Cb -0.09 -1.37 0.02 0.00 2.00 0.00 0.00 34.13 34.69 2k6z s GLU 68 CO 0.19 0.30 0.13 0.08 -0.56 0.00 0.00 175.26 175.40 2k6z s VAL 69 N -0.20 -0.02 1.04 3.70 1.01 0.10 -5.00 120.40 121.03 2k6z s VAL 69 Ca 0.02 0.06 -0.13 0.00 0.00 0.00 0.00 61.98 61.93 2k6z s VAL 69 Cb -0.08 -0.20 0.21 0.00 0.00 0.00 0.00 36.38 36.31 2k6z s VAL 69 CO 0.00 0.02 1.09 -2.16 0.00 0.00 0.00 175.10 174.05 2k6z s PRO 70 N 0.42 0.09 0.47 2.72 0.04 -1.26 -0.92 135.00 136.57 2k6z s PRO 70 Ca -0.03 0.48 -0.24 0.00 0.04 0.00 0.00 61.00 61.25 2k6z s PRO 70 Cb -0.04 -1.70 -0.08 0.00 0.04 0.00 0.00 34.50 32.72 2k6z s PRO 70 CO -0.02 -2.95 1.34 -0.35 0.04 0.00 0.00 177.00 175.06 2k6z n PRO 71 N -4.32 1.93 -0.69 0.56 -0.04 -1.25 -2.85 135.00 128.33 2k6z n PRO 71 Ca 0.05 0.69 0.00 0.00 -0.04 0.00 0.00 63.50 64.21 2k6z n PRO 71 Cb 0.57 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.52 2k6z n PRO 71 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2k6z n LYS 72 N -0.38 -0.02 -2.11 0.54 4.76 -0.21 -5.00 118.16 115.75 2k6z n LYS 72 Ca 0.07 0.00 -0.29 0.00 -2.87 0.00 0.00 58.31 55.23 2k6z n LYS 72 Cb 0.42 -3.76 0.03 0.00 -1.84 0.00 0.00 35.03 29.88 2k6z n LYS 72 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2k6z s GLY 73 N -2.00 1.61 -0.12 0.72 0.00 -1.13 -4.82 107.32 101.57 2k6z s GLY 73 Ca 0.00 -0.39 -0.19 0.00 0.00 0.00 0.00 44.72 44.15 2k6z s GLY 73 CO 0.00 -0.09 0.50 0.50 0.00 0.00 0.00 173.10 174.00 2k6z s ARG 74 N -5.14 4.33 -0.96 2.90 0.52 -1.26 -1.25 118.95 118.09 2k6z s ARG 74 Ca 0.55 0.47 -0.00 0.00 -0.52 0.00 0.00 55.73 56.23 2k6z s ARG 74 Cb -0.11 -3.45 0.32 0.00 0.52 0.00 0.00 34.95 32.23 2k6z s ARG 74 CO 0.50 0.12 1.65 0.28 0.02 0.00 0.00 175.30 177.87 2k6z n VAL 75 N 3.77 5.55 -4.47 3.52 0.31 0.12 -4.94 118.33 122.19 2k6z n VAL 75 Ca -0.06 -5.91 -0.34 0.00 -0.01 0.00 0.00 64.34 58.02 2k6z n VAL 75 Cb 0.51 -1.59 -0.14 0.00 -0.91 0.00 0.00 33.84 31.72 2k6z n VAL 75 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 2k6z s GLU 76 N -4.04 3.43 0.15 5.55 2.02 -1.24 -1.26 118.70 123.31 2k6z s GLU 76 Ca 0.40 -0.64 -0.08 0.00 0.02 0.00 0.00 54.97 54.66 2k6z s GLU 76 Cb 0.19 -2.78 -0.00 0.00 0.10 0.00 0.00 34.13 31.64 2k6z s GLU 76 CO -0.11 0.11 1.46 -0.07 0.02 0.00 0.00 175.26 176.67 2k6z h LEU 77 N 7.08 0.85 0.00 1.80 4.07 -1.47 -3.49 115.31 124.16 2k6z h LEU 77 Ca -0.31 -0.45 0.00 0.00 0.08 0.00 0.00 57.88 57.20 2k6z h LEU 77 Cb 1.19 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.69 2k6z h LEU 77 CO 0.58 1.21 0.00 0.29 -1.08 0.00 0.00 178.44 179.45 2k6z n LYS 78 N -4.00 0.00 0.00 1.13 4.01 -1.26 -1.16 118.16 116.88 2k6z n LYS 78 Ca -0.04 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.76 2k6z n LYS 78 Cb 0.61 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 35.13 