#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ck0 s VAL 2 N 0.00 2.54 -0.11 -0.39 1.01 -1.25 -3.47 120.40 118.72 2ck0 s VAL 2 Ca 0.00 0.42 -0.04 0.00 0.00 0.00 0.00 61.98 62.37 2ck0 s VAL 2 Cb 0.00 -3.27 0.05 0.00 0.00 0.00 0.00 36.38 33.16 2ck0 s VAL 2 CO 0.00 0.05 0.12 -1.58 0.00 0.00 0.00 175.10 173.69 2ck0 s GLN 3 N 0.25 0.03 -0.28 2.72 2.00 0.14 -4.91 119.66 119.62 2ck0 s GLN 3 Ca 0.65 0.28 -0.01 0.00 -2.00 0.00 0.00 55.36 54.27 2ck0 s GLN 3 Cb -0.44 -0.90 0.04 0.00 0.80 0.00 0.00 33.01 32.51 2ck0 s GLN 3 CO 0.39 -0.46 -0.03 -0.51 -0.50 0.00 0.00 175.29 174.18 2ck0 s LEU 4 N 2.22 3.64 -0.29 3.68 1.43 -1.26 -0.04 118.68 128.06 2ck0 s LEU 4 Ca 0.04 -1.15 0.00 0.00 -1.03 0.00 0.00 54.13 51.99 2ck0 s LEU 4 Cb -0.14 -1.69 0.06 0.00 0.03 0.00 0.00 46.19 44.46 2ck0 s LEU 4 CO -0.07 -0.21 -0.03 -1.58 0.23 0.00 0.00 176.35 174.69 2ck0 s GLN 5 N 1.27 2.29 0.15 1.70 -0.44 -0.30 -4.00 119.66 120.34 2ck0 s GLN 5 Ca -0.04 -1.35 -0.09 0.00 -2.50 0.00 0.00 55.36 51.38 2ck0 s GLN 5 Cb -0.19 -3.09 -0.06 0.00 -1.64 0.00 0.00 33.01 28.03 2ck0 s GLN 5 CO -0.02 -0.64 0.46 -1.83 0.50 0.00 0.00 175.29 173.76 2ck0 s GLU 6 N 1.17 3.77 0.15 1.67 1.03 -1.26 -1.50 118.70 123.73 2ck0 s GLU 6 Ca -0.05 0.18 -0.11 0.00 0.03 0.00 0.00 54.97 55.02 2ck0 s GLU 6 Cb -0.20 -2.84 0.00 0.00 -0.80 0.00 0.00 34.13 30.29 2ck0 s GLU 6 CO -0.03 0.45 0.31 -1.54 -1.33 0.00 0.00 175.26 173.12 2ck0 s SER 7 N -2.11 -0.01 0.00 0.83 1.04 -0.52 -4.79 113.70 108.14 2ck0 s SER 7 Ca 0.40 -0.71 0.00 0.00 0.48 0.00 0.00 55.95 56.12 2ck0 s SER 7 Cb -0.13 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.43 2ck0 s SER 7 CO 0.21 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 174.16 2ck0 n GLY 8 N -0.20 0.63 3.67 7.32 0.00 -1.26 -2.08 105.19 113.27 2ck0 n GLY 8 Ca -0.10 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.63 2ck0 n GLY 8 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2ck0 s GLY 9 N -0.91 1.59 0.00 -0.02 0.00 -1.26 -4.73 107.32 101.99 2ck0 s GLY 9 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 44.72 44.01 2ck0 s GLY 9 CO 0.00 0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.74 2ck0 n GLY 10 N -1.38 -1.08 3.71 0.20 0.00 0.92 -4.92 105.19 102.64 2ck0 n GLY 10 Ca 0.10 -1.33 -0.40 0.00 0.00 0.00 0.00 46.02 44.38 2ck0 n GLY 10 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2ck0 s LEU 11 N 0.00 4.30 0.00 0.99 2.96 -1.26 -0.84 118.68 124.83 2ck0 s LEU 11 Ca 0.00 1.17 -0.03 0.00 -0.22 0.00 0.00 54.13 55.05 2ck0 s LEU 11 Cb 0.00 -3.08 -0.01 0.00 0.50 0.00 0.00 46.19 43.60 2ck0 s LEU 11 CO 0.00 -0.15 0.04 -0.69 -1.32 0.00 0.00 176.35 174.24 2ck0 s VAL 12 N 0.96 0.07 0.31 1.68 1.01 -0.00 -4.96 120.40 119.47 2ck0 s VAL 12 Ca 0.37 -0.58 -0.16 0.00 0.00 0.00 0.00 61.98 61.61 2ck0 s VAL 12 Cb -0.18 -0.26 -0.09 0.00 0.00 0.00 0.00 36.38 35.86 2ck0 s VAL 12 CO 0.17 -0.32 0.74 0.00 0.00 0.00 0.00 175.10 175.70 2ck0 s GLN 13 N -1.00 4.05 0.44 2.72 -2.07 -1.25 -1.01 119.66 121.55 2ck0 s GLN 13 Ca -0.11 0.72 -0.22 0.00 -1.82 0.00 0.00 55.36 53.93 2ck0 s GLN 13 Cb -0.07 -2.48 -0.12 0.00 -1.09 0.00 0.00 33.01 29.25 2ck0 s GLN 13 CO -0.00 0.18 0.56 -2.30 -1.32 0.00 0.00 175.29 172.41 2ck0 n PRO 14 N -0.23 0.60 -0.95 9.60 -0.02 -1.26 -0.65 135.00 142.09 2ck0 n PRO 14 Ca 0.03 0.22 0.00 0.00 -2.02 0.00 0.00 63.50 61.73 2ck0 n PRO 14 Cb 0.53 -1.56 0.00 0.00 -0.02 0.00 0.00 33.50 32.45 2ck0 n PRO 14 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2ck0 n ARG 15 N 0.48 -1.16 -0.54 -0.52 5.12 0.12 -4.93 116.66 115.24 2ck0 n ARG 15 Ca 0.11 0.29 -0.01 0.00 -1.93 0.00 0.00 57.85 56.31 2ck0 n ARG 15 Cb 0.41 -4.29 0.01 0.00 -1.16 0.00 0.00 32.46 27.43 2ck0 n ARG 15 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ck0 n GLY 16 N -0.54 0.27 2.96 -0.13 0.00 0.17 -4.38 105.19 103.55 2ck0 n GLY 16 Ca 0.00 -1.88 -0.10 0.00 0.00 0.00 0.00 46.02 44.04 2ck0 n GLY 16 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ck0 s SER 17 N -1.18 0.19 -0.00 1.61 1.04 -1.26 -1.32 113.70 112.77 2ck0 s SER 17 Ca 0.03 -0.39 -0.07 0.00 0.48 0.00 0.00 55.95 56.00 2ck0 s SER 17 Cb -0.00 0.09 0.00 0.00 0.10 0.00 0.00 66.02 66.21 2ck0 s SER 17 CO 0.02 -0.24 0.14 -0.22 0.98 0.00 0.00 173.24 173.92 2ck0 s LEU 18 N -1.17 1.54 -0.18 2.42 2.96 -0.55 -5.00 118.68 118.70 2ck0 s LEU 18 Ca -0.13 -0.17 0.01 0.00 -0.22 0.00 0.00 54.13 53.62 2ck0 s LEU 18 Cb -0.08 0.67 0.03 0.00 0.50 0.00 0.00 46.19 47.31 2ck0 s LEU 18 CO -0.01 -0.35 -0.15 -0.75 -1.32 0.00 0.00 176.35 173.77 2ck0 s LYS 19 N -1.29 2.45 0.43 1.98 2.20 -1.26 0.20 119.74 124.45 2ck0 s LYS 19 Ca -0.14 -0.76 -0.02 0.00 -0.36 0.00 0.00 55.97 54.70 2ck0 s LYS 19 Cb -0.07 -2.37 -0.03 0.00 -1.51 0.00 0.00 37.83 33.85 2ck0 s LYS 19 CO 0.01 -0.29 0.68 -0.51 -0.36 0.00 0.00 175.35 174.88 2ck0 s LEU 20 N 1.38 3.77 0.02 5.43 1.43 -0.21 -4.76 118.68 125.75 2ck0 s LEU 20 Ca 0.03 0.62 -0.02 0.00 -1.03 0.00 0.00 54.13 53.72 2ck0 s LEU 20 Cb -0.14 -3.52 -0.02 0.00 0.03 0.00 0.00 46.19 42.55 2ck0 s LEU 20 CO -0.10 -0.50 0.02 -0.44 0.23 0.00 0.00 176.35 175.56 2ck0 s SER 21 N -4.10 0.21 -0.05 2.29 0.01 -0.88 -2.53 113.70 108.65 2ck0 s SER 21 Ca 0.45 -0.50 -0.01 0.00 1.31 0.00 0.00 55.95 57.20 2ck0 s SER 21 Cb -0.10 0.15 0.03 0.00 0.21 0.00 0.00 66.02 66.31 2ck0 s SER 21 CO 0.40 -0.38 0.02 0.00 0.41 0.00 0.00 173.24 173.69 2ck0 s ALA 23 N 1.67 3.46 0.00 0.00 0.00 -0.57 -0.95 121.76 125.38 2ck0 s ALA 23 Ca -0.01 -1.12 -0.06 0.00 0.00 0.00 0.00 51.96 50.77 2ck0 s ALA 23 Cb -0.13 -2.42 -0.05 0.00 0.00 0.00 0.00 23.12 20.53 2ck0 s ALA 23 CO -0.03 -0.58 0.25 0.00 0.00 0.00 0.00 175.76 175.40 2ck0 s ALA 24 N 1.73 3.87 0.05 0.00 0.00 -0.15 -1.15 121.76 126.12 2ck0 s ALA 24 Ca 0.07 -0.62 -0.15 0.00 0.00 0.00 0.00 51.96 51.26 2ck0 s ALA 24 Cb -0.16 -2.03 0.02 0.00 0.00 0.00 0.00 23.12 20.96 2ck0 s ALA 24 CO 0.10 0.67 0.33 -1.12 0.00 0.00 0.00 175.76 175.74 2ck0 s SER 25 N -1.74 -0.16 0.00 0.00 0.01 0.94 -4.88 113.70 107.87 2ck0 s SER 25 Ca 0.27 -0.18 0.00 0.00 1.31 0.00 0.00 55.95 57.35 2ck0 s SER 25 Cb -0.13 0.38 0.00 0.00 0.21 0.00 0.00 66.02 66.48 2ck0 s SER 25 CO 0.16 -0.66 0.00 0.61 0.41 0.00 0.00 173.24 173.77 2ck0 n GLY 26 N 0.45 0.97 3.48 3.44 0.00 -1.23 0.29 105.19 112.58 2ck0 n GLY 26 Ca -0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.74 2ck0 n GLY 26 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ck0 s PHE 27 N -3.42 0.05 -0.90 1.61 -0.12 -1.26 -4.33 117.98 109.61 2ck0 s PHE 27 Ca 0.00 -0.40 -0.24 0.00 -0.05 0.00 0.00 56.93 56.23 2ck0 s PHE 27 Cb 0.00 0.26 0.01 0.00 -0.63 0.00 0.00 43.02 42.66 2ck0 s PHE 27 CO 0.00 -0.87 1.59 0.95 -0.05 0.00 0.00 175.22 176.84 2ck0 s THR 28 N -3.91 3.70 0.30 -4.49 -4.23 -1.26 -4.83 115.64 100.92 2ck0 s THR 28 Ca 0.12 -0.34 0.02 0.00 -1.18 0.00 0.00 61.69 60.30 2ck0 s THR 28 Cb 0.00 -4.64 0.29 0.00 1.34 0.00 0.00 72.50 69.49 2ck0 s THR 28 CO -0.01 -1.56 1.87 0.15 -0.54 0.00 0.00 174.62 174.53 2ck0 h PHE 29 N 10.77 1.08 0.00 3.99 3.57 -1.94 -2.13 116.94 132.28 2ck0 h PHE 29 Ca 0.04 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.57 