#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3kj6 s ILE 2 N 0.00 -0.37 0.52 0.53 2.07 -1.26 -5.01 121.20 117.69 3kj6 s ILE 2 Ca 0.00 -1.29 -0.21 0.00 -1.41 0.00 0.00 60.65 57.74 3kj6 s ILE 2 Cb 0.00 -0.61 -0.07 0.00 0.13 0.00 0.00 42.46 41.91 3kj6 s ILE 2 CO 0.00 -0.57 1.06 0.29 -1.91 0.00 0.00 174.94 173.81 3kj6 n LYS 3 N 3.68 1.24 -3.47 3.50 4.76 -1.26 -4.77 118.16 121.84 3kj6 n LYS 3 Ca 0.17 0.46 -0.24 0.00 -2.87 0.00 0.00 58.31 55.83 3kj6 n LYS 3 Cb 0.49 -2.20 -0.12 0.00 -1.84 0.00 0.00 35.03 31.35 3kj6 n LYS 3 CO 0.00 0.00 0.00 -1.64 -1.37 0.00 0.00 177.40 174.39 3kj6 s MET 4 N -2.49 0.30 0.90 1.97 -1.94 -1.26 -1.37 119.30 115.41 3kj6 s MET 4 Ca 0.70 -0.51 -0.12 0.00 -1.71 0.00 0.00 55.69 54.05 3kj6 s MET 4 Cb -0.47 -0.97 0.13 0.00 2.01 0.00 0.00 34.83 35.53 3kj6 s MET 4 CO 0.51 -1.06 1.12 -0.08 -0.01 0.00 0.00 175.02 175.51 3kj6 s THR 5 N 2.03 2.26 -0.49 2.05 -1.32 -0.78 -4.04 115.64 115.35 3kj6 s THR 5 Ca 0.11 0.09 0.07 0.00 -1.21 0.00 0.00 61.69 60.74 3kj6 s THR 5 Cb -0.16 -2.78 0.19 0.00 -1.51 0.00 0.00 72.50 68.24 3kj6 s THR 5 CO -0.29 -0.11 0.73 -1.58 -2.21 0.00 0.00 174.62 171.15 3kj6 s GLN 6 N -5.19 1.00 0.12 7.08 0.74 -1.26 -2.67 119.66 119.48 3kj6 s GLN 6 Ca 0.63 -0.89 -0.13 0.00 0.05 0.00 0.00 55.36 55.03 3kj6 s GLN 6 Cb -0.15 -0.02 -0.07 0.00 1.10 0.00 0.00 33.01 33.87 3kj6 s GLN 6 CO 0.54 -1.26 0.50 0.45 -0.55 0.00 0.00 175.29 174.97 3kj6 s SER 7 N 1.06 6.76 1.00 6.67 0.15 -1.02 -4.36 113.70 123.97 3kj6 s SER 7 Ca 0.27 0.98 -0.04 0.00 0.70 0.00 0.00 55.95 57.86 3kj6 s SER 7 Cb -0.00 -2.25 0.05 0.00 -1.71 0.00 0.00 66.02 62.11 3kj6 s SER 7 CO -0.06 0.13 0.31 -0.81 1.20 0.00 0.00 173.24 174.01 3kj6 n PRO 8 N 0.85 -0.33 -0.09 5.44 -0.04 -1.26 -1.18 135.00 138.39 3kj6 n PRO 8 Ca -0.06 -0.48 -0.14 0.00 -0.04 0.00 0.00 63.50 62.78 3kj6 n PRO 8 Cb 0.52 -0.32 -0.08 0.00 -0.04 0.00 0.00 33.50 33.58 3kj6 n PRO 8 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 3kj6 n SER 9 N -3.21 2.35 -4.35 3.54 2.88 -1.26 -4.33 113.62 109.23 3kj6 n SER 9 Ca 0.04 -0.04 -0.22 0.00 -1.33 0.00 0.00 58.87 57.33 3kj6 n SER 9 Cb 0.13 -0.35 -0.11 0.00 -0.75 0.00 0.00 64.21 63.14 3kj6 n SER 9 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 3kj6 s SER 10 N -5.98 2.78 -0.30 -3.46 0.01 -1.26 -1.13 113.70 104.36 3kj6 s SER 10 Ca -0.26 -0.91 -0.13 0.00 1.31 0.00 0.00 55.95 55.96 3kj6 s SER 10 Cb 0.07 -0.17 0.15 0.00 0.21 0.00 0.00 66.02 66.28 3kj6 s SER 10 CO 0.41 -0.05 0.87 -0.32 0.41 0.00 0.00 173.24 174.56 3kj6 s MET 11 N -3.02 0.40 -0.29 12.44 0.00 -0.40 -4.88 119.30 123.54 3kj6 s MET 11 Ca 0.19 0.99 -0.07 0.00 0.00 0.00 0.00 55.69 56.80 3kj6 s MET 11 Cb -0.05 0.59 -0.00 0.00 0.00 0.00 0.00 34.83 35.37 3kj6 s MET 11 CO 0.08 -0.14 0.09 0.71 0.00 0.00 0.00 175.02 175.76 3kj6 s TYR 12 N 2.59 3.14 0.27 4.11 1.51 -1.26 0.57 117.35 128.28 3kj6 s TYR 12 Ca -0.04 -0.81 0.06 0.00 -1.01 0.00 0.00 57.07 55.27 3kj6 s TYR 12 Cb -0.08 -2.27 -0.06 0.00 -0.11 0.00 0.00 41.96 39.45 3kj6 s TYR 12 CO -0.18 -0.52 -0.05 0.00 -1.11 0.00 0.00 175.55 173.69 3kj6 s ALA 13 N 1.54 2.23 0.13 3.71 0.00 0.29 -4.79 121.76 124.87 3kj6 s ALA 13 Ca 0.04 -1.87 0.07 0.00 0.00 0.00 0.00 51.96 50.20 3kj6 s ALA 13 Cb -0.17 0.23 -0.04 0.00 0.00 0.00 0.00 23.12 23.14 3kj6 s ALA 13 CO 0.03 -0.10 -0.06 -1.54 0.00 0.00 0.00 175.76 174.09 3kj6 s SER 14 N -3.41 4.54 0.13 0.00 1.04 -1.26 -0.39 113.70 114.35 3kj6 s SER 14 Ca 0.29 -0.39 -0.34 0.00 0.48 0.00 0.00 55.95 55.99 3kj6 s SER 14 Cb 0.04 -0.91 -0.17 0.00 0.10 0.00 0.00 66.02 65.08 3kj6 s SER 14 CO 0.11 0.15 1.10 0.18 0.98 0.00 0.00 173.24 175.75 3kj6 n LEU 15 N 0.40 0.94 0.00 2.42 4.32 -1.26 -2.19 117.00 121.64 3kj6 n LEU 15 Ca -0.12 1.14 0.00 0.00 -0.02 0.00 0.00 56.01 57.01 3kj6 n LEU 15 Cb 0.53 -1.13 0.00 0.00 -1.62 0.00 0.00 43.42 41.21 3kj6 n LEU 15 CO 0.35 -1.57 0.00 0.61 -1.22 0.00 0.00 177.39 175.56 3kj6 n GLY 16 N 1.98 2.97 3.84 -0.72 0.00 -0.16 -4.87 105.19 108.22 3kj6 n GLY 16 Ca 0.17 -0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 3kj6 n GLY 16 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3kj6 s GLU 17 N 0.00 4.07 -0.30 1.61 0.41 -0.93 -3.43 118.70 120.14 3kj6 s GLU 17 Ca 0.00 0.88 -0.22 0.00 -0.41 0.00 0.00 54.97 55.22 3kj6 s GLU 17 Cb 0.00 -2.28 -0.01 0.00 -1.78 0.00 0.00 34.13 30.07 3kj6 s GLU 17 CO 0.00 -0.01 0.70 -0.98 -0.49 0.00 0.00 175.26 174.49 3kj6 s ARG 18 N -3.32 3.97 0.10 1.61 1.70 -1.26 -1.62 118.95 120.13 3kj6 s ARG 18 Ca 0.58 0.48 -0.16 0.00 -0.47 0.00 0.00 55.73 56.15 3kj6 s ARG 18 Cb -0.10 -3.71 -0.07 0.00 -0.57 0.00 0.00 34.95 30.50 3kj6 s ARG 18 CO 0.19 -0.59 0.54 0.54 -1.08 0.00 0.00 175.30 174.91 3kj6 s VAL 19 N 2.74 4.82 -0.06 4.99 0.11 -1.09 -4.94 120.40 126.97 3kj6 s VAL 19 Ca 0.29 1.00 0.01 0.00 -2.93 0.00 0.00 61.98 60.34 3kj6 s VAL 19 Cb -0.15 -3.80 0.02 0.00 -1.53 0.00 0.00 36.38 30.92 3kj6 s VAL 19 CO 0.11 0.41 -0.05 -0.89 -3.33 0.00 0.00 175.10 171.35 3kj6 s THR 20 N -1.28 0.66 -0.06 5.04 2.01 -1.26 -1.35 115.64 119.41 3kj6 s THR 20 Ca 0.33 -0.15 0.05 0.00 0.31 0.00 0.00 61.69 62.23 3kj6 s THR 20 Cb -0.17 -0.70 -0.01 0.00 0.01 0.00 0.00 72.50 71.64 3kj6 s THR 20 CO 0.18 0.27 -0.23 0.27 -0.69 0.00 0.00 174.62 174.42 3kj6 s ILE 21 N 1.18 1.93 0.07 1.82 -4.36 -0.28 -4.82 121.20 116.75 3kj6 s ILE 21 Ca -0.07 -0.99 0.03 0.00 -0.26 0.00 0.00 60.65 59.37 3kj6 