2k6z n LYS 78 CO 0.00 0.00 0.00 -0.35 -1.11 0.00 0.00 177.40 175.94 2k6z n PRO 79 N 0.82 0.53 -0.26 1.97 -0.04 -1.26 -3.44 135.00 133.32 2k6z n PRO 79 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 2k6z n PRO 79 Cb 0.00 -1.05 0.00 0.00 -0.04 0.00 0.00 33.50 32.41 2k6z n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2k6z n GLY 80 N 0.07 0.72 0.00 0.55 0.00 -1.26 -5.04 105.19 100.23 2k6z n GLY 80 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2k6z n GLY 80 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6z n GLY 81 N 0.00 0.00 2.99 -0.02 0.00 -1.22 -4.64 105.19 102.29 2k6z n GLY 81 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2k6z n GLY 81 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k6z s TYR 82 N -1.24 0.39 -0.06 1.61 2.02 -0.31 0.05 117.35 119.80 2k6z s TYR 82 Ca 0.00 -0.37 -0.28 0.00 -0.37 0.00 0.00 57.07 56.05 2k6z s TYR 82 Cb 0.00 -0.25 0.06 0.00 -0.40 0.00 0.00 41.96 41.38 2k6z s TYR 82 CO 0.00 -0.10 0.63 -3.38 -1.57 0.00 0.00 175.55 171.13 2k6z s HIS 83 N -1.00 -0.60 0.04 2.71 -3.43 0.05 -4.16 115.29 108.91 2k6z s HIS 83 Ca -0.09 1.08 -0.30 0.00 -0.80 0.00 0.00 55.06 54.95 2k6z s HIS 83 Cb -0.07 0.35 -0.04 0.00 -1.43 0.00 0.00 32.58 31.39 2k6z s HIS 83 CO -0.00 -0.56 0.97 -0.06 -2.00 0.00 0.00 174.74 173.10 2k6z s PHE 84 N -1.06 3.72 -0.56 0.38 0.08 -0.92 -0.69 117.98 118.93 2k6z s PHE 84 Ca -0.10 1.74 -0.21 0.00 0.12 0.00 0.00 56.93 58.48 2k6z s PHE 84 Cb -0.01 -3.10 0.07 0.00 -0.57 0.00 0.00 43.02 39.41 2k6z s PHE 84 CO 0.08 0.07 0.76 1.41 -0.10 0.00 0.00 175.22 177.44 2k6z s MET 85 N 0.62 3.14 -0.31 0.44 -2.45 -0.04 -1.04 119.30 119.65 2k6z s MET 85 Ca 0.50 -0.86 -0.24 0.00 -1.25 0.00 0.00 55.69 53.84 2k6z s MET 85 Cb -0.22 -4.15 0.00 0.00 1.25 0.00 0.00 34.83 31.72 2k6z s MET 85 CO 0.29 -1.44 0.83 -0.51 1.05 0.00 0.00 175.02 175.23 2k6z s LEU 86 N 3.13 4.07 -0.04 4.11 1.02 0.20 -2.29 118.68 128.89 2k6z s LEU 86 Ca 0.18 0.70 0.03 0.00 0.02 0.00 0.00 54.13 55.06 2k6z s LEU 86 Cb -0.19 -3.14 0.00 0.00 0.02 0.00 0.00 46.19 42.89 2k6z s LEU 86 CO 0.12 -0.66 -0.11 -0.22 0.02 0.00 0.00 176.35 175.49 2k6z s LEU 87 N 3.06 1.79 -0.15 1.79 0.20 0.41 -0.33 118.68 125.45 2k6z s LEU 87 Ca 0.34 -0.24 -0.00 0.00 0.69 0.00 0.00 54.13 54.92 2k6z s LEU 87 Cb -0.14 -0.69 0.00 0.00 -0.43 0.00 0.00 46.19 44.93 2k6z s LEU 87 CO 0.13 0.08 0.13 0.61 -0.29 0.00 0.00 176.35 177.01 2k6z n GLY 88 N 3.33 0.40 3.37 7.98 0.00 -0.56 -0.83 105.19 118.88 2k6z n GLY 88 Ca -0.19 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.04 2k6z n GLY 88 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2k6z n LEU 89 N -1.34 -0.73 -0.00 0.99 4.77 -1.21 -1.45 117.00 118.02 2k6z n LEU 89 Ca -0.03 0.53 -0.00 0.00 -0.03 0.00 0.00 56.01 56.48 2k6z n LEU 89 Cb 0.52 -1.11 -0.01 0.00 -2.33 0.00 0.00 43.42 40.50 2k6z n LEU 89 CO 0.08 -3.75 -0.52 0.29 -1.33 0.00 0.00 177.39 172.16 2k6z n LYS 90 N -0.08 3.87 -4.17 3.23 4.76 -1.17 -4.83 118.16 119.77 2k6z n LYS 90 Ca 0.08 -0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.21 2k6z n LYS 90 Cb 0.50 -1.02 -0.08 0.00 -1.84 0.00 0.00 35.03 32.60 2k6z n LYS 90 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 2k6z s ARG 91 N -2.02 2.75 0.76 1.97 1.81 -1.26 -5.03 118.95 117.93 2k6z s ARG 91 Ca -0.00 -0.69 -0.11 0.00 -1.72 0.00 0.00 55.73 53.21 2k6z s ARG 91 Cb 0.00 -2.66 0.05 0.00 -0.45 0.00 0.00 34.95 31.89 2k6z s ARG 91 CO 0.03 0.59 1.08 -1.25 -0.68 0.00 0.00 175.30 175.07 2k6z s PRO 92 N -1.98 2.37 0.06 3.54 0.04 -1.26 -5.07 135.00 132.71 2k6z s PRO 92 Ca 0.24 0.80 -0.20 0.00 0.04 0.00 0.00 61.00 61.88 2k6z s PRO 92 Cb -0.12 -1.94 0.04 0.00 0.04 0.00 0.00 34.50 32.53 2k6z s PRO 92 CO 0.15 -1.46 0.46 -0.48 0.04 0.00 0.00 177.00 175.72 2k6z s LEU 93 N -5.72 0.17 0.00 -3.56 2.34 -1.26 -5.10 118.68 105.55 2k6z s LEU 93 Ca 0.60 0.01 0.07 0.00 0.06 0.00 0.00 54.13 54.88 2k6z s LEU 93 Cb -0.15 1.95 0.12 0.00 -0.56 0.00 0.00 46.19 47.55 2k6z s LEU 93 CO 0.55 -0.73 0.95 2.29 -1.06 0.00 0.00 176.35 178.35 2k6z n LYS 94 N 0.30 0.00 -0.98 1.48 0.00 -1.26 -4.94 118.16 112.77 2k6z n LYS 94 Ca -0.18 -1.08 0.12 0.00 -0.00 0.00 0.00 58.31 57.17 2k6z n LYS 94 Cb 0.61 -0.12 -0.06 0.00 -0.00 0.00 0.00 35.03 35.46 2k6z n LYS 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2k6z n ALA 95 N 0.14 -2.55 -0.35 0.58 0.00 -1.26 -4.93 120.51 112.13 2k6z n ALA 95 Ca -0.02 0.56 0.00 0.00 0.00 0.00 0.00 53.44 53.98 2k6z n ALA 95 Cb 0.79 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 19.21 2k6z n ALA 95 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6z n GLY 96 N -3.65 1.65 3.84 0.00 0.00 -0.27 -4.97 105.19 101.79 2k6z n GLY 96 Ca -0.05 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.68 2k6z n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2k6z s GLU 97 N -0.10 2.15 -0.14 1.61 0.41 -1.26 -4.86 118.70 116.52 2k6z s GLU 97 Ca 0.00 0.48 0.02 0.00 -0.41 0.00 0.00 54.97 55.05 2k6z s GLU 97 Cb 0.00 -1.94 0.00 0.00 -1.78 0.00 0.00 34.13 30.41 2k6z s GLU 97 CO 0.00 -1.53 -0.19 -1.21 -0.49 0.00 0.00 175.26 171.84 2k6z s GLU 98 N -5.28 3.13 -0.01 1.61 0.41 -1.26 -0.35 118.70 116.95 2k6z s GLU 98 Ca 0.61 -0.80 0.06 0.00 -0.41 0.00 0.00 54.97 54.42 2k6z s GLU 98 Cb -0.13 -2.51 -0.02 0.00 -1.78 0.00 0.00 34.13 29.70 2k6z s GLU 98 CO 0.53 0.04 -0.18 0.08 -0.49 0.00 0.00 175.26 175.24 2k6z s VAL 99 N 0.72 1.43 -0.13 2.63 1.01 0.03 -4.94 120.40 121.15 2k6z s VAL 99 Ca -0.08 -0.81 -0.04 0.00 0.00 0.00 0.00 61.98 61.05 2k6z s VAL 99 Cb -0.16 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 35.00 2k6z s VAL 