2ck0 h PHE 29 Cb 1.03 -0.35 0.00 0.00 2.79 0.00 0.00 35.95 39.42 2ck0 h PHE 29 CO 1.21 0.49 0.10 -2.95 -2.23 0.00 0.00 178.31 174.93 2ck0 h ASN 30 N 1.00 0.00 0.00 0.41 -1.07 -1.88 -2.74 115.58 111.30 2ck0 h ASN 30 Ca 0.45 0.00 -0.07 0.00 0.07 0.00 0.00 56.30 56.75 2ck0 h ASN 30 Cb 0.37 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 36.61 2ck0 h ASN 30 CO -0.20 0.00 -1.87 0.35 0.07 0.00 0.00 177.43 175.78 2ck0 n THR 31 N -2.71 0.25 -3.51 6.14 -2.24 -0.80 -4.45 114.28 106.96 2ck0 n THR 31 Ca -0.02 -0.46 -0.29 0.00 -2.27 0.00 0.00 64.05 61.01 2ck0 n THR 31 Cb 0.15 -0.05 -0.03 0.00 -2.10 0.00 0.00 70.33 68.29 2ck0 n THR 31 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2ck0 s ASP 32 N -4.23 6.43 0.18 3.42 1.11 -1.03 -4.74 116.67 117.80 2ck0 s ASP 32 Ca -0.07 0.59 -0.22 0.00 0.18 0.00 0.00 52.55 53.03 2ck0 s ASP 32 Cb 0.10 -2.09 -0.08 0.00 1.07 0.00 0.00 42.92 41.92 2ck0 s ASP 32 CO 0.71 -0.11 0.73 0.00 1.18 0.00 0.00 175.17 177.69 2ck0 s ALA 33 N -1.95 3.45 0.06 5.23 0.00 -1.26 -4.33 121.76 122.96 2ck0 s ALA 33 Ca 0.42 0.25 0.08 0.00 0.00 0.00 0.00 51.96 52.71 2ck0 s ALA 33 Cb -0.11 -2.87 -0.03 0.00 0.00 0.00 0.00 23.12 20.11 2ck0 s ALA 33 CO 0.29 0.32 -0.21 -1.64 0.00 0.00 0.00 175.76 174.51 2ck0 s MET 34 N -1.45 1.91 0.22 0.00 -1.94 -0.71 -1.30 119.30 116.02 2ck0 s MET 34 Ca 0.38 -1.07 0.04 0.00 -1.71 0.00 0.00 55.69 53.32 2ck0 s MET 34 Cb -0.20 -2.10 -0.05 0.00 2.01 0.00 0.00 34.83 34.49 2ck0 s MET 34 CO 0.23 0.52 -0.02 -0.80 -0.01 0.00 0.00 175.02 174.94 2ck0 s ASN 35 N -1.50 1.80 -0.11 3.03 0.01 0.88 -0.90 114.94 118.16 2ck0 s ASN 35 Ca 0.14 -1.18 0.00 0.00 -0.71 0.00 0.00 52.86 51.11 2ck0 s ASN 35 Cb -0.10 0.01 0.02 0.00 0.41 0.00 0.00 41.25 41.59 2ck0 s ASN 35 CO 0.05 -0.48 -0.10 0.26 -1.51 0.00 0.00 177.10 175.32 2ck0 s TRP 36 N -3.41 1.61 0.10 2.20 0.52 -0.63 -0.84 118.94 118.49 2ck0 s TRP 36 Ca 0.26 -0.79 0.10 0.00 0.02 0.00 0.00 56.10 55.70 2ck0 s TRP 36 Cb 0.05 -1.27 -0.04 0.00 -1.15 0.00 0.00 33.47 31.06 2ck0 s TRP 36 CO 0.07 -0.50 -0.26 0.08 0.02 0.00 0.00 176.95 176.37 2ck0 s VAL 37 N 1.46 2.30 0.14 4.03 1.01 -0.72 -0.18 120.40 128.44 2ck0 s VAL 37 Ca 0.01 -1.62 0.05 0.00 0.00 0.00 0.00 61.98 60.42 2ck0 s VAL 37 Cb -0.13 -1.99 -0.04 0.00 0.00 0.00 0.00 36.38 34.22 2ck0 s VAL 37 CO -0.06 0.17 -0.11 0.00 0.00 0.00 0.00 175.10 175.10 2ck0 s ARG 38 N -1.83 1.05 -0.14 2.72 1.70 -0.27 0.67 118.95 122.85 2ck0 s ARG 38 Ca 0.14 -1.39 -0.02 0.00 -0.47 0.00 0.00 55.73 53.99 2ck0 s ARG 38 Cb -0.10 -0.72 0.04 0.00 -0.57 0.00 0.00 34.95 33.60 2ck0 s ARG 38 CO 0.05 0.11 0.01 -1.14 -1.08 0.00 0.00 175.30 173.25 2ck0 s GLN 39 N -3.40 0.75 0.46 3.89 0.74 0.24 -0.52 119.66 121.82 2ck0 s GLN 39 Ca 0.14 -0.21 -0.22 0.00 0.05 0.00 0.00 55.36 55.12 2ck0 s GLN 39 Cb -0.00 -1.62 -0.08 0.00 1.10 0.00 0.00 33.01 32.41 2ck0 s GLN 39 CO 0.02 -0.47 1.11 0.00 -0.55 0.00 0.00 175.29 175.40 2ck0 s ALA 40 N 1.88 2.94 -0.66 1.58 0.00 -1.25 -0.85 121.76 125.41 2ck0 s ALA 40 Ca 0.02 0.81 -0.38 0.00 0.00 0.00 0.00 51.96 52.41 2ck0 s ALA 40 Cb -0.15 -3.33 -0.19 0.00 0.00 0.00 0.00 23.12 19.45 2ck0 s ALA 40 CO -0.07 -0.51 2.35 -2.30 0.00 0.00 0.00 175.76 175.23 2ck0 n PRO 41 N -0.57 0.16 -2.71 0.00 -0.02 -1.26 -0.21 135.00 130.38 2ck0 n PRO 41 Ca 0.08 0.03 -0.14 0.00 -2.02 0.00 0.00 63.50 61.45 2ck0 n PRO 41 Cb 0.50 -1.68 0.02 0.00 -0.02 0.00 0.00 33.50 32.32 2ck0 n PRO 41 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2ck0 n GLY 42 N 6.99 -0.06 1.23 -1.23 0.00 -1.26 -5.02 105.19 105.84 2ck0 n GLY 42 Ca 0.57 -0.22 -0.09 0.00 0.00 0.00 0.00 46.02 46.27 2ck0 n GLY 42 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2ck0 n LYS 43 N -2.76 0.76 -0.94 1.61 4.76 0.71 -5.17 118.16 117.14 2ck0 n LYS 43 Ca -0.07 -1.27 -0.10 0.00 -2.87 0.00 0.00 58.31 54.00 2ck0 n LYS 43 Cb 0.58 0.71 0.06 0.00 -1.84 0.00 0.00 35.03 34.54 2ck0 n LYS 43 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2ck0 n GLY 44 N 1.09 -0.52 3.86 0.72 0.00 -1.26 -4.69 105.19 104.39 2ck0 n GLY 44 Ca -0.02 -1.80 -0.33 0.00 0.00 0.00 0.00 46.02 43.87 2ck0 n GLY 44 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ck0 s LEU 45 N 0.00 4.23 -0.12 0.99 1.43 -1.26 -3.94 118.68 120.01 2ck0 s LEU 45 Ca 0.26 0.99 -0.02 0.00 -1.03 0.00 0.00 54.13 54.34 2ck0 s LEU 45 Cb -0.01 -3.54 0.04 0.00 0.03 0.00 0.00 46.19 42.71 2ck0 s LEU 45 CO 0.18 -0.01 0.02 -0.70 0.23 0.00 0.00 176.35 176.07 2ck0 s GLU 46 N -2.49 0.57 0.26 1.70 2.12 0.32 -4.99 118.70 116.19 2ck0 s GLU 46 Ca 0.44 -0.07 -0.30 0.00 0.36 0.00 0.00 54.97 55.40 2ck0 s GLU 46 Cb -0.13 -1.39 -0.10 0.00 0.26 0.00 0.00 34.13 32.77 2ck0 s GLU 46 CO 0.20 -0.44 1.45 -0.46 -0.54 0.00 0.00 175.26 175.47 2ck0 s TRP 47 N 1.95 2.99 -0.11 5.30 -0.00 -1.26 -1.12 118.94 126.69 2ck0 s TRP 47 Ca 0.03 1.02 -0.13 0.00 -0.00 0.00 0.00 56.10 57.02 2ck0 s TRP 47 Cb -0.14 -3.84 -0.04 0.00 -0.00 0.00 0.00 33.47 29.45 2ck0 s TRP 47 CO -0.06 -2.72 -0.26 0.28 -0.00 0.00 0.00 176.95 174.19 2ck0 n VAL 48 N 2.23 1.37 -4.05 5.86 0.31 0.75 -4.64 118.33 120.15 2ck0 n VAL 48 Ca 0.06 0.21 -0.09 0.00 -0.01 0.00 0.00 64.34 64.51 2ck0 n VAL 48 Cb 0.40 -2.14 -0.09 0.00 -0.91 0.00 0.00 33.84 31.10 2ck0 n VAL 48 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2ck0 s ALA 49 N -2.71 0.43 -0.13 3.52 0.00 -0.96 -1.46 121.76 120.45 2ck0 s ALA 49 Ca -0.21 -1.17 -0.09 0.00 0.00 0.00 0.00 51.96 50.49 2ck0 s ALA 49 Cb 0.03 0.79 0.04 0.00 0.00 0.00 0.00 23.12 23.99 2ck0 s ALA 49 CO 0.32 -0.54 0.32 0.50 0.00 0.00 0.00 175.76 176.35 2ck0 s ARG 50 N -3.99 0.32 -0.22 0.00 3.52 -0.30 -1.61 118.95 116.67 2ck0 s ARG 50 Ca 0.19 0.56 -0.00 0.00 -0.13 0.00 0.00 55.73 56.34 2ck0 s ARG 50 Cb 0.06 0.03 0.06 0.00 -1.56 0.00 0.00 34.95 33.53 2ck0 s ARG 50 CO -0.01 -0.11 -0.03 -1.50 -0.81 0.00 0.00 175.30 172.84 2ck0 s ILE 51 N 0.84 1.19 0.97 4.11 2.07 -0.07 -0.86 121.20 129.45 2ck0 s ILE 51 Ca -0.06 -0.97 -0.12 0.00 -1.41 0.00 0.00 60.65 58.09 2ck0 s ILE 51 Cb -0.06 -1.52 0.17 0.00 0.13 0.00 0.00 42.46 41.17 2ck0 s ILE 51 CO -0.06 -0.12 1.09 -0.13 -1.91 0.00 0.00 174.94 173.82 2ck0 s ARG 52 N 1.55 0.66 0.97 3.50 0.52 0.51 -1.73 118.95 124.94 2ck0 s ARG 52 Ca -0.04 0.62 -0.12 0.00 -0.52 0.00 0.00 55.73 55.67 2ck0 s ARG 52 Cb -0.18 -1.76 0.17 0.00 0.52 0.00 0.00 34.95 33.71 2ck0 s ARG 52 CO -0.07 -2.60 1.10 -1.54 0.02 0.00 0.00 175.30 172.22 2ck0 s SER 52 N -3.42 2.88 0.39 0.23 1.04 -1.26 -4.11 113.70 109.45 2ck0 s SER 52 Ca 0.65 1.13 0.09 0.00 0.48 0.00 0.00 55.95 58.30 2ck0 s SER 52 Cb -0.18 -1.77 0.86 0.00 0.10 0.00 0.00 66.02 65.02 2ck0 s SER 52 CO 0.57 -2.96 1.98 0.50 0.98 0.00 0.00 173.24 174.31 2ck0 h LYS 52 N -1.78 0.59 0.00 4.02 1.63 -1.93 0.47 116.57 119.57 2ck0 h LYS 52 Ca -0.53 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.23 2ck0 h LYS 52 Cb 1.33 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 32.83 2ck0 h LYS 52 CO 0.59 0.39 0.00 0.41 -3.45 0.00 0.00 179.45 177.39 2ck0 n GLY 52 N -1.48 -0.76 0.66 5.01 0.00 -1.26 -0.06 105.19 107.31 2ck0 n GLY 52 Ca 0.09 