s ILE 21 Cb -0.14 -1.64 -0.04 0.00 1.25 0.00 0.00 42.46 41.89 3kj6 s ILE 21 CO -0.01 0.54 0.06 0.28 0.24 0.00 0.00 174.94 176.04 3kj6 s THR 22 N -0.04 4.42 -0.16 8.37 -1.32 -0.32 -0.33 115.64 126.25 3kj6 s THR 22 Ca -0.06 -0.79 -0.05 0.00 -1.21 0.00 0.00 61.69 59.59 3kj6 s THR 22 Cb -0.14 -3.11 0.06 0.00 -1.51 0.00 0.00 72.50 67.80 3kj6 s THR 22 CO 0.04 0.15 0.10 0.00 -2.21 0.00 0.00 174.62 172.70 3kj6 s LYS 24 N 2.16 2.89 0.21 0.00 1.02 -1.09 -1.28 119.74 123.65 3kj6 s LYS 24 Ca 0.03 -0.57 0.06 0.00 0.02 0.00 0.00 55.97 55.50 3kj6 s LYS 24 Cb -0.16 -2.61 -0.04 0.00 -0.52 0.00 0.00 37.83 34.50 3kj6 s LYS 24 CO -0.09 0.57 0.21 0.00 -0.92 0.00 0.00 175.35 175.12 3kj6 s ALA 25 N -0.56 3.67 0.02 5.17 0.00 0.02 -1.87 121.76 128.21 3kj6 s ALA 25 Ca 0.08 -1.28 -0.19 0.00 0.00 0.00 0.00 51.96 50.57 3kj6 s ALA 25 Cb -0.12 -1.44 -0.20 0.00 0.00 0.00 0.00 23.12 21.37 3kj6 s ALA 25 CO 0.02 0.37 1.18 0.66 0.00 0.00 0.00 175.76 177.98 3kj6 h SER 26 N 1.82 0.52 -2.63 0.00 4.64 -1.52 -3.46 113.55 112.92 3kj6 h SER 26 Ca -0.49 -0.68 -0.46 0.00 -0.47 0.00 0.00 61.79 59.69 3kj6 h SER 26 Cb 1.22 -0.16 0.11 0.00 -0.31 0.00 0.00 62.40 63.26 3kj6 h SER 26 CO 0.62 1.12 0.21 -1.58 -0.87 0.00 0.00 176.83 176.33 3kj6 s GLN 27 N -3.54 1.27 -0.69 4.77 2.00 -1.26 -5.04 119.66 117.17 3kj6 s GLN 27 Ca -0.13 -0.96 -0.10 0.00 -2.00 0.00 0.00 55.36 52.17 3kj6 s GLN 27 Cb 0.04 -2.18 0.18 0.00 0.80 0.00 0.00 33.01 31.86 3kj6 s GLN 27 CO 0.81 -1.81 0.58 0.34 -0.50 0.00 0.00 175.29 174.72 3kj6 s ASP 28 N -4.81 6.09 0.36 6.67 3.68 -1.26 -4.65 116.67 122.75 3kj6 s ASP 28 Ca 0.70 -2.55 -0.26 0.00 2.13 0.00 0.00 52.55 52.56 3kj6 s ASP 28 Cb -0.04 -2.07 -0.09 0.00 -1.45 0.00 0.00 42.92 39.27 3kj6 s ASP 28 CO 0.47 -0.55 1.07 0.27 0.13 0.00 0.00 175.17 176.56 3kj6 s ILE 29 N 0.39 3.60 -1.50 4.11 -4.36 -0.95 -4.94 121.20 117.55 3kj6 s ILE 29 Ca 0.15 1.36 -0.11 0.00 -0.26 0.00 0.00 60.65 61.78 3kj6 s ILE 29 Cb -0.17 -3.76 0.01 0.00 1.25 0.00 0.00 42.46 39.78 3kj6 s ILE 29 CO -0.05 0.13 2.50 0.59 0.24 0.00 0.00 174.94 178.35 3kj6 n ASN 30 N 0.36 6.20 -0.91 4.36 5.03 -1.26 -4.00 115.26 125.03 3kj6 n ASN 30 Ca 0.03 -2.78 -0.08 0.00 0.87 0.00 0.00 54.58 52.62 3kj6 n ASN 30 Cb 0.48 -1.58 -0.03 0.00 -1.02 0.00 0.00 39.78 37.62 3kj6 n ASN 30 CO 0.00 0.00 0.00 -1.20 -1.83 0.00 0.00 177.26 174.23 3kj6 n SER 31 N 4.61 -3.00 -3.30 6.41 7.64 -1.26 -4.81 113.62 119.90 3kj6 n SER 31 Ca 0.62 0.19 -0.38 0.00 1.01 0.00 0.00 58.87 60.31 3kj6 n SER 31 Cb 0.31 -2.59 -0.03 0.00 -1.01 0.00 0.00 64.21 60.90 3kj6 n SER 31 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 3kj6 n TYR 32 N -1.53 2.38 -4.37 1.43 0.53 -1.26 -2.89 117.16 111.45 3kj6 n TYR 32 Ca -0.08 -2.95 -0.29 0.00 -1.02 0.00 0.00 57.90 53.56 3kj6 n TYR 32 Cb 0.33 -2.27 -0.12 0.00 -1.03 0.00 0.00 39.34 36.25 3kj6 n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.02 0.00 0.00 176.86 174.67 3kj6 s LEU 33 N -0.52 2.45 0.05 7.72 0.20 -1.26 -1.71 118.68 125.61 3kj6 s LEU 33 Ca 0.65 -0.70 0.04 0.00 0.69 0.00 0.00 54.13 54.81 3kj6 s LEU 33 Cb 0.19 -1.31 -0.02 0.00 -0.43 0.00 0.00 46.19 44.61 3kj6 s LEU 33 CO -0.07 0.17 -0.11 -0.55 -0.29 0.00 0.00 176.35 175.50 3kj6 s SER 34 N -2.15 1.26 -0.11 3.68 0.15 0.16 -1.35 113.70 115.34 3kj6 s SER 34 Ca 0.16 -0.51 0.03 0.00 0.70 0.00 0.00 55.95 56.33 3kj6 s SER 34 Cb -0.10 -0.03 -0.00 0.00 -1.71 0.00 0.00 66.02 64.18 3kj6 s SER 34 CO 0.08 -0.09 -0.21 0.26 1.20 0.00 0.00 173.24 174.48 3kj6 s TRP 35 N -1.12 2.63 0.30 3.44 0.52 0.12 -0.49 118.94 124.35 3kj6 s TRP 35 Ca -0.04 -1.00 0.03 0.00 0.02 0.00 0.00 56.10 55.11 3kj6 s TRP 35 Cb -0.09 -1.76 -0.04 0.00 -1.15 0.00 0.00 33.47 30.43 3kj6 s TRP 35 CO 0.01 -0.40 0.13 -0.59 0.02 0.00 0.00 176.95 176.12 3kj6 s PHE 36 N 0.42 1.61 -0.15 -1.98 -0.12 0.06 -1.11 117.98 116.71 3kj6 s PHE 36 Ca -0.15 -1.28 -0.02 0.00 -0.05 0.00 0.00 56.93 55.43 3kj6 s PHE 36 Cb -0.17 -0.92 0.05 0.00 -0.63 0.00 0.00 43.02 41.35 3kj6 s PHE 36 CO 0.07 -0.41 0.02 -1.14 -0.05 0.00 0.00 175.22 173.71 3kj6 s GLN 37 N -3.89 0.62 -0.20 1.99 0.74 0.09 -0.97 119.66 118.03 3kj6 s GLN 37 Ca 0.35 -0.20 -0.16 0.00 0.05 0.00 0.00 55.36 55.40 3kj6 s GLN 37 Cb 0.06 -1.66 -0.04 0.00 1.10 0.00 0.00 33.01 32.47 3kj6 s GLN 37 CO 0.16 -0.51 0.42 -0.65 -0.55 0.00 0.00 175.29 174.15 3kj6 s GLN 38 N 1.92 4.18 -0.08 1.67 -1.52 0.42 -1.82 119.66 124.43 3kj6 s GLN 38 Ca 0.02 0.24 0.00 0.00 -1.95 0.00 0.00 55.36 53.66 3kj6 s GLN 38 Cb -0.15 -3.54 -0.03 0.00 -0.22 0.00 0.00 33.01 29.07 3kj6 s GLN 38 CO -0.07 -0.05 -0.06 0.15 -0.25 0.00 0.00 175.29 175.01 3kj6 s LYS 39 N 1.35 2.85 -0.39 2.91 1.02 -1.26 -0.93 119.74 125.28 3kj6 s LYS 39 Ca 0.20 -0.54 -0.38 0.00 0.02 0.00 0.00 55.97 55.27 3kj6 s LYS 39 Cb -0.15 -2.63 -0.14 0.00 -0.52 0.00 0.00 37.83 34.39 3kj6 s LYS 39 CO 0.08 0.63 2.17 -0.35 -0.92 0.00 0.00 175.35 176.96 3kj6 n PRO 40 N 2.34 0.74 -0.35 -1.68 -0.04 -1.26 -0.71 135.00 134.04 3kj6 n PRO 40 Ca -0.18 0.20 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 3kj6 n PRO 40 Cb 0.53 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.83 3kj6 n PRO 40 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3kj6 n GLY 41 N 6.85 0.80 3.66 0.55 0.00 -1.26 -5.07 105.19 110.73 3kj6 n GLY 41 Ca 0.46 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.17 3kj6 n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3kj6 