99 CO 0.01 0.37 0.00 -1.83 0.00 0.00 0.00 175.10 173.65 2k6z s GLU 100 N -0.51 3.42 -0.03 2.72 -1.05 -1.26 -0.93 118.70 121.06 2k6z s GLU 100 Ca 0.07 -0.43 0.02 0.00 -0.15 0.00 0.00 54.97 54.48 2k6z s GLU 100 Cb -0.07 -2.92 0.01 0.00 -0.44 0.00 0.00 34.13 30.70 2k6z s GLU 100 CO -0.00 0.47 -0.08 -0.51 0.95 0.00 0.00 175.26 176.08 2k6z s LEU 101 N -0.23 1.66 0.17 1.83 1.02 -0.61 -4.31 118.68 118.21 2k6z s LEU 101 Ca 0.06 -0.18 -0.30 0.00 0.02 0.00 0.00 54.13 53.72 2k6z s LEU 101 Cb -0.12 -0.55 -0.07 0.00 0.02 0.00 0.00 46.19 45.46 2k6z s LEU 101 CO 0.02 0.03 1.02 -1.81 0.02 0.00 0.00 176.35 175.63 2k6z s ASP 102 N 0.43 7.42 -0.21 2.29 1.01 0.20 0.38 116.67 128.19 2k6z s ASP 102 Ca -0.07 1.97 -0.08 0.00 0.71 0.00 0.00 52.55 55.08 2k6z s ASP 102 Cb -0.11 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.18 2k6z s ASP 102 CO 0.01 -0.09 0.09 -0.76 0.21 0.00 0.00 175.17 174.63 2k6z s LEU 103 N -0.46 3.84 -0.42 1.23 1.02 -0.11 -1.03 118.68 122.74 2k6z s LEU 103 Ca 0.47 0.04 -0.11 0.00 0.02 0.00 0.00 54.13 54.55 2k6z s LEU 103 Cb -0.27 -2.00 0.06 0.00 0.02 0.00 0.00 46.19 44.00 2k6z s LEU 103 CO 0.33 0.11 0.28 -0.76 0.02 0.00 0.00 176.35 176.33 2k6z s LEU 104 N 0.78 5.15 0.11 1.79 1.43 -0.22 -2.34 118.68 125.38 2k6z s LEU 104 Ca 0.05 -1.30 0.04 0.00 -1.03 0.00 0.00 54.13 51.88 2k6z s LEU 104 Cb -0.13 -2.05 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 2k6z s LEU 104 CO 0.02 -0.52 0.09 -0.36 0.23 0.00 0.00 176.35 175.81 2k6z s PHE 105 N 1.52 3.16 0.19 0.29 0.08 0.18 -1.05 117.98 122.35 2k6z s PHE 105 Ca 0.03 0.04 -0.33 0.00 0.12 0.00 0.00 56.93 56.79 2k6z s PHE 105 Cb -0.22 -1.57 -0.13 0.00 -0.57 0.00 0.00 43.02 40.52 2k6z s PHE 105 CO 0.05 0.52 1.55 0.00 -0.10 0.00 0.00 175.22 177.24 2k6z n ALA 106 N 0.17 1.50 -1.71 5.36 0.00 -0.33 -2.95 120.51 122.56 2k6z n ALA 106 Ca -0.09 0.43 -0.01 0.00 0.00 0.00 0.00 53.44 53.77 2k6z n ALA 106 Cb 0.53 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.63 2k6z n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k6z n GLY 107 N 3.09 0.71 2.32 0.00 0.00 -1.26 -4.41 105.19 105.64 2k6z n GLY 107 Ca 0.15 -0.26 -0.01 0.00 0.00 0.00 0.00 46.02 45.90 2k6z n GLY 107 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k6z n GLY 108 N -1.39 0.40 3.54 -0.02 0.00 -1.25 -4.99 105.19 101.48 2k6z n GLY 108 Ca -0.01 -0.08 -0.42 0.00 0.00 0.00 0.00 46.02 45.51 2k6z n GLY 108 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k6z s LYS 109 N -0.87 3.47 -0.04 1.61 1.02 -1.15 -5.02 119.74 118.76 2k6z s LYS 109 Ca 0.00 -0.28 0.04 0.00 0.02 0.00 0.00 55.97 55.75 2k6z s LYS 109 Cb 0.00 -3.86 -0.00 0.00 -0.52 0.00 0.00 37.83 33.44 2k6z s LYS 109 CO 0.00 -0.76 -0.16 0.08 -0.92 0.00 0.00 175.35 173.58 2k6z s VAL 110 N 2.48 1.36 -0.16 3.17 1.01 -1.26 -0.64 120.40 126.35 2k6z s VAL 110 Ca 0.19 -0.69 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 2k6z s VAL 110 Cb -0.15 -1.17 0.07 0.00 0.00 0.00 0.00 36.38 35.13 2k6z s VAL 110 CO 0.15 0.39 0.17 -0.22 0.00 0.00 0.00 175.10 175.59 2k6z s LEU 111 N -0.02 0.04 -0.71 3.92 0.20 -0.99 -4.96 118.68 116.16 2k6z s LEU 111 Ca -0.02 -0.20 -0.22 0.00 0.69 0.00 0.00 54.13 54.38 2k6z s LEU 111 Cb -0.10 0.16 0.08 0.00 -0.43 0.00 0.00 46.19 45.90 2k6z s LEU 111 CO 0.02 -0.31 1.01 -0.75 -0.29 0.00 0.00 176.35 176.03 2k6z s LYS 112 N 2.26 3.19 0.86 1.98 2.20 -1.26 -0.94 119.74 128.03 2k6z s LYS 112 Ca 0.05 -0.95 -0.13 0.00 -0.36 0.00 0.00 55.97 54.58 2k6z s LYS 112 Cb -0.15 -4.35 0.12 0.00 -1.51 0.00 0.00 37.83 31.94 2k6z s LYS 112 CO -0.09 -1.84 1.22 0.08 -0.36 0.00 0.00 175.35 174.36 2k6z s VAL 113 N 3.97 2.00 0.01 4.02 1.01 0.16 -4.89 120.40 126.67 2k6z s VAL 113 Ca 0.25 -0.00 0.00 0.00 0.00 0.00 0.00 61.98 62.23 2k6z s VAL 113 Cb -0.14 -3.00 -0.01 0.00 0.00 0.00 0.00 36.38 33.23 2k6z s VAL 113 CO 0.07 0.00 -0.02 0.54 0.00 0.00 0.00 175.10 175.69 2k6z s VAL 114 N -3.68 0.10 -0.13 2.92 0.11 -1.26 -1.58 120.40 116.88 2k6z s VAL 114 Ca 0.66 -0.31 -0.21 0.00 -2.93 0.00 0.00 61.98 59.19 2k6z s VAL 114 Cb -0.09 -0.14 0.05 0.00 -1.53 0.00 0.00 36.38 34.67 2k6z s VAL 114 CO 0.50 -0.13 0.54 -1.48 -3.33 0.00 0.00 175.10 171.20 2k6z s LEU 115 N -0.46 -0.07 0.55 2.54 2.34 -0.10 -4.89 118.68 118.58 2k6z s LEU 115 Ca -0.04 0.81 -0.15 0.00 0.06 0.00 0.00 54.13 54.81 2k6z s LEU 115 Cb -0.03 1.95 -0.06 0.00 -0.56 0.00 0.00 46.19 47.48 2k6z s LEU 115 CO -0.00 -0.35 1.01 -2.16 -1.06 0.00 0.00 176.35 173.78 2k6z s PRO 116 N -0.41 3.77 -0.24 1.48 0.04 -1.26 -0.79 135.00 137.58 2k6z s PRO 116 Ca -0.06 0.96 -0.16 0.00 0.04 0.00 0.00 61.00 61.78 2k6z s PRO 116 Cb -0.03 -2.11 -0.03 0.00 0.04 0.00 0.00 34.50 32.37 2k6z s PRO 116 CO 0.04 -0.43 0.44 0.08 0.04 0.00 0.00 177.00 177.17 2k6z s VAL 117 N -2.70 5.14 0.36 -0.36 1.01 0.53 -0.72 120.40 123.67 2k6z s VAL 117 Ca 0.59 0.74 -0.01 0.00 0.00 0.00 0.00 61.98 63.30 2k6z s VAL 117 Cb -0.11 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 2k6z s VAL 117 CO 0.36 0.16 0.59 -1.61 0.00 0.00 0.00 175.10 174.60 2k6z s GLU 118 N 1.92 3.51 -0.94 2.72 0.41 -0.58 -1.11 118.70 124.62 2k6z s GLU 118 Ca 0.19 -0.21 -0.04 0.00 -0.41 0.00 0.00 54.97 54.50 2k6z s GLU 118 Cb -0.15 -2.61 0.16 0.00 -1.78 0.00 0.00 34.13 29.74 2k6z s GLU 118 CO 0.09 0.10 2.38 0.00 -0.49 0.00 0.00 175.26 177.34 2k6z n ALA 119 N -1.78 6.55 -1.42 5.21 0.00 -1.26 -3.88 120.51 123.92 2k6z n ALA 119 Ca -0.04 -3.84 0.00 0.00 0.00 0.00 0.00 53.44 49.57 2k6z n ALA 119 Cb 0.56 -2.39 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2k6z n ALA 119 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37