0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.21 2ck0 n GLY 52 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2ck0 n PHE 53 N -1.72 0.00 -3.23 1.61 3.01 0.09 -4.98 117.46 112.25 2ck0 n PHE 53 Ca 0.01 -1.38 -0.22 0.00 1.01 0.00 0.00 57.45 56.87 2ck0 n PHE 53 Cb 0.07 -0.24 0.00 0.00 -0.01 0.00 0.00 39.48 39.30 2ck0 n PHE 53 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 2ck0 n ASN 54 N -0.98 -4.17 -3.58 4.37 3.02 0.92 -2.68 115.26 112.16 2ck0 n ASN 54 Ca 0.18 -0.33 -0.26 0.00 -0.03 0.00 0.00 54.58 54.14 2ck0 n ASN 54 Cb 0.73 -3.44 0.04 0.00 -0.61 0.00 0.00 39.78 36.50 2ck0 n ASN 54 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2ck0 n PHE 55 N -4.00 -2.35 -1.69 3.10 3.72 -0.80 -4.91 117.46 110.52 2ck0 n PHE 55 Ca -0.04 0.81 -0.44 0.00 -0.05 0.00 0.00 57.45 57.72 2ck0 n PHE 55 Cb 0.56 -4.27 -0.03 0.00 -0.94 0.00 0.00 39.48 34.80 2ck0 n PHE 55 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2ck0 n ALA 56 N -4.42 1.79 -2.49 4.37 0.00 -1.09 -4.60 120.51 114.06 2ck0 n ALA 56 Ca -0.00 0.42 -0.32 0.00 0.00 0.00 0.00 53.44 53.53 2ck0 n ALA 56 Cb 0.56 -2.39 -0.13 0.00 0.00 0.00 0.00 19.45 17.49 2ck0 n ALA 56 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2ck0 s THR 57 N 0.66 3.11 0.02 0.00 -4.23 -1.26 -0.36 115.64 113.58 2ck0 s THR 57 Ca 0.74 -0.81 0.04 0.00 -1.18 0.00 0.00 61.69 60.47 2ck0 s THR 57 Cb -0.61 -2.25 -0.02 0.00 1.34 0.00 0.00 72.50 70.96 2ck0 s THR 57 CO 0.40 0.52 -0.11 -0.31 -0.54 0.00 0.00 174.62 174.57 2ck0 s TYR 58 N -0.81 1.01 0.00 3.99 2.02 -0.04 -4.99 117.35 118.52 2ck0 s TYR 58 Ca 0.13 -0.30 0.02 0.00 -0.37 0.00 0.00 57.07 56.55 2ck0 s TYR 58 Cb -0.11 -0.61 -0.01 0.00 -0.40 0.00 0.00 41.96 40.83 2ck0 s TYR 58 CO 0.02 0.00 -0.06 0.71 -1.57 0.00 0.00 175.55 174.66 2ck0 s TYR 59 N -0.68 0.53 0.68 2.71 2.02 -1.26 -1.15 117.35 120.21 2ck0 s TYR 59 Ca 0.01 -0.14 -0.17 0.00 -0.37 0.00 0.00 57.07 56.40 2ck0 s TYR 59 Cb -0.07 -0.34 0.01 0.00 -0.40 0.00 0.00 41.96 41.17 2ck0 s TYR 59 CO 0.01 -0.02 1.24 0.00 -1.57 0.00 0.00 175.55 175.21 2ck0 s ALA 60 N -0.26 2.26 0.24 3.71 0.00 -0.54 -4.74 121.76 122.44 2ck0 s ALA 60 Ca 0.01 1.02 -0.05 0.00 0.00 0.00 0.00 51.96 52.94 2ck0 s ALA 60 Cb -0.03 -3.50 0.43 0.00 0.00 0.00 0.00 23.12 20.02 2ck0 s ALA 60 CO -0.00 -1.69 1.75 -0.44 0.00 0.00 0.00 175.76 175.38 2ck0 h ASP 61 N 0.15 0.35 0.71 0.00 5.19 -1.94 -1.32 116.42 119.57 2ck0 h ASP 61 Ca -0.49 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.01 2ck0 h ASP 61 Cb 1.31 0.05 0.00 0.00 0.18 0.00 0.00 39.33 40.87 2ck0 h ASP 61 CO 0.52 0.16 0.00 -1.54 -3.12 0.00 0.00 179.24 175.25 2ck0 n SER 62 N -4.95 0.68 -0.04 6.45 3.41 -1.26 -3.09 113.62 114.81 2ck0 n SER 62 Ca 0.14 0.67 0.03 0.00 -0.26 0.00 0.00 58.87 59.45 2ck0 n SER 62 Cb 0.38 -0.81 -0.03 0.00 -0.26 0.00 0.00 64.21 63.48 2ck0 n SER 62 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 2ck0 n VAL 63 N -2.26 0.00 -1.67 -3.33 0.31 -0.72 -5.00 118.33 105.65 2ck0 n VAL 63 Ca 0.02 -0.37 -0.39 0.00 -0.01 0.00 0.00 64.34 63.58 2ck0 n VAL 63 Cb 0.22 1.02 0.03 0.00 -0.91 0.00 0.00 33.84 34.21 2ck0 n VAL 63 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 2ck0 n ARG 64 N -0.91 1.48 -0.34 5.55 0.63 -0.58 -2.11 116.66 120.38 2ck0 n ARG 64 Ca 0.02 0.54 0.00 0.00 -0.92 0.00 0.00 57.85 57.49 2ck0 n ARG 64 Cb 0.11 -2.32 0.00 0.00 0.45 0.00 0.00 32.46 30.70 2ck0 n ARG 64 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 2ck0 n ASP 65 N -0.37 0.00 -0.09 6.15 10.43 -1.26 -4.61 116.55 126.80 2ck0 n ASP 65 Ca 0.10 0.00 -0.18 0.00 2.57 0.00 0.00 54.79 57.28 2ck0 n ASP 65 Cb 0.43 -1.70 -0.06 0.00 1.84 0.00 0.00 41.12 41.63 2ck0 n ASP 65 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 2ck0 n ARG 66 N -2.00 0.37 -2.91 -1.24 1.74 -1.01 -5.04 116.66 106.58 2ck0 n ARG 66 Ca 0.00 0.15 -0.23 0.00 -0.77 0.00 0.00 57.85 57.00 2ck0 n ARG 66 Cb 0.00 -1.15 0.01 0.00 -1.02 0.00 0.00 32.46 30.31 2ck0 n ARG 66 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2ck0 s PHE 67 N -2.32 3.20 -0.26 -1.55 0.40 -0.90 -2.70 117.98 113.86 2ck0 s PHE 67 Ca -0.24 0.26 -0.02 0.00 -0.60 0.00 0.00 56.93 56.33 2ck0 s PHE 67 Cb 0.09 -2.38 0.12 0.00 0.51 0.00 0.00 43.02 41.36 2ck0 s PHE 67 CO 0.32 -0.43 0.26 0.99 0.70 0.00 0.00 175.22 177.05 2ck0 s THR 68 N -2.61 -0.36 0.22 0.64 2.01 0.68 -4.94 115.64 111.27 2ck0 s THR 68 Ca 0.49 -0.36 -0.27 0.00 0.31 0.00 0.00 61.69 61.87 2ck0 s THR 68 Cb -0.10 -0.87 -0.09 0.00 0.01 0.00 0.00 72.50 71.45 2ck0 s THR 68 CO 0.39 -0.38 0.86 -0.51 -0.69 0.00 0.00 174.62 174.29 2ck0 s ILE 69 N 2.34 4.23 0.33 1.82 2.07 -1.26 -1.97 121.20 128.76 2ck0 s ILE 69 Ca 0.09 1.86 -0.11 0.00 -1.41 0.00 0.00 60.65 61.07 2ck0 s ILE 69 Cb -0.15 -4.19 0.02 0.00 0.13 0.00 0.00 42.46 38.27 2ck0 s ILE 69 CO -0.25 0.46 0.62 -0.94 -1.91 0.00 0.00 174.94 172.92 2ck0 s SER 70 N -1.23 0.25 0.25 4.50 1.04 -1.03 -5.02 113.70 112.46 2ck0 s SER 70 Ca 0.40 -1.15 -0.15 0.00 0.48 0.00 0.00 55.95 55.52 2ck0 s SER 70 Cb -0.24 0.72 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2ck0 s SER 70 CO 0.28 -1.41 0.54 0.00 0.98 0.00 0.00 173.24 173.62 2ck0 s ARG 71 N -3.08 1.58 -0.36 4.02 1.70 -1.26 -1.66 118.95 119.89 2ck0 s ARG 71 Ca 0.21 -1.14 0.00 0.00 -0.47 0.00 0.00 55.73 54.33 2ck0 s ARG 71 Cb -0.03 0.51 0.14 0.00 -0.57 0.00 0.00 34.95 35.00 2ck0 s ARG 71 CO 0.13 -0.67 0.23 0.34 -1.08 0.00 0.00 175.30 174.25 2ck0 s ASP 72 N -2.98 2.78 0.45 -2.89 -1.08 -0.05 -4.99 116.67 107.92 2ck0 s ASP 72 Ca 0.18 -2.23 0.18 0.00 -0.52 0.00 0.00 52.55 50.16 2ck0 s ASP 72 Cb -0.02 -0.36 1.13 0.00 -1.46 0.00 0.00 42.92 42.21 2ck0 s ASP 72 CO 0.07 -0.30 1.92 0.44 0.52 0.00 0.00 175.17 177.82 2ck0 h ASP 73 N 6.91 0.31 1.31 -0.34 3.45 -1.96 0.37 116.42 126.48 2ck0 h ASP 73 Ca 0.08 0.02 -0.01 0.00 0.43 0.00 0.00 57.03 57.55 2ck0 h ASP 73 Cb 0.97 -0.04 -0.00 0.00 -0.56 0.00 0.00 39.33 39.70 2ck0 h ASP 73 CO 0.27 0.15 -0.05 0.77 -1.57 0.00 0.00 179.24 178.81 2ck0 h SER 74 N 0.33 0.00 -0.00 6.45 4.64 -1.96 -3.17 113.55 119.83 2ck0 h SER 74 Ca 0.37 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.69 2ck0 h SER 74 Cb 0.96 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.05 2ck0 h SER 74 CO -0.10 0.05 -0.38 0.00 -0.87 0.00 0.00 176.83 175.52 2ck0 n GLN 75 N -3.14 4.13 -3.25 4.77 1.13 -0.61 -5.00 117.38 115.41 2ck0 n GLN 75 Ca 0.02 -0.03 -0.19 0.00 -1.94 0.00 0.00 57.00 54.86 2ck0 n GLN 75 Cb 0.40 -0.90 0.05 0.00 0.11 0.00 0.00 30.24 29.90 2ck0 n GLN 75 CO 0.00 0.00 0.00 0.43 -1.44 0.00 0.00 177.06 176.05 2ck0 n SER 76 N -1.15 -5.40 -4.52 1.08 7.64 0.12 -4.81 113.62 106.58 2ck0 n SER 76 Ca 0.02 -0.38 -0.34 0.00 1.01 0.00 0.00 58.87 59.18 2ck0 n SER 76 Cb 0.13 -4.06 -0.12 0.00 -1.01 0.00 0.00 64.21 59.16 2ck0 n SER 76 CO 0.00 0.00 0.00 -0.04 -3.01 0.00 0.00 175.04 171.99 2ck0 s MET 77 N -5.90 3.03 -0.11 1.43 -1.94 -1.01 -0.98 119.30 113.82 2ck0 s MET 77 Ca 0.41 -0.57 0.01 0.00 -1.71 0.00 0.00 55.69 53.83 2ck0 s MET 77 Cb -0.18 -2.65 -0.02 0.00 2.01 0.00 0.00 34.83 33.99 2ck0 s MET 77 CO 0.51 0.50 -0.14 -1.17 -0.01 0.00 0.00 175.02 174.71 2ck0 s LEU 78 N -0.37 2.70 0.16 -0.03 2.96 -0.12 -0.87 118.68 123.12 2ck0 s LEU 78 Ca 0.05 -0.30 0.10 0.00 -0.22 0.00 0.00 54.13 53.76 2ck0 s LEU 78 Cb -0.12 -1.59 -0.04 0.00 0.50 0.00 0.00 46.19 44.93 2ck0 s LEU 78 CO 0.02 0.21 -0.22 -0.31 -1.32 0.00 0.00 176.35 174.74 2ck0 s TYR 79 N 0.07 2.05 -0.31 5.38 2.02 -0.66 -0.33 117.35 125.58 2ck0 s TYR 79 Ca -0.05 -0.41 -0.03 0.00 -0.37 0.00 0.00 57.07 56.21 2ck0 s TYR 79 Cb -0.15 -1.04 0.11 0.00 -0.40 0.00 0.00 41.96 40.48 2ck0 s TYR 79 CO 0.04 0.38 0.13 -1.17 -1.57 0.00 0.00 175.55 173.37 2ck0 s LEU 80 N -2.49 1.05 -0.30 -1.29 2.96 -1.05 -2.45 118.68 115.10 2ck0 s LEU 80 Ca 0.16 -1.51 -0.24 0.00 -0.22 0.00 0.00 54.13 52.32 2ck0 s LEU 80 Cb -0.08 -0.50 0.00 0.00 0.50 0.00 0.00 46.19 46.12 2ck0 s LEU 80 CO 0.07 -0.42 0.80 -1.58 -1.32 0.00 0.00 176.35 173.91 2ck0 s GLN 81 N 1.82 3.98 -0.16 1.98 2.00 -0.83 -1.04 119.66 127.41 2ck0 s GLN 81 Ca 0.10 0.64 -0.05 0.00 -2.00 0.00 0.00 55.36 54.05 2ck0 s GLN 81 Cb -0.17 -3.72 -0.03 0.00 0.80 0.00 0.00 33.01 29.88 2ck0 s GLN 81 CO -0.29 -0.68 0.01 -1.64 -0.50 0.00 0.00 175.29 172.20 2ck0 s MET 82 N 2.98 3.79 0.25 1.67 -1.94 0.13 -0.23 119.30 125.95 2ck0 s MET 82 Ca 0.33 -0.42 0.05 0.00 -1.71 0.00 0.00 55.69 53.94 2ck0 s MET 82 Cb -0.14 -3.06 -0.05 0.00 2.01 0.00 0.00 34.83 33.59 2ck0 s MET 82 CO 0.12 0.29 -0.04 -0.80 -0.01 0.00 0.00 175.02 174.58 2ck0 s ASN 83 N 0.28 2.37 -1.66 3.03 -0.87 -1.10 -1.48 114.94 115.51 2ck0 s ASN 83 Ca 0.00 -1.19 -0.13 0.00 -1.57 0.00 0.00 52.86 49.97 2ck0 s ASN 83 Cb -0.13 -0.09 0.12 0.00 -0.02 0.00 0.00 41.25 41.12 2ck0 s ASN 83 CO 0.01 -0.40 0.56 0.59 -2.57 0.00 0.00 177.10 175.29 2ck0 n ASN 84 N -0.50 -1.78 -4.54 -1.22 4.13 -1.14 -4.69 115.26 105.53 2ck0 n ASN 84 Ca -0.06 -1.10 -0.39 0.00 1.68 0.00 0.00 54.58 54.72 2ck0 n ASN 84 Cb 0.63 -2.41 0.04 0.00 -1.54 0.00 0.00 39.78 36.50 2ck0 n ASN 84 CO 0.00 0.00 0.00 0.18 0.28 0.00 0.00 177.26 177.72 2ck0 n LEU 85 N -4.35 1.97 -4.24 3.41 4.77 -0.44 -4.62 117.00 113.51 2ck0 n LEU 85 Ca -0.05 0.82 -0.13 0.00 -0.03 0.00 0.00 56.01 56.61 2ck0 n LEU 85 Cb 0.55 -1.27 -0.10 0.00 -2.33 0.00 0.00 43.42 40.27 2ck0 n LEU 85 CO 0.86 -2.41 -0.37 -0.54 -1.33 0.00 0.00 177.39 173.60 2ck0 s LYS 86 N -2.26 1.05 0.44 3.23 1.02 -1.26 0.16 119.74 122.12 2ck0 s LYS 86 Ca 0.70 -1.47 0.13 0.00 0.02 0.00 0.00 55.97 55.34 2ck0 s LYS 86 Cb -0.46 -0.42 1.03 0.00 -0.52 0.00 0.00 37.83 37.45 2ck0 s LYS 86 CO 0.52 -0.03 2.02 1.15 -0.92 0.00 0.00 175.35 178.10 2ck0 h THR 87 N 2.76 0.96 -0.14 2.17 2.02 -1.96 -1.29 112.91 117.44 2ck0 h THR 87 Ca -0.36 -0.13 0.04 0.00 0.77 0.00 0.00 66.41 66.72 2ck0 h THR 87 Cb 1.19 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 2ck0 h THR 87 CO 0.64 0.07 0.13 -0.33 0.37 0.00 0.00 175.52 176.40 2ck0 h GLU 88 N 0.39 0.00 0.00 6.66 3.07 -1.96 -1.19 114.58 121.55 2ck0 h GLU 88 Ca 0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.07 2ck0 h GLU 88 Cb 0.35 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.26 2ck0 h GLU 88 CO -0.05 0.00 0.00 -0.25 -1.40 0.00 0.00 179.01 177.31 2ck0 n ASP 89 N -4.00 0.00 -4.74 1.42 8.00 -0.49 -4.82 116.55 111.91 2ck0 n ASP 89 Ca 0.00 -1.62 -0.41 0.00 0.71 0.00 0.00 54.79 53.48 2ck0 n ASP 89 Cb 0.25 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.30 2ck0 n ASP 89 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2ck0 s THR 90 N -2.00 3.80 -5.00 -3.53 2.01 -0.45 -4.85 115.64 105.62 2ck0 s THR 90 Ca 0.12 1.65 0.00 0.00 0.31 0.00 0.00 61.69 63.76 2ck0 s THR 90 Cb 0.05 -4.05 0.00 0.00 0.01 0.00 0.00 72.50 68.51 2ck0 s THR 90 CO 0.09 0.33 0.00 0.61 -0.69 0.00 0.00 174.62 174.96 2ck0 n GLY 91 N 1.75 -1.13 3.85 4.40 0.00 0.15 -4.34 105.19 109.86 2ck0 n GLY 91 Ca 0.01 -1.46 -0.38 0.00 0.00 0.00 0.00 46.02 44.20 2ck0 n GLY 91 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ck0 s ILE 92 N -2.33 5.21 -0.21 -0.61 1.09 -0.03 -0.81 121.20 123.51 2ck0 s ILE 92 Ca 0.00 0.60 -0.03 0.00 -1.10 0.00 0.00 60.65 60.12 2ck0 s ILE 92 Cb 0.00 -3.60 -0.00 0.00 -1.06 0.00 0.00 42.46 37.80 2ck0 s ILE 92 CO 0.00 0.59 -0.07 -0.31 -0.10 0.00 0.00 174.94 175.05 2ck0 s TYR 93 N -1.00 2.93 -0.03 3.97 1.51 -0.59 -0.60 117.35 123.54 2ck0 s TYR 93 Ca 0.20 -1.03 -0.06 0.00 -1.01 0.00 0.00 57.07 55.18 2ck0 s TYR 93 Cb -0.15 -2.07 -0.04 0.00 -0.11 0.00 0.00 41.96 39.59 2ck0 s TYR 93 CO 0.10 -0.57 0.22 0.71 -1.11 0.00 0.00 175.55 174.89 2ck0 s TYR 94 N 1.41 3.59 -0.33 2.71 1.51 0.21 -1.99 117.35 124.45 2ck0 s TYR 94 Ca 0.05 0.53 -0.11 0.00 -1.01 0.00 0.00 57.07 56.53 2ck0 s TYR 94 Cb -0.14 -1.95 -0.00 0.00 -0.11 0.00 0.00 41.96 39.75 2ck0 s TYR 94 CO -0.04 0.66 0.19 0.00 -1.11 0.00 0.00 175.55 175.24 2ck0 s VAL 96 N 1.63 2.73 -0.28 0.00 1.01 -0.02 0.37 120.40 125.85 2ck0 s VAL 96 Ca 0.05 -0.76 -0.26 0.00 0.00 0.00 0.00 61.98 61.00 2ck0 s VAL 96 Cb -0.18 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.07 2ck0 s VAL 96 CO 0.07 0.52 0.93 -0.60 0.00 0.00 0.00 175.10 176.03 2ck0 s ARG 97 N 0.59 4.11 -0.43 2.72 3.52 0.11 -0.08 118.95 129.49 2ck0 s ARG 97 Ca -0.09 0.97 0.02 0.00 -0.13 0.00 0.00 55.73 56.50 2ck0 s ARG 97 Cb -0.16 -3.69 0.13 0.00 -1.56 0.00 0.00 34.95 29.67 2ck0 s ARG 97 CO 0.03 -0.69 0.22 0.20 -0.81 0.00 0.00 175.30 174.26 2ck0 s GLY 98 N 1.47 1.66 -0.11 8.12 0.00 -0.42 -1.07 107.32 116.98 2ck0 s GLY 98 Ca 0.39 -2.55 -0.36 0.00 0.00 0.00 0.00 44.72 42.20 2ck0 s GLY 98 CO 0.11 1.52 1.81 0.54 0.00 0.00 0.00 173.10 177.07 2ck0 n ARG 99 N 3.64 1.90 -1.93 2.90 1.74 -1.22 -4.16 116.66 119.54 2ck0 n ARG 99 Ca 0.08 0.70 -0.42 0.00 -0.77 0.00 0.00 57.85 57.43 2ck0 n ARG 99 Cb 0.35 -2.49 -0.03 0.00 -1.02 0.00 0.00 32.46 29.27 2ck0 n ARG 99 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2ck0 s ASP 100 N 3.56 5.66 0.00 0.55 -4.77 -1.26 -2.19 116.67 118.23 2ck0 s ASP 100 Ca 0.93 1.22 0.00 0.00 -3.30 0.00 0.00 52.55 51.39 2ck0 s ASP 100 Cb -0.79 -2.52 0.00 0.00 -1.09 0.00 0.00 42.92 38.52 2ck0 s ASP 100 CO 0.54 -1.91 0.00 0.61 0.70 0.00 0.00 175.17 175.11 2ck0 n GLY 101 N 5.54 1.36 0.00 2.12 0.00 -1.26 -5.03 105.19 107.91 2ck0 n GLY 101 Ca 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 46.06 2ck0 n GLY 101 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ck0 n GLU 102 N 0.00 0.00 -3.86 1.61 1.02 -0.93 -5.17 120.64 113.32 2ck0 n GLU 102 Ca 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.04 2ck0 n GLU 102 Cb 0.00 0.00 0.01 0.00 -0.02 0.00 0.00 31.44 31.43 2ck0 n GLU 102 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2ck0 s ALA 103 N -3.95 -0.53 -0.89 0.62 0.00 -1.24 -5.03 121.76 110.74 2ck0 s ALA 103 Ca 0.00 -0.85 -0.25 0.00 0.00 0.00 0.00 51.96 50.87 2ck0 s ALA 103 Cb 0.00 0.76 0.02 0.00 0.00 0.00 0.00 23.12 23.91 2ck0 s ALA 103 CO 0.00 -0.96 1.51 -1.64 0.00 0.00 0.00 175.76 174.68 2ck0 s MET 104 N -2.54 3.24 0.00 0.00 -1.94 -1.26 -3.37 119.30 113.43 2ck0 s MET 104 Ca 0.18 -0.60 0.00 0.00 -1.71 0.00 0.00 55.69 53.56 2ck0 s MET 104 Cb -0.04 -4.90 0.00 0.00 2.01 0.00 0.00 34.83 31.89 2ck0 s MET 104 CO 0.13 -2.42 