s LYS 42 N -0.65 2.09 -0.07 1.61 1.02 0.11 -5.14 119.74 118.70 3kj6 s LYS 42 Ca 0.00 -2.31 -0.10 0.00 0.02 0.00 0.00 55.97 53.57 3kj6 s LYS 42 Cb 0.00 -1.17 -0.05 0.00 -0.52 0.00 0.00 37.83 36.09 3kj6 s LYS 42 CO 0.00 -0.40 0.25 -1.54 -0.92 0.00 0.00 175.35 172.74 3kj6 s SER 43 N -3.77 6.56 -0.04 2.83 1.04 -1.26 -4.66 113.70 114.39 3kj6 s SER 43 Ca 0.13 0.67 -0.34 0.00 0.48 0.00 0.00 55.95 56.89 3kj6 s SER 43 Cb 0.02 -2.15 -0.12 0.00 0.10 0.00 0.00 66.02 63.87 3kj6 s SER 43 CO 0.08 0.37 1.81 -0.81 0.98 0.00 0.00 173.24 175.67 3kj6 n PRO 44 N 1.97 2.14 -3.73 4.02 -0.04 -1.26 -4.78 135.00 133.32 3kj6 n PRO 44 Ca -0.17 0.78 -0.36 0.00 -0.04 0.00 0.00 63.50 63.71 3kj6 n PRO 44 Cb 0.54 -2.61 -0.07 0.00 -0.04 0.00 0.00 33.50 31.32 3kj6 n PRO 44 CO 0.00 0.00 0.00 0.21 -0.04 0.00 0.00 175.50 175.67 3kj6 s LYS 45 N 3.41 3.97 0.00 0.54 2.20 -0.76 -4.86 119.74 124.24 3kj6 s LYS 45 Ca 0.90 -0.11 -0.23 0.00 -0.36 0.00 0.00 55.97 56.17 3kj6 s LYS 45 Cb -0.70 -3.34 -0.05 0.00 -1.51 0.00 0.00 37.83 32.23 3kj6 s LYS 45 CO 0.49 0.45 0.69 0.99 -0.36 0.00 0.00 175.35 177.62 3kj6 s THR 46 N -0.11 4.86 -0.27 3.43 2.01 -1.26 -0.74 115.64 123.57 3kj6 s THR 46 Ca 0.12 1.46 -0.15 0.00 0.31 0.00 0.00 61.69 63.44 3kj6 s THR 46 Cb -0.12 -4.04 -0.13 0.00 0.01 0.00 0.00 72.50 68.23 3kj6 s THR 46 CO 0.02 0.36 -0.30 0.18 -0.69 0.00 0.00 174.62 174.18 3kj6 n LEU 47 N 3.00 1.95 -3.97 4.42 7.99 -0.27 -4.76 117.00 125.36 3kj6 n LEU 47 Ca -0.04 0.35 -0.12 0.00 -0.01 0.00 0.00 56.01 56.19 3kj6 n LEU 47 Cb 0.51 -0.83 -0.12 0.00 -0.11 0.00 0.00 43.42 42.86 3kj6 n LEU 47 CO 0.46 0.54 -0.38 -0.63 -1.51 0.00 0.00 177.39 175.87 3kj6 s ILE 48 N -2.50 0.23 0.28 -0.08 1.01 -0.89 -0.08 121.20 119.17 3kj6 s ILE 48 Ca -0.38 -0.61 0.02 0.00 0.00 0.00 0.00 60.65 59.68 3kj6 s ILE 48 Cb 0.14 -0.29 -0.05 0.00 0.01 0.00 0.00 42.46 42.27 3kj6 s ILE 48 CO 0.50 -0.25 0.11 -0.72 0.00 0.00 0.00 174.94 174.58 3kj6 s TYR 49 N -0.86 1.58 -1.64 3.97 -0.85 -1.06 0.15 117.35 118.64 3kj6 s TYR 49 Ca -0.08 -1.21 -0.17 0.00 -0.52 0.00 0.00 57.07 55.10 3kj6 s TYR 49 Cb -0.06 -0.92 0.14 0.00 0.38 0.00 0.00 41.96 41.49 3kj6 s TYR 49 CO -0.00 -0.35 0.81 -2.13 -1.52 0.00 0.00 175.55 172.36 3kj6 n ARG 50 N -0.52 -3.66 0.00 -3.49 0.00 -0.45 -1.56 116.66 106.98 3kj6 n ARG 50 Ca -0.00 0.42 0.00 0.00 -0.00 0.00 0.00 57.85 58.27 3kj6 n ARG 50 Cb 0.66 -5.19 0.00 0.00 0.00 0.00 0.00 32.46 27.93 3kj6 n ARG 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3kj6 n ALA 51 N -4.37 0.00 -0.31 5.13 0.00 -0.92 -3.89 120.51 116.14 3kj6 n ALA 51 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3kj6 n ALA 51 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 3kj6 n ALA 51 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3kj6 n ASN 52 N 1.40 0.00 -4.47 0.00 2.04 -1.19 -3.04 115.26 110.00 3kj6 n ASN 52 Ca 0.00 0.00 -0.43 0.00 -0.44 0.00 0.00 54.58 53.71 3kj6 n ASN 52 Cb 0.00 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.22 3kj6 n ASN 52 CO 0.00 0.00 0.00 -0.13 -0.44 0.00 0.00 177.26 176.69 3kj6 s ARG 53 N 0.00 3.34 0.21 -3.83 0.52 -0.60 -4.62 118.95 113.96 3kj6 s ARG 53 Ca 0.00 -1.15 -0.31 0.00 -0.52 0.00 0.00 55.73 53.75 3kj6 s ARG 53 Cb 0.00 -4.59 -0.15 0.00 0.52 0.00 0.00 34.95 30.73 3kj6 s ARG 53 CO 0.00 -1.86 1.02 1.28 0.02 0.00 0.00 175.30 175.75 3kj6 n LEU 54 N 7.53 1.17 -4.79 2.53 4.77 -1.26 -2.58 117.00 124.37 3kj6 n LEU 54 Ca 0.10 1.15 -0.35 0.00 -0.03 0.00 0.00 56.01 56.89 3kj6 n LEU 54 Cb 0.47 -1.19 -0.03 0.00 -2.33 0.00 0.00 43.42 40.35 3kj6 n LEU 54 CO 0.60 -1.59 0.73 -0.69 -1.33 0.00 0.00 177.39 175.11 3kj6 s VAL 55 N -0.59 3.64 0.12 4.08 1.01 0.88 -4.89 120.40 124.64 3kj6 s VAL 55 Ca 0.68 1.04 -0.31 0.00 0.00 0.00 0.00 61.98 63.39 3kj6 s VAL 55 Cb -0.83 -3.43 -0.09 0.00 0.00 0.00 0.00 36.38 32.03 3kj6 s VAL 55 CO 0.56 -0.20 1.62 1.51 0.00 0.00 0.00 175.10 178.59 3kj6 s ASP 56 N -1.88 6.59 0.00 3.32 -4.77 -1.26 -2.42 116.67 116.24 3kj6 s ASP 56 Ca 0.68 2.56 0.00 0.00 -3.30 0.00 0.00 52.55 52.48 3kj6 s ASP 56 Cb -0.19 -2.58 0.00 0.00 -1.09 0.00 0.00 42.92 39.07 3kj6 s ASP 56 CO 0.22 -0.86 0.00 0.61 0.70 0.00 0.00 175.17 175.84 3kj6 n GLY 57 N 3.89 0.40 3.77 2.12 0.00 -1.26 -5.07 105.19 109.04 3kj6 n GLY 57 Ca 0.15 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.79 3kj6 n GLY 57 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kj6 s VAL 58 N -2.00 5.10 0.22 1.61 1.01 -1.02 -5.03 120.40 120.29 3kj6 s VAL 58 Ca 0.00 0.90 -0.31 0.00 0.00 0.00 0.00 61.98 62.57 3kj6 s VAL 58 Cb 0.00 -3.77 -0.14 0.00 0.00 0.00 0.00 36.38 32.47 3kj6 s VAL 58 CO 0.00 0.45 1.24 -0.81 0.00 0.00 0.00 175.10 175.98 3kj6 n PRO 59 N 2.78 1.57 0.00 2.72 -0.04 -1.26 -4.82 135.00 135.95 3kj6 n PRO 59 Ca -0.10 0.56 0.06 0.00 -0.04 0.00 0.00 63.50 63.97 3kj6 n PRO 59 Cb 0.52 -2.10 0.34 0.00 -0.04 0.00 0.00 33.50 32.22 3kj6 n PRO 59 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 3kj6 n SER 60 N 1.88 0.00 -0.24 3.54 3.41 -1.26 -2.09 113.62 118.86 3kj6 n SER 60 Ca 0.12 -0.44 0.14 0.00 -0.26 0.00 0.00 58.87 58.44 3kj6 n SER 60 Cb 0.29 0.00 0.62 0.00 -0.26 0.00 0.00 64.21 64.86 3kj6 n SER 60 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 3kj6 n ARG 61 N -0.95 1.14 -3.47 4.33 1.85 -1.26 -4.75 116.66 113.54 3kj6 n ARG 61 Ca 0.09 -0.49 -0.37 0.00 -1.00 0.00 0.00 57.85 56.08 3kj6 n ARG 