0.62 -3.47 -0.01 0.00 0.00 175.02 169.87 2ck0 n ASP 105 N 10.14 0.00 -4.36 3.03 4.64 -0.23 -4.84 116.55 124.93 2ck0 n ASP 105 Ca 0.25 0.62 -0.32 0.00 -1.38 0.00 0.00 54.79 53.96 2ck0 n ASP 105 Cb 0.50 -0.12 -0.15 0.00 -1.04 0.00 0.00 41.12 40.31 2ck0 n ASP 105 CO 0.00 0.00 0.00 -0.31 -0.82 0.00 0.00 177.20 176.07 2ck0 s TYR 106 N -1.48 2.48 0.13 -0.67 1.51 -1.21 -4.96 117.35 113.14 2ck0 s TYR 106 Ca 0.00 -0.38 0.08 0.00 -1.01 0.00 0.00 57.07 55.76 2ck0 s TYR 106 Cb 0.00 -1.56 -0.04 0.00 -0.11 0.00 0.00 41.96 40.25 2ck0 s TYR 106 CO 0.00 0.01 -0.11 -1.58 -1.11 0.00 0.00 175.55 172.76 2ck0 s TRP 107 N -0.58 2.67 0.05 2.71 0.52 -1.26 0.10 118.94 123.15 2ck0 s TRP 107 Ca 0.09 -0.20 -0.01 0.00 0.02 0.00 0.00 56.10 56.00 2ck0 s TRP 107 Cb -0.11 -1.37 0.01 0.00 -1.15 0.00 0.00 33.47 30.85 2ck0 s TRP 107 CO 0.00 0.44 0.06 0.41 0.02 0.00 0.00 176.95 177.89 2ck0 n GLY 108 N 0.51 -1.14 0.06 0.98 0.00 0.16 -4.83 105.19 100.94 2ck0 n GLY 108 Ca -0.13 -1.67 0.12 0.00 0.00 0.00 0.00 46.02 44.34 2ck0 n GLY 108 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2ck0 n GLN 109 N -1.13 0.23 0.00 1.61 1.13 -1.26 -4.77 117.38 113.19 2ck0 n GLN 109 Ca 0.01 0.10 0.00 0.00 -1.94 0.00 0.00 57.00 55.17 2ck0 n GLN 109 Cb 0.03 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 28.70 2ck0 n GLN 109 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2ck0 n GLY 110 N 1.36 0.32 2.92 1.08 0.00 -1.26 -5.02 105.19 104.60 2ck0 n GLY 110 Ca 0.04 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.18 2ck0 n GLY 110 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ck0 s THR 111 N -2.80 -0.14 0.31 2.61 -1.32 -0.84 -4.79 115.64 108.66 2ck0 s THR 111 Ca 0.00 0.24 -0.28 0.00 -1.21 0.00 0.00 61.69 60.44 2ck0 s THR 111 Cb 0.00 -0.29 -0.09 0.00 -1.51 0.00 0.00 72.50 70.60 2ck0 s THR 111 CO 0.00 0.10 1.05 -0.89 -2.21 0.00 0.00 174.62 172.67 2ck0 s THR 112 N 1.63 3.69 -0.05 5.08 2.01 -1.26 -1.54 115.64 125.19 2ck0 s THR 112 Ca -0.05 1.54 -0.01 0.00 0.31 0.00 0.00 61.69 63.49 2ck0 s THR 112 Cb -0.12 -3.92 0.03 0.00 0.01 0.00 0.00 72.50 68.50 2ck0 s THR 112 CO -0.06 0.25 0.01 -0.22 -0.69 0.00 0.00 174.62 173.91 2ck0 s LEU 113 N -1.82 0.69 -0.11 4.42 1.98 0.01 -0.06 118.68 123.78 2ck0 s LEU 113 Ca 0.48 -0.04 0.03 0.00 -2.89 0.00 0.00 54.13 51.71 2ck0 s LEU 113 Cb -0.27 -0.33 -0.00 0.00 0.66 0.00 0.00 46.19 46.24 2ck0 s LEU 113 CO 0.34 -0.17 -0.20 -0.89 -1.89 0.00 0.00 176.35 173.54 2ck0 s THR 114 N 1.71 2.38 -0.35 3.68 2.01 -0.02 -0.68 115.64 124.37 2ck0 s THR 114 Ca 0.00 -0.90 -0.04 0.00 0.31 0.00 0.00 61.69 61.06 2ck0 s THR 114 Cb -0.13 -1.94 0.07 0.00 0.01 0.00 0.00 72.50 70.51 2ck0 s THR 114 CO -0.04 0.55 0.10 -0.69 -0.69 0.00 0.00 174.62 173.86 2ck0 s VAL 115 N 0.38 3.35 0.11 3.82 1.01 -1.26 -0.82 120.40 127.00 2ck0 s VAL 115 Ca -0.16 -1.53 -0.24 0.00 0.00 0.00 0.00 61.98 60.05 2ck0 s VAL 115 Cb -0.17 -3.04 0.07 0.00 0.00 0.00 0.00 36.38 33.23 2ck0 s VAL 115 CO 0.07 -0.33 0.61 -0.94 0.00 0.00 0.00 175.10 174.51 2ck0 s SER 116 N 1.52 -0.57 0.08 3.32 1.04 -0.18 -4.61 113.70 114.31 2ck0 s SER 116 Ca 0.00 0.14 0.25 0.00 0.48 0.00 0.00 55.95 56.82 2ck0 s SER 116 Cb -0.21 0.58 0.45 0.00 0.10 0.00 0.00 66.02 66.94 2ck0 s SER 116 CO -0.01 -0.89 1.39 -1.54 0.98 0.00 0.00 173.24 173.18 2ck0 n SER 117 N -0.09 0.61 -3.87 7.02 3.41 -1.26 -3.75 113.62 115.68 2ck0 n SER 117 Ca -0.17 0.05 -0.28 0.00 -0.26 0.00 0.00 58.87 58.21 2ck0 n SER 117 Cb 0.63 0.13 0.23 0.00 -0.26 0.00 0.00 64.21 64.94 2ck0 n SER 117 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ck0 n ALA 118 N -1.72 -3.55 -2.43 7.33 0.00 -1.26 -5.03 120.51 113.85 2ck0 n ALA 118 Ca 0.04 -1.45 -0.23 0.00 0.00 0.00 0.00 53.44 51.81 2ck0 n ALA 118 Cb 0.40 -1.54 -0.11 0.00 0.00 0.00 0.00 19.45 18.20 2ck0 n ALA 118 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2ck0 s LYS 119 N -4.22 1.42 0.08 0.00 -2.85 -1.26 -5.01 119.74 107.90 2ck0 s LYS 119 Ca 0.59 -1.55 -0.31 0.00 -1.00 0.00 0.00 55.97 53.71 2ck0 s LYS 119 Cb -0.15 -1.48 -0.09 0.00 -2.06 0.00 0.00 37.83 34.06 2ck0 s LYS 119 CO 0.57 0.29 1.66 0.99 0.10 0.00 0.00 175.35 178.95 2ck0 s THR 120 N -2.27 2.98 -0.10 3.79 2.01 -1.26 -4.70 115.64 116.08 2ck0 s THR 120 Ca 0.21 0.46 0.00 0.00 0.31 0.00 0.00 61.69 62.68 2ck0 s THR 120 Cb -0.05 -3.30 0.02 0.00 0.01 0.00 0.00 72.50 69.19 2ck0 s THR 120 CO 0.09 0.00 -0.09 -0.89 -0.69 0.00 0.00 174.62 173.04 2ck0 s THR 121 N 2.54 1.09 0.60 -0.82 2.01 0.31 -4.96 115.64 116.40 2ck0 s THR 121 Ca 0.74 -0.36 -0.19 0.00 0.31 0.00 0.00 61.69 62.19 2ck0 s THR 121 Cb -0.40 -1.07 -0.03 0.00 0.01 0.00 0.00 72.50 71.01 2ck0 s THR 121 CO 0.32 0.37 1.24 -2.84 -0.69 0.00 0.00 174.62 173.03 2ck0 s PRO 122 N 1.41 2.86 0.31 4.92 0.02 -1.26 -1.36 135.00 141.90 2ck0 s PRO 122 Ca -0.00 1.93 -0.14 0.00 0.02 0.00 0.00 61.00 62.81 2ck0 s PRO 122 Cb -0.13 -1.93 -0.09 0.00 0.02 0.00 0.00 34.50 32.37 2ck0 s PRO 122 CO -0.05 -1.32 0.71 -1.25 -0.33 0.00 0.00 177.00 174.76 2ck0 s PRO 123 N -3.31 3.96 -0.31 5.54 0.04 -1.26 -4.28 135.00 135.38 2ck0 s PRO 123 Ca 0.79 0.59 -0.10 0.00 0.04 0.00 0.00 61.00 62.32 2ck0 s PRO 123 Cb -0.33 -2.46 -0.01 0.00 0.04 0.00 0.00 34.50 31.74 2ck0 s PRO 123 CO 0.36 0.17 0.15 -1.12 0.04 0.00 0.00 177.00 176.60 2ck0 s SER 124 N -2.35 5.55 -0.31 6.66 0.01 -0.47 -4.93 113.70 117.86 2ck0 s SER 124 Ca 0.53 -0.48 -0.14 0.00 1.31 0.00 0.00 55.95 57.17 2ck0 s SER 124 Cb -0.10 -2.00 -0.03 0.00 0.21 0.00 0.00 66.02 64.10 2ck0 s SER 124 CO 0.19 -0.18 0.34 -0.69 0.41 0.00 0.00 173.24 173.31 2ck0 s VAL 125 N 1.62 5.19 -0.14 3.43 1.01 -1.26 -1.69 120.40 128.56 2ck0 s VAL 125 Ca 0.05 0.24 -0.02 0.00 0.00 0.00 0.00 61.98 62.25 2ck0 s VAL 125 Cb -0.17 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 2ck0 s VAL 125 CO 0.06 0.04 -0.09 -0.31 0.00 0.00 0.00 175.10 174.80 2ck0 s TYR 126 N 2.00 2.90 -0.42 5.22 4.12 0.70 -4.96 117.35 126.91 2ck0 s TYR 126 Ca 0.12 -0.52 -0.29 0.00 0.02 0.00 0.00 57.07 56.40 2ck0 s TYR 126 Cb -0.16 -1.90 0.03 0.00 -1.52 0.00 0.00 41.96 38.40 2ck0 s TYR 126 CO 0.11 -0.16 1.11 -2.14 0.02 0.00 0.00 175.55 174.49 2ck0 s PRO 127 N 0.41 3.84 -0.66 -1.71 0.02 -1.26 -0.58 135.00 135.06 2ck0 s PRO 127 Ca -0.07 0.73 -0.22 0.00 0.02 0.00 0.00 61.00 61.45 2ck0 s PRO 127 Cb -0.15 -3.85 0.07 0.00 0.02 0.00 0.00 34.50 30.59 2ck0 s PRO 127 CO 0.04 -1.21 0.95 -0.51 -0.33 0.00 0.00 177.00 175.95 2ck0 s LEU 128 N 4.15 4.46 0.07 -5.54 1.02 -0.93 -4.98 118.68 116.95 2ck0 s LEU 128 Ca 0.47 -1.05 0.02 0.00 0.02 0.00 0.00 54.13 53.59 2ck0 s LEU 128 Cb -0.09 -2.41 -0.04 0.00 0.02 0.00 0.00 46.19 43.67 2ck0 s LEU 128 CO 0.26 -1.41 0.10 0.00 0.02 0.00 0.00 176.35 175.31 2ck0 s ALA 129 N 3.95 3.64 0.00 4.21 0.00 -1.26 -1.35 121.76 130.95 2ck0 s ALA 129 Ca 0.22 -0.98 0.00 0.00 0.00 0.00 0.00 51.96 51.20 2ck0 s ALA 129 Cb -0.17 -1.50 0.00 0.00 0.00 0.00 0.00 23.12 21.45 2ck0 s ALA 129 CO 0.09 0.76 0.00 -2.30 0.00 0.00 0.00 175.76 174.32 2ck0 n PRO 130 N 0.45 0.26 0.00 0.00 -0.02 -1.26 -5.02 135.00 129.41 2ck0 n PRO 130 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 