61 Cb 0.04 -1.49 -0.07 0.00 -1.05 0.00 0.00 32.46 29.89 3kj6 n ARG 61 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 3kj6 s PHE 62 N -2.20 3.43 -0.21 2.89 0.40 -0.89 -2.45 117.98 118.95 3kj6 s PHE 62 Ca 0.36 0.61 -0.03 0.00 -0.60 0.00 0.00 56.93 57.27 3kj6 s PHE 62 Cb 0.21 -2.42 0.07 0.00 0.51 0.00 0.00 43.02 41.39 3kj6 s PHE 62 CO 0.41 0.14 0.05 0.42 0.70 0.00 0.00 175.22 176.94 3kj6 s ILE 63 N 0.78 0.45 -0.13 0.64 1.01 0.17 -4.94 121.20 119.19 3kj6 s ILE 63 Ca 0.18 -0.60 -0.15 0.00 0.00 0.00 0.00 60.65 60.08 3kj6 s ILE 63 Cb -0.14 -1.03 -0.05 0.00 0.01 0.00 0.00 42.46 41.25 3kj6 s ILE 63 CO 0.06 -0.29 0.34 -0.83 0.00 0.00 0.00 174.94 174.22 3kj6 s GLY 64 N 1.88 2.28 -0.26 6.18 0.00 -1.26 -0.30 107.32 115.84 3kj6 s GLY 64 Ca 0.01 -0.38 -0.02 0.00 0.00 0.00 0.00 44.72 44.34 3kj6 s GLY 64 CO -0.11 0.46 0.38 -1.59 0.00 0.00 0.00 173.10 172.24 3kj6 s THR 65 N 0.31 -0.60 0.36 0.90 2.01 -0.87 -4.03 115.64 113.72 3kj6 s THR 65 Ca 0.19 -0.14 -0.14 0.00 0.31 0.00 0.00 61.69 61.91 3kj6 s THR 65 Cb -0.14 -0.86 0.04 0.00 0.01 0.00 0.00 72.50 71.55 3kj6 s THR 65 CO 0.06 -0.17 0.72 -0.83 -0.69 0.00 0.00 174.62 173.71 3kj6 s GLY 66 N 2.54 0.52 -0.28 4.40 0.00 -1.26 -3.32 107.32 109.92 3kj6 s GLY 66 Ca 0.12 -0.84 -0.21 0.00 0.00 0.00 0.00 44.72 43.79 3kj6 s GLY 66 CO -0.20 -0.41 0.83 -0.56 0.00 0.00 0.00 173.10 172.76 3kj6 s SER 67 N -3.08 -0.69 0.00 1.64 0.01 -0.69 -4.94 113.70 105.94 3kj6 s SER 67 Ca 0.18 1.22 0.00 0.00 1.31 0.00 0.00 55.95 58.66 3kj6 s SER 67 Cb -0.04 1.26 0.00 0.00 0.21 0.00 0.00 66.02 67.45 3kj6 s SER 67 CO 0.12 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 174.18 3kj6 n GLY 68 N 3.18 1.77 0.00 3.44 0.00 -1.26 -3.27 105.19 109.06 3kj6 n GLY 68 Ca -0.16 0.16 0.01 0.00 0.00 0.00 0.00 46.02 46.03 3kj6 n GLY 68 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3kj6 n GLN 69 N 0.00 0.29 -4.47 1.61 7.27 -1.26 -2.24 117.38 118.57 3kj6 n GLN 69 Ca 0.00 -0.02 -0.23 0.00 0.07 0.00 0.00 57.00 56.82 3kj6 n GLN 69 Cb 0.00 -1.07 -0.16 0.00 2.41 0.00 0.00 30.24 31.42 3kj6 n GLN 69 CO 0.00 0.00 0.00 0.16 0.07 0.00 0.00 177.06 177.29 3kj6 s ASP 70 N -2.39 1.51 0.39 1.69 -4.77 -1.20 -0.80 116.67 111.11 3kj6 s ASP 70 Ca -0.01 -0.25 0.05 0.00 -3.30 0.00 0.00 52.55 49.05 3kj6 s ASP 70 Cb 0.02 -0.67 -0.02 0.00 -1.09 0.00 0.00 42.92 41.16 3kj6 s ASP 70 CO 0.12 0.02 0.19 -0.31 0.70 0.00 0.00 175.17 175.89 3kj6 s TYR 71 N 0.64 1.78 -0.29 2.11 1.51 -0.41 -1.71 117.35 120.98 3kj6 s TYR 71 Ca -0.12 -1.46 -0.17 0.00 -1.01 0.00 0.00 57.07 54.31 3kj6 s TYR 71 Cb -0.15 -1.00 0.15 0.00 -0.11 0.00 0.00 41.96 40.85 3kj6 s TYR 71 CO 0.02 -0.53 1.00 -1.54 -1.11 0.00 0.00 175.55 173.39 3kj6 s SER 72 N -3.54 -0.48 -0.23 2.29 1.04 -1.21 -0.70 113.70 110.87 3kj6 s SER 72 Ca 0.28 0.77 -0.18 0.00 0.48 0.00 0.00 55.95 57.31 3kj6 s SER 72 Cb 0.02 1.16 -0.03 0.00 0.10 0.00 0.00 66.02 67.26 3kj6 s SER 72 CO 0.19 -0.12 0.49 -0.22 0.98 0.00 0.00 173.24 174.56 3kj6 s LEU 73 N 1.23 4.11 -0.05 2.42 2.96 0.55 -2.05 118.68 127.85 3kj6 s LEU 73 Ca -0.08 0.57 0.04 0.00 -0.22 0.00 0.00 54.13 54.44 3kj6 s LEU 73 Cb -0.04 -2.64 -0.02 0.00 0.50 0.00 0.00 46.19 43.99 3kj6 s LEU 73 CO -0.14 -0.20 -0.17 -0.89 -1.32 0.00 0.00 176.35 173.63 3kj6 s THR 74 N 1.84 2.84 -0.36 3.68 2.01 0.58 -1.12 115.64 125.12 3kj6 s THR 74 Ca 0.22 -0.80 0.01 0.00 0.31 0.00 0.00 61.69 61.42 3kj6 s THR 74 Cb -0.15 -2.10 0.11 0.00 0.01 0.00 0.00 72.50 70.37 3kj6 s THR 74 CO 0.09 0.59 0.14 -0.51 -0.69 0.00 0.00 174.62 174.24 3kj6 s ILE 75 N -0.64 1.33 0.37 1.82 2.07 -0.45 0.44 121.20 126.14 3kj6 s ILE 75 Ca 0.10 -2.00 -0.27 0.00 -1.41 0.00 0.00 60.65 57.07 3kj6 s ILE 75 Cb -0.11 -1.97 -0.09 0.00 0.13 0.00 0.00 42.46 40.42 3kj6 s ILE 75 CO 0.01 -0.74 1.28 -0.94 -1.91 0.00 0.00 174.94 172.63 3kj6 s SER 76 N 1.02 6.55 -0.50 4.50 1.04 -1.03 -2.66 113.70 122.63 3kj6 s SER 76 Ca 0.13 2.62 -0.18 0.00 0.48 0.00 0.00 55.95 59.00 3kj6 s SER 76 Cb -0.20 -2.64 0.02 0.00 0.10 0.00 0.00 66.02 63.30 3kj6 s SER 76 CO -0.13 -0.68 0.63 -0.24 0.98 0.00 0.00 173.24 173.80 3kj6 n SER 77 N 0.42 -7.28 -4.73 7.02 2.88 -1.22 -4.85 113.62 105.86 3kj6 n SER 77 Ca 0.02 0.23 -0.42 0.00 -1.33 0.00 0.00 58.87 57.38 3kj6 n SER 77 Cb 0.43 -4.43 -0.03 0.00 -0.75 0.00 0.00 64.21 59.43 3kj6 n SER 77 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 3kj6 s LEU 78 N -2.89 4.36 0.16 2.46 2.96 -0.64 -4.66 118.68 120.43 3kj6 s LEU 78 Ca 0.23 2.83 0.04 0.00 -0.22 0.00 0.00 54.13 57.01 3kj6 s LEU 78 Cb -0.05 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.99 3kj6 s LEU 78 CO 0.80 -0.92 0.19 -0.62 -1.32 0.00 0.00 176.35 174.48 3kj6 s ASP 79 N 0.97 5.84 0.34 3.68 2.15 -1.26 -0.99 116.67 127.39 3kj6 s ASP 79 Ca 0.70 -0.01 0.06 0.00 0.43 0.00 0.00 52.55 53.73 3kj6 s ASP 79 Cb -0.48 -1.62 0.71 0.00 -0.30 0.00 0.00 42.92 41.23 3kj6 s ASP 79 CO 0.36 0.06 1.89 0.10 -0.17 0.00 0.00 175.17 177.41 3kj6 h TYR 80 N 2.32 0.90 0.00 -5.34 -0.00 -1.95 0.35 116.97 113.25 3kj6 h TYR 80 Ca -0.48 0.02 0.00 0.00 0.00 0.00 0.00 58.73 58.28 3kj6 h TYR 80 Cb 1.20 -0.29 0.00 0.00 0.00 0.00 0.00 36.73 37.64 3kj6 h TYR 80 CO 0.56 0.39 0.00 0.00 -0.00 0.00 0.00 178.16 179.11 3kj6 n ALA 81 N -2.42 1.65 -1.61 0.10 0.00 -1.26 -3.87 120.51 113.10 3kj6 n ALA 81 Ca 0.16 -0.05 -0.30 0.00 0.00 0.00 0.00 53.44 53.25 3kj6 n ALA 81 Cb 0.36 -1.22 -0.04 0.00 