2ck0 n PRO 130 Cb 0.51 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.99 2ck0 n PRO 130 CO 0.00 0.00 0.00 -1.33 1.98 0.00 0.00 175.50 176.15 2ck0 n MET 139 N 0.00 0.00 -4.77 -0.52 0.00 -1.25 -5.14 117.12 105.44 2ck0 n MET 139 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 57.70 57.43 2ck0 n MET 139 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 33.22 33.05 2ck0 n MET 139 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 175.97 176.11 2ck0 s VAL 140 N 0.00 1.40 0.12 2.03 -7.23 0.46 -4.75 120.40 112.43 2ck0 s VAL 140 Ca 0.00 -0.63 -0.25 0.00 -1.81 0.00 0.00 61.98 59.29 2ck0 s VAL 140 Cb 0.00 -1.25 -0.07 0.00 0.56 0.00 0.00 36.38 35.62 2ck0 s VAL 140 CO 0.00 0.41 0.76 -0.89 -0.31 0.00 0.00 175.10 175.07 2ck0 s THR 141 N 0.57 4.52 0.12 5.32 2.01 -1.26 -2.79 115.64 124.14 2ck0 s THR 141 Ca -0.16 1.65 0.06 0.00 0.31 0.00 0.00 61.69 63.55 2ck0 s THR 141 Cb -0.16 -4.12 -0.04 0.00 0.01 0.00 0.00 72.50 68.19 2ck0 s THR 141 CO 0.05 0.47 -0.14 -0.76 -0.69 0.00 0.00 174.62 173.55 2ck0 s LEU 142 N -0.74 2.40 0.38 4.42 1.43 -0.18 -4.58 118.68 121.81 2ck0 s LEU 142 Ca 0.36 -0.80 0.06 0.00 -1.03 0.00 0.00 54.13 52.72 2ck0 s LEU 142 Cb -0.22 -0.56 -0.02 0.00 0.03 0.00 0.00 46.19 45.42 2ck0 s LEU 142 CO 0.25 -0.14 0.22 -0.83 0.23 0.00 0.00 176.35 176.07 2ck0 s GLY 143 N -2.42 2.57 -0.14 -3.19 0.00 -0.46 -0.47 107.32 103.21 2ck0 s GLY 143 Ca 0.09 -1.59 -0.07 0.00 0.00 0.00 0.00 44.72 43.14 2ck0 s GLY 143 CO 0.03 -1.66 0.32 0.00 0.00 0.00 0.00 173.10 171.79 2ck0 s LEU 145 N 1.69 4.38 -0.45 0.00 2.96 0.26 -1.83 118.68 125.69 2ck0 s LEU 145 Ca -0.07 -0.72 -0.08 0.00 -0.22 0.00 0.00 54.13 53.05 2ck0 s LEU 145 Cb -0.10 -2.02 0.11 0.00 0.50 0.00 0.00 46.19 44.68 2ck0 s LEU 145 CO -0.10 -0.28 0.31 -0.69 -1.32 0.00 0.00 176.35 174.27 2ck0 s VAL 146 N 1.59 4.08 0.10 1.68 1.01 0.60 -0.21 120.40 129.26 2ck0 s VAL 146 Ca 0.04 -1.75 0.04 0.00 0.00 0.00 0.00 61.98 60.31 2ck0 s VAL 146 Cb -0.18 -3.66 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 2ck0 s VAL 146 CO 0.07 -0.71 -0.11 -1.59 0.00 0.00 0.00 175.10 172.75 2ck0 s LYS 147 N 1.34 0.90 -0.32 2.72 0.00 -0.68 0.44 119.74 124.14 2ck0 s LYS 147 Ca 0.05 -1.18 -0.01 0.00 0.00 0.00 0.00 55.97 54.83 2ck0 s LYS 147 Cb -0.25 -0.65 0.00 0.00 0.00 0.00 0.00 37.83 36.93 2ck0 s LYS 147 CO -0.01 0.11 0.14 0.41 0.00 0.00 0.00 175.35 176.00 2ck0 n GLY 148 N 0.55 0.45 3.80 0.59 0.00 0.15 -1.37 105.19 109.36 2ck0 n GLY 148 Ca -0.16 -0.58 -0.24 0.00 0.00 0.00 0.00 46.02 45.04 2ck0 n GLY 148 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2ck0 s TYR 149 N -2.70 2.46 -0.29 1.61 1.13 -1.00 -4.53 117.35 114.02 2ck0 s TYR 149 Ca 0.07 -0.62 -0.24 0.00 -1.41 0.00 0.00 57.07 54.87 2ck0 s TYR 149 Cb -0.03 -1.99 0.17 0.00 -1.10 0.00 0.00 41.96 39.01 2ck0 s TYR 149 CO 0.09 0.02 1.28 0.12 -2.51 0.00 0.00 175.55 174.54 2ck0 s PHE 150 N -2.61 -0.22 0.41 -3.49 5.36 -0.47 -1.17 117.98 115.81 2ck0 s PHE 150 Ca 0.40 0.51 0.00 0.00 -0.96 0.00 0.00 56.93 56.88 2ck0 s PHE 150 Cb 0.01 0.41 0.08 0.00 -0.34 0.00 0.00 43.02 43.18 2ck0 s PHE 150 CO 0.23 -0.10 0.57 -0.35 -1.46 0.00 0.00 175.22 174.10 2ck0 n PRO 151 N 2.00 0.22 -2.12 10.12 -0.04 -1.26 -0.53 135.00 143.39 2ck0 n PRO 151 Ca -0.12 -1.55 -0.32 0.00 -0.04 0.00 0.00 63.50 61.47 2ck0 n PRO 151 Cb 0.57 -0.37 -0.00 0.00 -0.04 0.00 0.00 33.50 33.65 2ck0 n PRO 151 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 2ck0 s GLU 152 N -3.92 3.52 0.60 0.54 2.56 -1.26 -4.76 118.70 115.98 2ck0 s GLU 152 Ca 0.38 1.07 0.10 0.00 0.00 0.00 0.00 54.97 56.52 2ck0 s GLU 152 Cb -0.02 -2.07 0.10 0.00 2.00 0.00 0.00 34.13 34.14 2ck0 s GLU 152 CO 0.25 -0.63 0.81 -1.25 -0.56 0.00 0.00 175.26 173.88 2ck0 s PRO 153 N -4.22 2.23 0.02 4.30 0.04 -1.26 -4.93 135.00 131.18 2ck0 s PRO 153 Ca 0.61 -1.72 0.02 0.00 0.04 0.00 0.00 61.00 59.95 2ck0 s PRO 153 Cb -0.13 -2.61 -0.01 0.00 0.04 0.00 0.00 34.50 31.78 2ck0 s PRO 153 CO 0.37 -0.94 -0.07 0.08 0.04 0.00 0.00 177.00 176.48 2ck0 s VAL 154 N -2.72 0.50 -0.23 -0.36 1.01 -1.26 -4.49 120.40 112.85 2ck0 s VAL 154 Ca 0.62 -0.68 -0.03 0.00 0.00 0.00 0.00 61.98 61.89 2ck0 s VAL 154 Cb -0.05 -0.50 0.00 0.00 0.00 0.00 0.00 36.38 35.83 2ck0 s VAL 154 CO 0.39 -0.14 -0.05 -0.89 0.00 0.00 0.00 175.10 174.41 2ck0 s THR 155 N -0.78 3.20 -0.12 3.92 2.01 0.11 -4.97 115.64 119.01 2ck0 s THR 155 Ca -0.04 -0.64 0.00 0.00 0.31 0.00 0.00 61.69 61.33 2ck0 s THR 155 Cb -0.06 -2.49 -0.02 0.00 0.01 0.00 0.00 72.50 69.94 2ck0 s THR 155 CO 0.00 0.38 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.48 2ck0 s VAL 156 N 1.44 3.02 0.05 3.82 1.01 -1.26 -1.25 120.40 127.23 2ck0 s VAL 156 Ca 0.05 -0.68 -0.01 0.00 0.00 0.00 0.00 61.98 61.33 2ck0 s VAL 156 Cb -0.15 -2.25 -0.04 0.00 0.00 0.00 0.00 36.38 33.94 2ck0 s VAL 156 CO -0.04 0.53 -0.02 0.42 0.00 0.00 0.00 175.10 176.00 2ck0 s THR 157 N 0.21 0.20 -0.14 3.92 -4.23 -0.08 -5.01 115.64 110.51 2ck0 s THR 157 Ca -0.08 -1.65 0.01 0.00 -1.18 0.00 0.00 61.69 58.78 2ck0 s THR 157 Cb -0.15 -1.34 -0.01 0.00 1.34 0.00 0.00 72.50 72.34 2ck0 s THR 157 CO 0.05 -0.91 -0.15 0.26 -0.54 0.00 0.00 174.62 173.33 2ck0 s TRP 158 N -3.57 2.77 -1.45 3.99 0.52 -1.26 -0.34 118.94 119.60 2ck0 s TRP 158 Ca 0.04 -0.89 -0.09 0.00 0.02 0.00 0.00 56.10 55.18 2ck0 s TRP 158 Cb 0.05 -1.85 0.03 0.00 -1.15 0.00 0.00 33.47 30.55 2ck0 s TRP 158 CO -0.09 -0.37 0.93 0.09 0.02 0.00 0.00 176.95 177.53 2ck0 n ASN 159 N 3.80 -5.80 0.00 2.95 3.02 -0.34 -1.82 115.26 117.07 2ck0 n ASN 159 Ca -0.19 -0.51 0.00 0.00 -0.03 0.00 0.00 54.58 53.86 2ck0 n ASN 159 Cb 0.52 -4.62 0.00 0.00 -0.61 0.00 0.00 39.78 35.07 2ck0 n ASN 159 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2ck0 n SER 160 N -2.78 0.00 0.00 6.41 7.64 -1.26 -2.39 113.62 121.24 2ck0 n SER 160 Ca -0.02 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.86 2ck0 n SER 160 Cb 0.57 -1.04 0.00 0.00 -1.01 0.00 0.00 64.21 62.73 2ck0 n SER 160 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ck0 n GLY 161 N -1.94 0.63 0.30 0.23 0.00 -0.76 -5.00 105.19 98.65 2ck0 n GLY 161 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 2ck0 n GLY 161 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ck0 h SER 162 N 0.26 0.00 -3.38 1.61 4.64 -1.51 -3.33 113.55 111.84 2ck0 h SER 162 Ca 0.00 0.00 -0.74 0.00 -0.47 0.00 0.00 61.79 60.58 2ck0 h SER 162 Cb 0.00 0.00 -0.28 0.00 -0.31 0.00 0.00 62.40 61.81 2ck0 h SER 162 CO 0.00 0.00 -0.28 -0.76 -0.87 0.00 0.00 176.83 174.92 2ck0 s LEU 163 N -8.19 5.94 -0.01 5.97 1.43 -1.00 -4.78 118.68 118.05 2ck0 s LEU 163 Ca -0.05 -2.07 0.01 0.00 -1.03 0.00 0.00 54.13 50.99 2ck0 s LEU 163 Cb 0.16 -2.08 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 2ck0 s LEU 163 CO 0.60 -0.69 0.01 -1.20 0.23 0.00 0.00 176.35 175.29 2ck0 n SER 164 N 4.75 4.72 -4.83 2.29 7.64 -1.25 -3.99 113.62 122.95 2ck0 n SER 164 Ca -0.05 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.47 2ck0 n SER 164 Cb 0.41 0.57 -0.06 0.00 -1.01 0.00 0.00 64.21 64.13 2ck0 n SER 164 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ck0 s SER 165 N -3.05 6.96 0.00 6.43 0.01 -1.26 -3.83 113.70 118.95 2ck0 s SER 165 Ca -0.01 1.23 0.00 0.00 1.31 0.00 0.00 55.95 58.49 2ck0 s SER 165 Cb 0.00 -2.35 0.00 0.00 0.21 0.00 0.00 66.02 63.89 2ck0 s SER 165 CO 0.05 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.43 2ck0 n GLY 166 N 0.98 0.83 3.87 3.44 0.00 -1.26 -4.70 105.19 108.35 2ck0 n GLY 166 Ca -0.05 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.62 2ck0 n GLY 166 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2ck0 s VAL 167 N -3.28 5.12 -0.14 1.61 1.01 -1.25 -2.20 120.40 121.27 2ck0 s VAL 167 Ca 0.00 0.40 -0.04 0.00 0.00 0.00 0.00 61.98 62.34 2ck0 s VAL 167 Cb 0.00 -3.63 0.06 0.00 0.00 0.00 0.00 36.38 32.81 2ck0 s VAL 167 CO 0.00 0.29 0.13 -1.00 0.00 0.00 0.00 175.10 174.52 2ck0 s HIS 168 N -1.40 -0.01 -0.32 5.22 3.76 -0.34 -4.98 115.29 117.22 2ck0 s HIS 168 Ca 0.33 0.07 -0.07 0.00 -0.15 0.00 0.00 55.06 55.24 2ck0 s HIS 168 Cb -0.14 -0.50 0.02 0.00 1.11 0.00 0.00 32.58 33.07 2ck0 s HIS 168 CO 0.18 -0.44 0.11 0.99 -0.85 0.00 0.00 174.74 174.72 2ck0 s THR 169 N 2.22 4.00 0.25 1.30 2.01 -1.26 -1.13 115.64 123.04 2ck0 s THR 169 Ca 0.04 -0.84 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 2ck0 s THR 169 Cb -0.15 -3.15 -0.09 0.00 0.01 0.00 0.00 72.50 69.12 2ck0 s THR 169 CO -0.08 -0.04 0.96 -0.36 -0.69 0.00 0.00 174.62 174.41 2ck0 s PHE 170 N 1.48 3.91 0.39 4.92 0.08 -0.80 -4.99 117.98 122.97 2ck0 s PHE 170 Ca 0.01 1.88 -0.26 0.00 0.12 0.00 0.00 56.93 58.69 2ck0 s PHE 170 Cb -0.18 -3.01 -0.11 0.00 -0.57 0.00 0.00 43.02 39.15 2ck0 s PHE 170 CO 0.03 0.31 1.14 -0.35 -0.10 0.00 0.00 175.22 176.25 2ck0 n PRO 171 N 1.37 1.65 -1.64 0.24 -0.04 -1.26 -4.36 135.00 130.97 2ck0 n PRO 171 Ca -0.02 0.59 -0.35 0.00 -0.04 0.00 0.00 63.50 63.68 2ck0 n PRO 171 Cb 0.47 -2.17 0.07 0.00 -0.04 0.00 0.00 33.50 31.83 2ck0 n PRO 171 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ck0 s ALA 172 N -1.20 2.29 -0.08 0.55 0.00 -1.26 -4.85 121.76 117.21 2ck0 s ALA 172 Ca 0.61 0.88 0.03 0.00 0.00 0.00 0.00 51.96 53.48 2ck0 s ALA 172 Cb -0.56 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.12 2ck0 s ALA 172 CO 0.58 -1.60 -0.18 0.08 0.00 0.00 0.00 175.76 174.64 2ck0 s VAL 173 N -1.91 1.59 0.12 0.00 1.01 -0.51 -4.95 120.40 115.76 2ck0 s VAL 173 Ca 0.74 -0.75 -0.28 0.00 0.00 0.00 0.00 61.98 61.69 2ck0 s VAL 173 Cb -0.29 -1.40 -0.07 0.00 0.00 0.00 0.00 36.38 34.63 2ck0 s VAL 173 CO 0.41 0.46 0.88 -0.22 0.00 0.00 0.00 175.10 176.63 2ck0 s LEU 174 N 0.42 4.53 -0.27 3.92 2.96 -1.26 -2.03 118.68 126.95 2ck0 s LEU 174 Ca -0.15 1.70 -0.07 0.00 -0.22 0.00 0.00 54.13 55.39 2ck0 s LEU 174 Cb -0.16 -3.45 0.13 0.00 0.50 0.00 0.00 46.19 43.20 2ck0 s LEU 174 CO 0.06 0.04 0.56 -1.58 -1.32 0.00 0.00 176.35 174.10 2ck0 s GLN 175 N -0.38 0.49 -1.15 1.98 2.00 0.78 -4.97 119.66 118.41 2ck0 s GLN 175 Ca 0.42 1.22 -0.17 0.00 -2.00 0.00 0.00 55.36 54.83 2ck0 s GLN 175 Cb -0.23 0.59 -0.02 0.00 0.80 0.00 0.00 33.01 34.16 2ck0 s GLN 175 CO 0.28 -0.30 0.79 0.43 -0.50 0.00 0.00 175.29 175.99 2ck0 n SER 176 N 5.42 -5.02 0.00 6.67 7.64 -1.26 -1.45 113.62 125.62 2ck0 n SER 176 Ca -0.09 -0.97 0.00 0.00 1.01 0.00 0.00 58.87 58.82 2ck0 n SER 176 Cb 0.49 -3.62 0.00 0.00 -1.01 0.00 0.00 64.21 60.08 2ck0 n SER 176 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 2ck0 n ASP 177 N -2.77 0.00 -4.35 6.43 9.92 -1.26 -4.94 116.55 119.57 2ck0 n ASP 177 Ca -0.11 0.00 -0.24 0.00 -0.53 0.00 0.00 54.79 53.91 2ck0 n ASP 177 Cb 0.60 -1.26 -0.12 0.00 -0.64 0.00 0.00 41.12 39.70 2ck0 n ASP 177 CO 0.00 0.00 0.00 -0.76 0.13 0.00 0.00 177.20 176.57 2ck0 s LEU 178 N 0.00 2.39 0.11 0.64 2.01 -0.53 -4.89 118.68 118.41 2ck0 s LEU 178 Ca 0.00 -0.80 -0.02 0.00 0.01 0.00 0.00 54.13 53.31 2ck0 s LEU 178 Cb 0.00 -0.96 -0.05 0.00 0.01 0.00 0.00 46.19 45.19 2ck0 s LEU 178 CO 0.00 0.05 0.30 -0.31 1.01 0.00 0.00 176.35 177.40 2ck0 s TYR 179 N -1.62 3.50 -0.02 0.29 2.02 -0.32 -0.16 117.35 121.05 2ck0 s TYR 179 Ca 0.14 0.38 0.01 0.00 -0.37 0.00 0.00 57.07 57.24 2ck0 s TYR 179 Cb -0.08 -1.87 0.01 0.00 -0.40 0.00 0.00 41.96 39.62 2ck0 s TYR 179 CO 0.07 0.50 -0.03 0.99 -1.57 0.00 0.00 175.55 175.50 2ck0 s THR 180 N -1.61 0.35 -0.00 -0.71 2.01 -0.86 0.31 115.64 115.13 2ck0 s THR 180 Ca 0.38 -0.12 -0.06 0.00 0.31 0.00 0.00 61.69 62.20 2ck0 s THR 180 Cb -0.12 -0.35 -0.00 0.00 0.01 0.00 0.00 72.50 72.04 2ck0 s THR 180 CO 0.27 0.13 0.11 -0.22 -0.69 0.00 0.00 174.62 174.22 2ck0 s LEU 181 N 0.34 1.66 0.12 4.42 0.20 0.17 -1.42 118.68 124.17 2ck0 s LEU 181 Ca -0.04 -0.18 0.05 0.00 0.69 0.00 0.00 54.13 54.65 2ck0 s LEU 181 Cb -0.07 0.55 -0.04 0.00 -0.43 0.00 0.00 46.19 46.20 2ck0 s LEU 181 CO -0.00 -0.31 -0.12 -0.94 -0.29 0.00 0.00 176.35 174.68 2ck0 s SER 182 N -1.18 1.81 -0.07 3.68 1.04 -1.26 -0.29 113.70 117.43 2ck0 s SER 182 Ca -0.13 -0.86 -0.03 0.00 0.48 0.00 0.00 55.95 55.42 2ck0 s SER 182 Cb -0.07 -0.04 0.04 0.00 0.10 0.00 0.00 66.02 66.05 2ck0 s SER 182 CO 0.01 -0.22 0.15 -0.55 0.98 0.00 0.00 173.24 173.61 2ck0 s SER 183 N -2.62 -0.11 0.12 7.02 0.15 -0.76 -1.91 113.70 115.59 2ck0 s SER 183 Ca 0.10 0.31 0.10 0.00 0.70 0.00 0.00 55.95 57.15 2ck0 s SER 183 Cb -0.03 0.20 -0.04 0.00 -1.71 0.00 0.00 66.02 64.44 2ck0 s SER 183 CO 0.02 -0.15 -0.20 -0.94 1.20 0.00 0.00 173.24 173.16 2ck0 s SER 184 N 1.19 3.74 -0.00 5.45 1.04 -0.28 -0.45 113.70 124.39 2ck0 s SER 184 Ca -0.09 -0.61 0.01 0.00 0.48 0.00 0.00 55.95 55.73 2ck0 s SER 184 Cb -0.12 -0.46 0.00 0.00 0.10 0.00 0.00 66.02 65.55 2ck0 s SER 184 CO -0.06 0.18 -0.02 0.54 0.98 0.00 0.00 173.24 174.86 2ck0 s VAL 185 N -1.13 0.18 -0.21 5.02 0.11 0.38 -1.20 120.40 123.55 2ck0 s VAL 185 Ca 0.17 -0.07 -0.00 0.00 -2.93 0.00 0.00 61.98 59.14 2ck0 s VAL 185 Cb -0.10 -0.17 0.02 0.00 -1.53 0.00 0.00 36.38 34.60 2ck0 s VAL 185 CO 0.09 0.06 -0.13 -0.89 -3.33 0.00 0.00 175.10 170.91 2ck0 s THR 186 N 0.08 2.52 0.14 5.04 2.01 -0.93 -1.01 115.64 123.48 2ck0 s THR 186 Ca -0.00 -0.96 0.09 0.00 0.31 0.00 0.00 61.69 61.12 2ck0 s THR 186 Cb -0.02 -2.18 -0.04 0.00 0.01 0.00 0.00 72.50 70.26 2ck0 s THR 186 CO -0.00 0.36 -0.20 0.68 -0.69 0.00 0.00 174.62 174.77 2ck0 s VAL 187 N 1.31 1.83 0.57 3.82 -7.23 -1.12 -4.74 120.40 114.85 2ck0 s VAL 187 Ca 0.02 -1.78 -0.21 0.00 -1.81 0.00 0.00 61.98 58.21 2ck0 s VAL 187 Cb -0.15 -1.76 -0.04 0.00 0.56 0.00 0.00 36.38 34.98 2ck0 s VAL 187 CO -0.08 -0.19 1.27 -2.65 -0.31 0.00 0.00 175.10 173.14 2ck0 n PRO 188 N 0.60 1.43 -0.13 4.82 -0.02 -1.26 -0.40 135.00 140.04 2ck0 n PRO 188 Ca -0.16 0.53 0.27 0.00 -2.02 0.00 0.00 63.50 62.13 2ck0 n PRO 188 Cb 0.56 -2.49 0.72 0.00 -0.02 0.00 0.00 33.50 32.27 2ck0 n PRO 188 CO 0.00 0.00 0.00 0.77 1.98 0.00 0.00 175.50 178.25 2ck0 h SER 189 N 1.09 0.00 0.68 2.55 0.02 -1.90 -2.95 113.55 113.04 2ck0 h SER 189 Ca -0.50 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.41 2ck0 h SER 189 Cb 1.32 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.87 2ck0 h SER 189 CO 0.55 0.00 -0.33 0.28 -1.14 0.00 0.00 176.83 176.20 2ck0 h SER 190 N 