0.00 0.00 0.00 19.45 18.55 3kj6 n ALA 81 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3kj6 n ASP 82 N -1.46 6.76 -4.18 0.00 8.00 0.11 -4.88 116.55 120.90 3kj6 n ASP 82 Ca 0.04 -3.28 -0.33 0.00 0.71 0.00 0.00 54.79 51.92 3kj6 n ASP 82 Cb 0.15 -1.23 -0.16 0.00 -0.02 0.00 0.00 41.12 39.87 3kj6 n ASP 82 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kj6 s MET 83 N -1.98 3.09 0.00 -1.24 0.23 -1.25 -4.90 119.30 113.26 3kj6 s MET 83 Ca 0.57 -0.79 0.00 0.00 -1.03 0.00 0.00 55.69 54.45 3kj6 s MET 83 Cb 0.37 -2.64 0.00 0.00 -1.53 0.00 0.00 34.83 31.03 3kj6 s MET 83 CO -0.23 -0.15 0.00 0.41 -2.03 0.00 0.00 175.02 173.01 3kj6 n GLY 84 N 4.51 -0.60 3.19 3.16 0.00 -1.03 -4.88 105.19 109.54 3kj6 n GLY 84 Ca -0.20 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 44.81 3kj6 n GLY 84 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3kj6 s ILE 85 N -3.46 2.62 -0.20 -0.61 1.01 -0.11 -0.22 121.20 120.23 3kj6 s ILE 85 Ca 0.00 -0.85 -0.12 0.00 0.00 0.00 0.00 60.65 59.69 3kj6 s ILE 85 Cb 0.00 -2.20 -0.05 0.00 0.01 0.00 0.00 42.46 40.23 3kj6 s ILE 85 CO 0.00 0.42 0.20 -0.31 0.00 0.00 0.00 174.94 175.25 3kj6 s TYR 86 N 1.35 3.39 0.11 3.97 1.51 0.16 -0.44 117.35 127.40 3kj6 s TYR 86 Ca 0.04 0.39 0.09 0.00 -1.01 0.00 0.00 57.07 56.57 3kj6 s TYR 86 Cb -0.14 -2.27 -0.04 0.00 -0.11 0.00 0.00 41.96 39.40 3kj6 s TYR 86 CO -0.08 0.19 -0.18 0.71 -1.11 0.00 0.00 175.55 175.08 3kj6 s TYR 87 N 0.67 2.54 0.20 2.71 1.51 -0.15 -0.68 117.35 124.16 3kj6 s TYR 87 Ca 0.11 -0.26 0.07 0.00 -1.01 0.00 0.00 57.07 55.98 3kj6 s TYR 87 Cb -0.12 -1.35 -0.04 0.00 -0.11 0.00 0.00 41.96 40.33 3kj6 s TYR 87 CO 0.02 0.38 0.09 0.00 -1.11 0.00 0.00 175.55 174.93 3kj6 s LEU 89 N -3.32 0.86 -0.09 0.00 2.96 0.36 -0.88 118.68 118.58 3kj6 s LEU 89 Ca 0.30 0.53 0.00 0.00 -0.22 0.00 0.00 54.13 54.75 3kj6 s LEU 89 Cb -0.09 0.87 -0.03 0.00 0.50 0.00 0.00 46.19 47.44 3kj6 s LEU 89 CO 0.22 -0.11 -0.09 0.00 -1.32 0.00 0.00 176.35 175.05 3kj6 s GLN 90 N 0.39 2.95 -0.28 1.98 1.03 -1.20 0.38 119.66 124.91 3kj6 s GLN 90 Ca -0.02 -0.59 0.14 0.00 0.04 0.00 0.00 55.36 54.92 3kj6 s GLN 90 Cb -0.04 -2.61 0.48 0.00 0.03 0.00 0.00 33.01 30.88 3kj6 s GLN 90 CO -0.02 0.52 1.16 2.48 -2.54 0.00 0.00 175.29 176.89 3kj6 n TYR 91 N 2.65 2.10 0.09 9.60 4.11 -0.69 -3.65 117.16 131.37 3kj6 n TYR 91 Ca -0.18 -2.18 -0.22 0.00 -0.00 0.00 0.00 57.90 55.33 3kj6 n TYR 91 Cb 0.53 -0.29 -0.15 0.00 -0.00 0.00 0.00 39.34 39.42 3kj6 n TYR 91 CO 0.00 0.00 0.00 0.22 -0.00 0.00 0.00 176.86 177.08 3kj6 h ASP 92 N 2.35 0.63 -5.12 9.48 3.58 -1.96 -3.48 116.42 121.90 3kj6 h ASP 92 Ca 0.15 -0.82 -0.06 0.00 0.42 0.00 0.00 57.03 56.72 3kj6 h ASP 92 Cb 1.43 -0.20 -0.13 0.00 1.72 0.00 0.00 39.33 42.14 3kj6 h ASP 92 CO 0.51 1.68 -0.17 -1.83 -2.88 0.00 0.00 179.24 176.54 3kj6 s GLU 93 N -2.60 1.04 0.42 0.28 -1.05 -1.26 -5.01 118.70 110.51 3kj6 s GLU 93 Ca -0.12 -0.84 -0.22 0.00 -0.15 0.00 0.00 54.97 53.64 3kj6 s GLU 93 Cb 0.05 0.43 -0.10 0.00 -0.44 0.00 0.00 34.13 34.07 3kj6 s GLU 93 CO 0.88 -0.39 0.98 -0.06 0.95 0.00 0.00 175.26 177.63 3kj6 s PHE 94 N -3.84 3.31 0.24 4.83 0.08 -1.26 -3.81 117.98 117.53 3kj6 s PHE 94 Ca 0.05 1.64 -0.16 0.00 0.12 0.00 0.00 56.93 58.59 3kj6 s PHE 94 Cb 0.03 -2.96 -0.08 0.00 -0.57 0.00 0.00 43.02 39.44 3kj6 s PHE 94 CO -0.10 -0.29 0.67 -1.25 -0.10 0.00 0.00 175.22 174.16 3kj6 s PRO 95 N -2.86 4.07 0.02 0.24 0.04 -1.26 -4.97 135.00 130.28 3kj6 s PRO 95 Ca 0.60 0.66 -0.34 0.00 0.04 0.00 0.00 61.00 61.97 3kj6 s PRO 95 Cb -0.15 -2.72 -0.12 0.00 0.04 0.00 0.00 34.50 31.55 3kj6 s PRO 95 CO 0.19 0.32 1.78 0.66 0.04 0.00 0.00 177.00 180.00 3kj6 n TYR 96 N 0.29 2.35 -3.97 0.56 0.53 -1.25 -4.82 117.16 110.85 3kj6 n TYR 96 Ca -0.01 0.05 -0.34 0.00 -1.02 0.00 0.00 57.90 56.58 3kj6 n TYR 96 Cb 0.52 -2.64 -0.15 0.00 -1.03 0.00 0.00 39.34 36.05 3kj6 n TYR 96 CO 0.00 0.00 0.00 0.95 -1.02 0.00 0.00 176.86 176.79 3kj6 s THR 97 N 2.90 2.92 0.65 -0.72 -4.23 -1.24 -5.03 115.64 110.89 3kj6 s THR 97 Ca 0.87 -0.75 -0.10 0.00 -1.18 0.00 0.00 61.69 60.52 3kj6 s THR 97 Cb -0.65 -2.36 -0.01 0.00 1.34 0.00 0.00 72.50 70.82 3kj6 s THR 97 CO 0.45 0.38 1.03 -0.36 -0.54 0.00 0.00 174.62 175.58 3kj6 s PHE 98 N 1.39 3.43 0.77 3.99 0.40 -1.26 -3.27 117.98 123.43 3kj6 s PHE 98 Ca 0.04 1.05 -0.05 0.00 -0.60 0.00 0.00 56.93 57.37 3kj6 s PHE 98 Cb -0.15 -2.86 0.13 0.00 0.51 0.00 0.00 43.02 40.66 3kj6 s PHE 98 CO -0.06 -0.91 1.07 0.20 0.70 0.00 0.00 175.22 176.22 3kj6 s GLY 99 N -4.28 1.76 0.15 4.36 0.00 -0.06 -4.66 107.32 104.60 3kj6 s GLY 99 Ca 0.56 -1.47 -0.11 0.00 0.00 0.00 0.00 44.72 43.70 3kj6 s GLY 99 CO 0.51 -0.89 1.53 -1.33 0.00 0.00 0.00 173.10 172.92 3kj6 h GLY 100 N -0.80 1.04 -0.51 0.20 0.00 -1.88 -3.45 103.07 97.67 3kj6 h GLY 100 Ca -0.40 -0.95 0.00 0.00 0.00 0.00 0.00 47.33 45.99 3kj6 h GLY 100 CO 0.43 0.86 0.00 0.61 0.00 0.00 0.00 176.54 178.44 3kj6 n GLY 101 N -0.06 -0.13 3.79 4.60 0.00 -1.26 -5.01 105.19 107.12 3kj6 n GLY 101 Ca -0.01 -0.90 -0.37 0.00 0.00 0.00 0.00 46.02 44.74 3kj6 n GLY 101 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3kj6 s THR 102 N 0.00 4.31 -0.16 2.61 -1.32 0.15 -4.81 115.64 116.41 3kj6 s THR 102 Ca 0.00 1.70 -0.03 0.00 -1.21 0.00 0.00 61.69 62.14 3kj6 s THR 102 Cb 0.00 -4.03 -0.03 0.00 -1.51 0.00 0.00 72.50 66.94 3kj6 s THR 102 CO 0.00 0.26 -0.04 -0.75 -2.21 0.00 0.00 174.62 171.88 3kj6 s LYS 103 N -1.79 3.63 -0.18 7.08 2.20 -0.29 0.37 119.74 130.76 3kj6 s LYS 103 Ca 0.45 -0.54 -0.00 0.00 -0.36 0.00 0.00 55.97 55.52 3kj6 s LYS 103 Cb -0.20 -2.91 0.01 0.00 -1.51 0.00 0.00 37.83 33.22 3kj6 s LYS 103 CO 0.24 0.20 -0.15 -1.17 -0.36 0.00 0.00 175.35 174.11 3kj6 s LEU 104 N 0.47 2.41 0.31 5.43 0.20 0.69 -1.28 118.68 126.92 3kj6 s LEU 104 Ca -0.04 -0.53 0.10 0.00 0.69 0.00 0.00 54.13 54.35 3kj6 s LEU 104 Cb -0.14 -1.56 -0.06 0.00 -0.43 0.00 0.00 46.19 43.99 3kj6 s LEU 104 CO 0.03 0.03 -0.13 -1.61 -0.29 0.00 0.00 176.35 174.38 3kj6 s GLU 105 N 1.15 1.74 -0.23 1.98 2.02 0.19 -2.45 118.70 123.10 3kj6 s GLU 105 Ca 0.01 -1.86 -0.04 0.00 0.02 0.00 0.00 54.97 53.10 3kj6 s GLU 105 Cb -0.14 -1.66 -0.01 0.00 0.10 0.00 0.00 34.13 32.42 3kj6 s GLU 105 CO -0.06 0.20 -0.03 0.42 0.02 0.00 0.00 175.26 175.81 3kj6 s ILE 106 N -2.62 3.45 -0.04 -1.63 1.01 -1.25 -0.55 121.20 119.57 3kj6 s ILE 106 Ca 0.31 -0.52 -0.30 0.00 0.00 0.00 0.00 60.65 60.14 3kj6 s ILE 106 Cb 0.00 -2.60 -0.05 0.00 0.01 0.00 0.00 42.46 39.82 3kj6 s ILE 106 CO 0.15 0.37 1.47 -1.59 0.00 0.00 0.00 174.94 175.35 3kj6 s LYS 107 N 1.48 4.24 0.17 2.79 -2.85 0.47 -4.89 119.74 121.15 3kj6 s LYS 107 Ca 0.05 2.01 0.01 0.00 -1.00 0.00 0.00 55.97 57.05 3kj6 s LYS 107 Cb -0.15 -3.72 0.01 0.00 -2.06 0.00 0.00 37.83 31.91 3kj6 s LYS 107 CO -0.02 -0.69 0.11 -2.13 0.10 0.00 0.00 175.35 172.72 3kj6 n ARG 108 N 6.08 1.30 -3.36 1.78 0.63 -1.26 -4.70 116.66 117.14 3kj6 n ARG 108 Ca 0.15 -1.11 -0.38 0.00 -0.92 0.00 0.00 57.85 55.59 3kj6 n ARG 108 Cb 0.43 0.15 -0.06 0.00 0.45 0.00 0.00 32.46 33.44 3kj6 n ARG 108 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3kj6 s ALA 109 N -2.26 3.56 0.04 5.13 0.00 -1.26 -5.01 121.76 121.97 3kj6 s ALA 109 Ca 0.08 -0.15 -0.38 0.00 0.00 0.00 0.00 51.96 51.51 3kj6 s ALA 109 Cb -0.01 -2.57 -0.18 0.00 0.00 0.00 0.00 23.12 20.37 3kj6 s ALA 109 CO 0.05 0.22 1.29 -0.25 0.00 0.00 0.00 175.76 177.06 3kj6 n ASP 110 N 2.76 1.20 -3.90 0.00 8.00 -1.26 -4.69 116.55 118.65 3kj6 n ASP 110 Ca -0.10 1.13 -0.18 0.00 0.71 0.00 0.00 54.79 56.36 3kj6 n ASP 110 Cb 0.52 -1.11 -0.16 0.00 -0.02 0.00 0.00 41.12 40.35 3kj6 n ASP 110 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3kj6 s ALA 111 N 0.52 0.52 0.29 2.24 0.00 0.11 -4.87 121.76 120.57 3kj6 s ALA 111 Ca 0.87 -0.07 -0.28 0.00 0.00 0.00 0.00 51.96 52.48 3kj6 s ALA 111 Cb -1.06 -0.29 -0.09 0.00 0.00 0.00 0.00 23.12 21.68 3kj6 s ALA 111 CO 0.51 0.03 1.00 0.00 0.00 0.00 0.00 175.76 177.30 3kj6 s ALA 112 N 0.55 3.29 0.41 0.00 0.00 -1.26 -1.31 121.76 123.44 3kj6 s ALA 112 Ca -0.07 0.68 -0.25 0.00 0.00 0.00 0.00 51.96 52.33 3kj6 s ALA 112 Cb -0.10 -3.24 -0.08 0.00 0.00 0.00 0.00 23.12 19.69 3kj6 s ALA 112 CO -0.00 0.05 1.18 -1.25 0.00 0.00 0.00 175.76 175.73 3kj6 s PRO 113 N -1.63 4.01 -1.05 0.00 0.04 -1.26 -4.59 135.00 130.51 3kj6 s PRO 113 Ca 0.46 1.85 -0.13 0.00 0.04 0.00 0.00 61.00 63.23 3kj6 s PRO 113 Cb -0.25 -2.64 0.21 0.00 0.04 0.00 0.00 34.50 31.86 3kj6 s PRO 113 CO 0.32 -0.37 1.13 0.99 0.04 0.00 0.00 177.00 179.12 3kj6 s THR 114 N -1.42 5.47 0.41 1.26 2.01 0.20 -4.82 115.64 118.74 3kj6 s THR 114 Ca 0.58 -2.74 -0.25 0.00 0.31 0.00 0.00 61.69 59.59 3kj6 s THR 114 Cb -0.31 -4.69 -0.08 0.00 0.01 0.00 0.00 72.50 67.43 3kj6 s THR 114 CO 0.39 -1.32 1.15 0.54 -0.69 0.00 0.00 174.62 174.69 3kj6 s VAL 115 N 0.39 3.22 -0.23 3.82 0.11 -1.25 -3.60 120.40 122.86 3kj6 s VAL 115 Ca 0.32 1.00 -0.14 0.00 -2.93 0.00 0.00 61.98 60.23 3kj6 s VAL 115 Cb -0.07 -3.55 0.07 0.00 -1.53 0.00 0.00 36.38 31.30 3kj6 s VAL 115 CO -0.06 0.07 0.57 -0.94 -3.33 0.00 0.00 175.10 171.41 3kj6 s SER 116 N -1.21 -0.73 -0.04 3.54 1.04 -0.68 -4.98 113.70 110.63 3kj6 s SER 116 Ca 0.58 1.23 0.02 0.00 0.48 0.00 0.00 55.95 58.26 3kj6 s SER 116 Cb -0.29 1.13 -0.03 0.00 0.10 0.00 0.00 66.02 66.92 3kj6 s SER 116 CO 0.37 -0.22 -0.09 -0.51 0.98 0.00 0.00 173.24 173.77 3kj6 s ILE 117 N 1.34 3.50 -0.10 -1.02 2.07 -1.26 -0.74 121.20 124.99 3kj6 s ILE 117 Ca -0.08 -0.63 0.03 0.00 -1.41 0.00 0.00 60.65 58.55 3kj6 s ILE 117 Cb -0.06 -2.44 0.01 0.00 0.13 0.00 0.00 42.46 40.10 3kj6 s ILE 117 CO -0.14 0.54 -0.19 -0.36 -1.91 0.00 0.00 174.94 172.88 3kj6 s PHE 118 N -0.84 2.19 0.67 3.50 0.40 0.14 -5.00 117.98 119.04 3kj6 s PHE 118 Ca 0.13 -0.97 -0.12 0.00 -0.60 0.00 0.00 56.93 55.37 3kj6 s PHE 118 Cb -0.11 -1.52 0.00 0.00 0.51 0.00 0.00 43.02 41.90 3kj6 s PHE 118 CO 0.03 -0.44 1.06 -2.14 0.70 0.00 0.00 175.22 174.43 3kj6 s PRO 119 N 0.69 2.96 -0.14 0.24 0.02 -1.26 -2.73 135.00 134.78 3kj6 s PRO 119 Ca -0.12 1.07 -0.38 0.00 0.02 0.00 0.00 61.00 61.59 3kj6 s PRO 119 Cb -0.16 -1.99 -0.15 0.00 0.02 0.00 0.00 34.50 32.22 3kj6 s PRO 119 CO 0.03 -1.09 1.69 -2.30 -0.33 0.00 0.00 177.00 175.00 3kj6 n PRO 120 N -2.84 1.44 -1.67 5.54 -0.02 -1.25 -4.87 135.00 131.33 3kj6 n PRO 120 Ca 0.08 0.53 -0.44 0.00 -2.02 0.00 0.00 63.50 61.65 3kj6 n PRO 120 Cb 0.53 -2.24 -0.02 0.00 -0.02 0.00 0.00 33.50 31.75 3kj6 n PRO 120 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3kj6 n SER 121 N 5.02 2.48 0.19 2.55 3.41 -1.26 -4.82 113.62 121.18 3kj6 n SER 121 Ca 0.24 1.17 0.18 0.00 -0.26 0.00 0.00 58.87 60.20 3kj6 n SER 121 Cb 0.19 -1.42 0.79 0.00 -0.26 0.00 0.00 64.21 63.51 3kj6 n SER 121 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3kj6 h SER 122 N 3.20 0.00 0.33 4.04 4.64 -2.00 -0.67 113.55 123.09 3kj6 h SER 122 Ca -0.45 0.00 -0.21 0.00 -0.47 0.00 0.00 61.79 60.66 3kj6 h SER 122 Cb 1.