0.00 -0.77 0.00 3.07 0.02 -2.01 -3.32 113.55 110.54 2ck0 h SER 190 Ca 0.38 0.03 0.00 0.00 -0.84 0.00 0.00 61.79 61.36 2ck0 h SER 190 Cb 1.63 0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.37 2ck0 h SER 190 CO -0.00 -0.41 0.00 -0.81 -1.14 0.00 0.00 176.83 174.46 2ck0 n PRO 191 N -5.22 0.41 -3.54 3.45 -0.04 -1.11 -4.17 135.00 124.78 2ck0 n PRO 191 Ca -0.11 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 2ck0 n PRO 191 Cb 0.36 -1.29 -0.06 0.00 -0.04 0.00 0.00 33.50 32.47 2ck0 n PRO 191 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2ck0 s ARG 192 N 1.04 0.23 -0.02 0.54 1.81 -1.25 -3.29 118.95 118.02 2ck0 s ARG 192 Ca 0.00 0.46 0.03 0.00 -1.72 0.00 0.00 55.73 54.50 2ck0 s ARG 192 Cb 0.00 0.14 0.11 0.00 -0.45 0.00 0.00 34.95 34.75 2ck0 s ARG 192 CO 0.00 -0.06 0.90 -2.30 -0.68 0.00 0.00 175.30 173.16 2ck0 n PRO 193 N 3.93 1.43 -0.14 3.54 -0.02 -1.26 -4.89 135.00 137.59 2ck0 n PRO 193 Ca -0.15 -0.45 -0.10 0.00 -2.02 0.00 0.00 63.50 60.79 2ck0 n PRO 193 Cb 0.56 -1.34 -0.01 0.00 -0.02 0.00 0.00 33.50 32.68 2ck0 n PRO 193 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2ck0 h SER 194 N 0.65 0.67 -3.34 2.55 4.64 -1.78 -3.41 113.55 113.52 2ck0 h SER 194 Ca 0.00 -0.28 -0.63 0.00 -0.47 0.00 0.00 61.79 60.41 2ck0 h SER 194 Cb 0.43 -0.18 -0.19 0.00 -0.31 0.00 0.00 62.40 62.15 2ck0 h SER 194 CO 0.04 0.78 -0.61 -1.61 -0.87 0.00 0.00 176.83 174.56 2ck0 s GLU 195 N -5.11 3.81 0.28 4.77 8.01 -1.21 -5.06 118.70 124.19 2ck0 s GLU 195 Ca -0.13 -0.43 -0.30 0.00 0.01 0.00 0.00 54.97 54.11 2ck0 s GLU 195 Cb 0.10 -3.11 -0.11 0.00 -4.31 0.00 0.00 34.13 26.70 2ck0 s GLU 195 CO 0.79 0.20 1.61 0.99 0.01 0.00 0.00 175.26 178.85 2ck0 s THR 196 N 0.54 2.07 -0.15 3.63 2.01 -1.26 -4.30 115.64 118.19 2ck0 s THR 196 Ca 0.01 0.06 0.01 0.00 0.31 0.00 0.00 61.69 62.08 2ck0 s THR 196 Cb -0.13 -3.04 0.02 0.00 0.01 0.00 0.00 72.50 69.35 2ck0 s THR 196 CO 0.02 0.01 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.09 2ck0 s VAL 197 N 0.18 1.82 0.07 3.82 1.01 -1.26 -5.01 120.40 121.03 2ck0 s VAL 197 Ca 0.65 -0.81 0.09 0.00 0.00 0.00 0.00 61.98 61.91 2ck0 s VAL 197 Cb -0.48 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.22 2ck0 s VAL 197 CO 0.45 0.50 -0.25 -0.89 0.00 0.00 0.00 175.10 174.91 2ck0 s THR 198 N 1.14 2.07 -0.28 3.92 2.01 -1.26 -0.99 115.64 122.24 2ck0 s THR 198 Ca -0.01 -1.48 -0.08 0.00 0.31 0.00 0.00 61.69 60.43 2ck0 s THR 198 Cb -0.14 -1.80 -0.02 0.00 0.01 0.00 0.00 72.50 70.55 2ck0 s THR 198 CO -0.07 0.23 0.11 0.00 -0.69 0.00 0.00 174.62 174.20 2ck0 s ASN 200 N 1.62 5.35 -0.02 0.00 -0.87 0.54 0.56 114.94 122.12 2ck0 s ASN 200 Ca 0.05 -0.10 0.05 0.00 -1.57 0.00 0.00 52.86 51.30 2ck0 s ASN 200 Cb -0.16 -1.95 -0.01 0.00 -0.02 0.00 0.00 41.25 39.11 2ck0 s ASN 200 CO 0.05 0.03 -0.17 -0.69 -2.57 0.00 0.00 177.10 173.76 2ck0 s VAL 201 N 1.21 1.36 -0.03 1.60 1.01 -0.40 -0.91 120.40 124.24 2ck0 s VAL 201 Ca 0.05 -0.73 0.00 0.00 0.00 0.00 0.00 61.98 61.30 2ck0 s VAL 201 Cb -0.14 -1.14 0.03 0.00 0.00 0.00 0.00 36.38 35.13 2ck0 s VAL 201 CO 0.04 0.39 0.02 0.00 0.00 0.00 0.00 175.10 175.54 2ck0 s ALA 202 N -0.33 0.22 -0.48 5.51 0.00 -0.38 -1.01 121.76 125.29 2ck0 s ALA 202 Ca 0.05 0.22 0.03 0.00 0.00 0.00 0.00 51.96 52.26 2ck0 s ALA 202 Cb -0.07 -0.31 0.13 0.00 0.00 0.00 0.00 23.12 22.86 2ck0 s ALA 202 CO -0.00 -0.12 0.23 -1.58 0.00 0.00 0.00 175.76 174.30 2ck0 s HIS 203 N 1.12 2.81 0.25 0.00 2.46 -0.66 -0.71 115.29 120.56 2ck0 s HIS 203 Ca -0.08 -2.90 -0.06 0.00 0.47 0.00 0.00 55.06 52.49 2ck0 s HIS 203 Cb -0.13 -2.51 0.47 0.00 -0.13 0.00 0.00 32.58 30.27 2ck0 s HIS 203 CO -0.02 -0.77 1.64 -1.00 -2.47 0.00 0.00 174.74 172.11 2ck0 h PRO 204 N 6.68 0.11 0.00 2.88 0.13 -1.81 -1.80 132.00 138.19 2ck0 h PRO 204 Ca -0.06 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2ck0 h PRO 204 Cb 0.91 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2ck0 h PRO 204 CO 0.61 0.07 0.26 0.00 -0.23 0.00 0.00 178.00 178.71 2ck0 n ALA 205 N -2.92 0.60 -2.27 -0.56 0.00 -1.26 -0.63 120.51 113.46 2ck0 n ALA 205 Ca 0.14 0.06 0.01 0.00 0.00 0.00 0.00 53.44 53.66 2ck0 n ALA 205 Cb 0.50 -0.67 0.00 0.00 0.00 0.00 0.00 19.45 19.28 2ck0 n ALA 205 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2ck0 n SER 206 N -1.65 0.45 -4.24 0.00 3.41 -0.71 -4.95 113.62 105.93 2ck0 n SER 206 Ca -0.00 -1.95 -0.33 0.00 -0.26 0.00 0.00 58.87 56.33 2ck0 n SER 206 Cb 0.27 -0.19 -0.09 0.00 -0.26 0.00 0.00 64.21 63.94 2ck0 n SER 206 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2ck0 n SER 207 N 0.27 -0.14 -4.88 4.04 3.41 0.20 -4.91 113.62 111.60 2ck0 n SER 207 Ca 0.01 -1.17 -0.35 0.00 -0.26 0.00 0.00 58.87 57.09 2ck0 n SER 207 Cb 0.94 -1.48 -0.05 0.00 -0.26 0.00 0.00 64.21 63.35 2ck0 n SER 207 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 2ck0 s THR 208 N -3.81 5.36 -0.24 6.66 2.01 -1.01 -4.98 115.64 119.62 2ck0 s THR 208 Ca 0.31 0.17 -0.07 0.00 0.31 0.00 0.00 61.69 62.40 2ck0 s THR 208 Cb -0.18 -3.53 0.11 0.00 0.01 0.00 0.00 72.50 68.91 2ck0 s THR 208 CO 0.94 0.43 0.51 -0.75 -0.69 0.00 0.00 174.62 175.06 2ck0 s LYS 209 N -1.57 0.43 -0.05 4.92 2.47 -1.26 -1.65 119.74 123.03 2ck0 s LYS 209 Ca 0.24 1.15 0.02 0.00 -1.56 0.00 0.00 55.97 55.83 2ck0 s LYS 209 Cb -0.13 0.49 0.01 0.00 -1.46 0.00 0.00 37.83 36.74 2ck0 s LYS 209 CO 0.13 -0.28 -0.11 0.08 0.16 0.00 0.00 175.35 175.34 2ck0 s VAL 210 N 2.72 1.02 -0.54 4.02 1.01 -0.18 -4.98 120.40 123.47 2ck0 s VAL 210 Ca -0.01 -0.43 -0.11 0.00 0.00 0.00 0.00 61.98 61.43 2ck0 s VAL 210 Cb -0.12 -0.93 0.14 0.00 0.00 0.00 0.00 36.38 35.46 2ck0 s VAL 210 CO -0.16 0.32 0.44 -1.81 0.00 0.00 0.00 175.10 173.90 2ck0 s ASP 211 N 0.55 5.91 -0.57 3.32 1.01 -1.26 -1.27 116.67 124.36 2ck0 s ASP 211 Ca -0.11 -2.05 -0.17 0.00 0.71 0.00 0.00 52.55 50.92 2ck0 s ASP 211 Cb -0.14 -2.07 0.12 0.00 1.01 0.00 0.00 42.92 41.84 2ck0 s ASP 211 CO 0.03 -0.70 0.61 -0.75 0.21 0.00 0.00 175.17 174.57 2ck0 s LYS 212 N 1.17 3.02 -0.06 8.23 2.47 0.19 -4.86 119.74 129.90 2ck0 s LYS 212 Ca 0.07 -1.52 -0.30 0.00 -1.56 0.00 0.00 55.97 52.66 2ck0 s LYS 212 Cb -0.25 -4.29 -0.04 0.00 -1.46 0.00 0.00 37.83 31.79 2ck0 s LYS 212 CO -0.01 -1.44 1.42 0.21 0.16 0.00 0.00 175.35 175.69 2ck0 s LYS 213 N 2.14 4.24 -0.86 4.03 2.20 -1.26 -0.23 119.74 130.00 2ck0 s LYS 213 Ca 0.08 1.92 -0.25 0.00 -0.36 0.00 0.00 55.97 57.36 2ck0 s LYS 213 Cb -0.27 -3.74 0.02 0.00 -1.51 0.00 0.00 37.83 32.33 2ck0 s LYS 213 CO 0.04 -0.68 1.53 0.42 -0.36 0.00 0.00 175.35 176.30 2ck0 s ILE 214 N 3.14 3.71 -0.03 5.43 -1.09 -0.16 -4.95 121.20 127.24 2ck0 s ILE 214 Ca 0.63 -0.19 -0.00 0.00 -2.23 0.00 0.00 60.65 58.86 2ck0 s ILE 214 Cb -0.29 -4.70 -0.04 0.00 -1.58 0.00 0.00 42.46 35.85 2ck0 s ILE 214 CO 0.24 -1.62 0.03 0.54 -1.23 0.00 0.00 174.94 172.89 2ck0 s VAL 215 N 6.56 4.42 0.00 2.92 0.11 -1.26 -4.64 120.40 128.51 2ck0 s VAL 215 Ca 0.49 -0.41 0.00 0.00 -2.93 0.00 0.00 61.98 59.13 2ck0 s VAL 215 Cb -0.05 -2.95 0.00 0.00 -1.53 0.00 0.00 36.38 31.84 2ck0 s VAL 215 CO 0.04 0.44 0.00 -3.20 -3.33 0.00 0.00 175.10 169.05