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3kj6 h SER 122 CO 0.68 0.00 -0.87 -0.08 -0.87 0.00 0.00 176.83 175.69 3kj6 h GLU 123 N 0.00 0.39 0.03 4.77 4.81 -1.99 -3.15 114.58 119.43 3kj6 h GLU 123 Ca 0.11 -0.39 -0.27 0.00 -0.13 0.00 0.00 59.36 58.68 3kj6 h GLU 123 Cb 0.84 0.10 0.02 0.00 0.63 0.00 0.00 28.75 30.35 3kj6 h GLU 123 CO -0.00 1.05 -1.09 0.37 -0.73 0.00 0.00 179.01 178.61 3kj6 h GLN 124 N 0.23 0.66 -0.72 1.92 4.15 -1.43 -2.95 115.11 116.97 3kj6 h GLN 124 Ca -0.06 -0.75 0.07 0.00 0.77 0.00 0.00 58.65 58.68 3kj6 h GLN 124 Cb 1.49 0.22 -0.06 0.00 0.21 0.00 0.00 27.48 29.34 3kj6 h GLN 124 CO 0.15 1.32 0.40 -0.07 -1.93 0.00 0.00 178.83 178.70 3kj6 h LEU 125 N 0.35 0.58 -1.31 -2.39 3.38 -1.37 0.14 115.31 114.70 3kj6 h LEU 125 Ca -0.14 0.04 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 3kj6 h LEU 125 Cb 1.74 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 42.41 3kj6 h LEU 125 CO 0.21 0.36 -0.26 0.74 0.09 0.00 0.00 178.44 179.58 3kj6 h THR 126 N 0.71 1.22 0.10 0.22 2.02 -1.60 -3.06 112.91 112.51 3kj6 h THR 126 Ca 0.33 -1.03 -0.00 0.00 0.77 0.00 0.00 66.41 66.47 3kj6 h THR 126 Cb 0.25 1.45 0.00 0.00 -1.74 0.00 0.00 68.15 68.10 3kj6 h THR 126 CO -0.21 0.31 -0.05 -1.28 0.37 0.00 0.00 175.52 174.66 3kj6 h SER 127 N 0.13 -0.11 0.00 4.18 0.87 -0.62 -3.48 113.55 114.52 3kj6 h SER 127 Ca 0.02 -0.22 0.00 0.00 -1.23 0.00 0.00 61.79 60.36 3kj6 h SER 127 Cb 0.53 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.52 3kj6 h SER 127 CO 0.04 0.16 0.00 0.61 -0.53 0.00 0.00 176.83 177.11 3kj6 n GLY 128 N -0.46 0.90 0.00 5.77 0.00 -0.20 -5.11 105.19 106.09 3kj6 n GLY 128 Ca -0.08 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3kj6 n GLY 128 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3kj6 n GLY 129 N 0.00 5.35 3.08 -0.02 0.00 -1.20 -2.83 105.19 109.57 3kj6 n GLY 129 Ca 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.93 3kj6 n GLY 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3kj6 s ALA 130 N -2.00 -1.94 -0.27 4.61 0.00 -0.82 -2.93 121.76 118.41 3kj6 s ALA 130 Ca 0.00 1.56 -0.08 0.00 0.00 0.00 0.00 51.96 53.43 3kj6 s ALA 130 Cb 0.00 -2.05 -0.02 0.00 0.00 0.00 0.00 23.12 21.05 3kj6 s ALA 130 CO 0.00 -1.33 0.11 -1.12 0.00 0.00 0.00 175.76 173.42 3kj6 s SER 131 N 2.77 5.37 -0.50 0.00 0.01 -1.26 -1.55 113.70 118.53 3kj6 s SER 131 Ca 0.18 -0.28 -0.19 0.00 1.31 0.00 0.00 55.95 56.98 3kj6 s SER 131 Cb -0.15 -1.97 0.06 0.00 0.21 0.00 0.00 66.02 64.17 3kj6 s SER 131 CO -0.20 -0.08 0.61 -0.69 0.41 0.00 0.00 173.24 173.29 3kj6 s VAL 132 N 1.63 4.90 0.23 3.43 1.01 -1.01 -3.90 120.40 126.69 3kj6 s VAL 132 Ca 0.06 -0.54 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 3kj6 s VAL 132 Cb -0.16 -4.29 -0.07 0.00 0.00 0.00 0.00 36.38 31.86 3kj6 s VAL 132 CO 0.05 -0.79 0.58 -0.69 0.00 0.00 0.00 175.10 174.25 3kj6 s VAL 133 N 2.56 4.88 -0.06 2.92 1.01 -1.10 -2.78 120.40 127.83 3kj6 s VAL 133 Ca 0.14 0.62 -0.03 0.00 0.00 0.00 0.00 61.98 62.72 3kj6 s VAL 133 Cb -0.20 -3.64 0.04 0.00 0.00 0.00 0.00 36.38 32.58 3kj6 s VAL 133 CO 0.11 -0.02 0.13 0.00 0.00 0.00 0.00 175.10 175.33 3kj6 s PHE 135 N 1.10 2.97 -0.60 0.00 0.08 0.09 -1.46 117.98 120.16 3kj6 s PHE 135 Ca -0.09 -0.58 -0.08 0.00 0.12 0.00 0.00 56.93 56.30 3kj6 s PHE 135 Cb -0.11 -2.02 0.16 0.00 -0.57 0.00 0.00 43.02 40.48 3kj6 s PHE 135 CO -0.05 -0.27 0.47 -0.51 -0.10 0.00 0.00 175.22 174.76 3kj6 s LEU 136 N 0.86 5.79 0.14 -0.37 2.01 0.12 -1.69 118.68 125.54 3kj6 s LEU 136 Ca -0.01 -2.39 0.04 0.00 0.01 0.00 0.00 54.13 51.78 3kj6 s LEU 136 Cb -0.15 -2.00 -0.04 0.00 0.01 0.00 0.00 46.19 44.01 3kj6 s LEU 136 CO 0.01 -0.56 0.16 0.20 1.01 0.00 0.00 176.35 177.17 3kj6 s ASN 137 N 1.92 5.74 -0.64 2.29 0.02 -1.24 0.60 114.94 123.63 3kj6 s ASN 137 Ca 0.12 -0.02 -0.16 0.00 -1.02 0.00 0.00 52.86 51.77 3kj6 s ASN 137 Cb -0.21 -1.57 0.02 0.00 0.02 0.00 0.00 41.25 39.51 3kj6 s ASN 137 CO -0.03 0.09 0.64 0.59 0.02 0.00 0.00 177.10 178.40 3kj6 n ASN 138 N -0.21 -5.66 -3.96 -1.22 3.02 -1.18 -0.63 115.26 105.42 3kj6 n ASN 138 Ca -0.08 -0.44 -0.10 0.00 -0.03 0.00 0.00 54.58 53.92 3kj6 n ASN 138 Cb 0.54 -2.35 -0.12 0.00 -0.61 0.00 0.00 39.78 37.24 3kj6 n ASN 138 CO 0.00 0.00 0.00 0.72 -2.62 0.00 0.00 177.26 175.36 3kj6 s PHE 139 N -2.39 0.26 -0.01 3.10 -0.12 0.08 -4.14 117.98 114.76 3kj6 s PHE 139 Ca 0.17 -0.38 -0.01 0.00 -0.05 0.00 0.00 56.93 56.65 3kj6 s PHE 139 Cb -0.02 -0.18 0.00 0.00 -0.63 0.00 0.00 43.02 42.19 3kj6 s PHE 139 CO 0.86 -0.12 0.03 -0.47 -0.05 0.00 0.00 175.22 175.47 3kj6 s TYR 140 N -1.05 -0.00 1.19 3.49 6.14 -0.43 -1.12 117.35 125.58 3kj6 s TYR 140 Ca -0.11 0.01 -0.19 0.00 0.64 0.00 0.00 57.07 57.42 3kj6 s TYR 140 Cb -0.07 -0.01 0.28 0.00 0.42 0.00 0.00 41.96 42.58 3kj6 s TYR 140 CO -0.01 -0.04 1.13 -2.14 0.64 0.00 0.00 175.55 175.13 3kj6 s PRO 141 N -0.18 -1.14 0.31 4.97 0.02 -1.26 0.09 135.00 137.82 3kj6 s PRO 141 Ca -0.02 -0.12 0.01 0.00 0.02 0.00 0.00 61.00 60.90 3kj6 s PRO 141 Cb -0.01 -1.61 0.52 0.00 0.02 0.00 0.00 34.50 33.41 3kj6 s PRO 141 CO -0.00 -3.65 1.88 -0.22 -0.33 0.00 0.00 177.00 174.68 3kj6 h LYS 142 N -2.53 0.72 -6.10 5.54 3.64 -1.96 -3.42 116.57 112.45 3kj6 h LYS 142 Ca -0.44 -0.13 -0.56 0.00 -1.27 0.00 0.00 60.65 58.25 3kj6 h LYS 142 Cb 1.29 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 32.97 3kj6 h LYS 142 CO 0.34 0.64 1.38 0.34 -2.27 0.00 0.00 179.45 179.87 3kj6 s ASP 143 N -6.62 5.55 0.47 4.20 3.68 -1.26 -4.94 116.67 117.75 3kj6 s ASP 143 Ca -0.09 1.32 0.02 0.00 2.13 0.00 0.00 52.55 55.94 3kj6 s ASP 143 Cb 0.16 -2.52 -0.01 0.00 -1.45 0.00 0.00 42.92 39.10 3kj6 s ASP 143 CO 0.78 -1.97 0.08 -0.51 0.13 0.00 0.00 175.17 173.68 3kj6 s ILE 144 N 8.06 0.74 -0.29 4.11 -1.16 -1.26 -4.54 121.20 126.87 3kj6 s ILE 144 Ca 0.86 -2.00 -0.19 0.00 -0.51 0.00 0.00 60.65 58.81 3kj6 s ILE 144 Cb -0.24 -2.17 0.14 0.00 0.61 0.00 0.00 42.46 40.80 3kj6 s ILE 144 CO 0.32 0.00 1.00 0.21 -2.81 0.00 0.00 174.94 173.66 3kj6 s ASN 145 N -3.75 -0.48 0.07 4.50 2.47 -1.10 -5.02 114.94 111.62 3kj6 s ASN 145 Ca 0.13 0.82 0.05 0.00 0.42 0.00 0.00 52.86 54.27 3kj6 s ASN 145 Cb 0.01 1.09 -0.03 0.00 -1.45 0.00 0.00 41.25 40.87 3kj6 s ASN 145 CO 0.09 -0.13 -0.13 0.68 -3.72 0.00 0.00 177.10 173.88 3kj6 s VAL 146 N 1.01 1.06 -0.02 -5.21 -7.23 -1.26 -0.09 120.40 108.66 3kj6 s VAL 146 Ca -0.05 -1.34 0.02 0.00 -1.81 0.00 0.00 61.98 58.80 3kj6 s VAL 146 Cb -0.04 -1.08 0.00 0.00 0.56 0.00 0.00 36.38 35.82 3kj6 s VAL 146 CO -0.13 -0.28 -0.07 -1.59 -0.31 0.00 0.00 175.10 172.73 3kj6 s LYS 147 N -1.86 0.68 -0.04 4.82 -2.85 -0.57 -5.02 119.74 114.91 3kj6 s LYS 147 Ca -0.01 -0.22 -0.20 0.00 -1.00 0.00 0.00 55.97 54.54 3kj6 s LYS 147 Cb -0.09 -0.67 -0.05 0.00 -2.06 0.00 0.00 37.83 34.96 3kj6 s LYS 147 CO 0.02 0.08 0.58 -1.58 0.10 0.00 0.00 175.35 174.55 3kj6 s TRP 148 N 0.18 3.63 -0.08 1.78 0.52 -1.25 -2.69 118.94 121.03 3kj6 s TRP 148 Ca -0.02 1.13 0.05 0.00 0.02 0.00 0.00 56.10 57.28 3kj6 s TRP 148 Cb -0.07 -2.62 -0.01 0.00 -1.15 0.00 0.00 33.47 29.63 3kj6 s TRP 148 CO -0.00 0.28 -0.23 0.15 0.02 0.00 0.00 176.95 177.17 3kj6 s LYS 149 N 0.12 2.80 -0.11 4.98 1.02 -0.69 -1.83 119.74 126.02 3kj6 s LYS 149 Ca 0.31 -0.87 -0.00 0.00 0.02 0.00 0.00 55.97 55.42 3kj6 s LYS 149 Cb -0.17 -2.26 0.02 0.00 -0.52 0.00 0.00 37.83 34.90 3kj6 s LYS 149 CO 0.16 0.31 -0.08 0.42 -0.92 0.00 0.00 175.35 175.24 3kj6 s ILE 150 N 0.04 1.01 -1.25 2.17 1.01 0.25 -0.26 121.20 124.16 3kj6 s ILE 150 Ca -0.09 -0.29 -0.06 0.00 0.00 0.00 0.00 60.65 60.21 3kj6 s ILE 150 Cb -0.15 -1.02 -0.01 0.00 0.01 0.00 0.00 42.46 41.29 3kj6 s ILE 150 CO 0.06 0.36 0.71 0.47 0.00 0.00 0.00 174.94 176.53 3kj6 n ASP 151 N 4.86 -2.68 0.00 3.58 8.00 -0.53 -2.36 116.55 127.41 3kj6 n ASP 151 Ca -0.13 -0.89 0.00 0.00 0.71 0.00 0.00 54.79 54.48 3kj6 n ASP 151 Cb 0.50 -3.85 0.00 0.00 -0.02 0.00 0.00 41.12 37.75 3kj6 n ASP 151 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3kj6 n GLY 152 N -1.63 1.19 3.43 0.44 0.00 -1.26 -4.90 105.19 102.46 3kj6 n GLY 152 Ca -0.22 -0.01 -0.30 0.00 0.00 0.00 0.00 46.02 45.49 3kj6 n GLY 152 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3kj6 n SER 153 N 2.71 -1.82 -3.82 1.61 2.88 -1.00 -4.96 113.62 109.23 3kj6 n SER 153 Ca 0.00 -0.10 -0.12 0.00 -1.33 0.00 0.00 58.87 57.32 3kj6 n SER 153 Cb 0.00 -1.19 -0.11 0.00 -0.75 0.00 0.00 64.21 62.16 3kj6 n SER 153 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 3kj6 s GLU 154 N -4.12 0.38 0.22 -1.46 4.04 -1.26 0.85 118.70 117.36 3kj6 s GLU 154 Ca 0.65 -0.01 -0.09 0.00 0.04 0.00 0.00 54.97 55.56 3kj6 s GLU 154 Cb -0.21 0.17 -0.02 0.00 0.02 0.00 0.00 34.13 34.09 3kj6 s GLU 154 CO 0.65 -0.08 0.34 0.50 -1.84 0.00 0.00 175.26 174.84 3kj6 s ARG 155 N -0.59 1.39 -0.07 -4.83 3.52 -0.76 -4.93 118.95 112.69 3kj6 s ARG 155 Ca -0.07 -1.36 0.24 0.00 -0.13 0.00 0.00 55.73 54.41 3kj6 s ARG 155 Cb -0.04 0.40 0.43 0.00 -1.56 0.00 0.00 34.95 34.17 3kj6 s ARG 155 CO 0.01 -0.54 1.15 0.00 -0.81 0.00 0.00 175.30 175.12 3kj6 n GLN 156 N -0.33 0.43 -3.48 5.12 10.64 -1.26 -3.93 117.38 124.57 3kj6 n GLN 156 Ca -0.01 -2.29 -0.41 0.00 -1.83 0.00 0.00 57.00 52.46 3kj6 n GLN 156 Cb 0.63 -0.34 -0.10 0.00 -0.86 0.00 0.00 30.24 29.57 3kj6 n GLN 156 CO 0.00 0.00 0.00 1.21 -1.83 0.00 0.00 177.06 176.44 3kj6 s ASN 157 N -2.35 6.10 0.00 2.61 3.04 -1.26 -4.20 114.94 118.88 3kj6 s ASN 157 Ca 0.30 -0.51 0.00 0.00 0.04 0.00 0.00 52.86 52.69 3kj6 s ASN 157 Cb 0.35 -2.16 0.00 0.00 -1.54 0.00 0.00 41.25 37.91 3kj6 s ASN 157 CO -0.13 -0.32 0.00 0.61 -3.04 0.00 0.00 177.10 174.22 3kj6 n GLY 158 N 5.09 0.91 3.75 1.21 0.00 -1.26 -4.89 105.19 110.00 3kj6 n GLY 158 Ca -0.11 -0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.51 3kj6 n GLY 158 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3kj6 s VAL 159 N -2.00 4.40 -0.28 1.61 1.01 -1.26 -2.87 120.40 121.01 3kj6 s VAL 159 Ca 0.00 1.88 0.03 0.00 0.00 0.00 0.00 61.98 63.89 3kj6 s VAL 159 Cb 0.00 -4.23 0.07 0.00 0.00 0.00 0.00 36.38 32.22 3kj6 s VAL 159 CO 0.00 0.43 -0.06 -0.22 0.00 0.00 0.00 175.10 175.25 3kj6 s LEU 160 N -0.63 3.78 0.34 3.92 0.20 0.74 -4.95 118.68 122.08 3kj6 s LEU 160 Ca 0.41 -1.55 0.07 0.00 0.69 0.00 0.00 54.13 53.75 3kj6 s LEU 160 Cb -0.23 -1.59 -0.01 0.00 -0.43 0.00 0.00 46.19 43.93 3kj6 s LEU 160 CO 0.28 -0.24 0.45 0.20 -0.29 0.00 0.00 176.35 176.75 3kj6 s ASN 161 N 1.09 5.83 -0.29 3.68 0.02 -1.26 -1.00 114.94 123.01 3kj6 s ASN 161 Ca -0.04 -0.26 -0.17 0.00 -1.02 0.00 0.00 52.86 51.36 3kj6 s ASN 161 Cb -0.20 -1.13 0.16 0.00 0.02 0.00 0.00 41.25 40.10 3kj6 s ASN 161 CO -0.05 -0.45 1.07 -0.55 0.02 0.00 0.00 177.10 177.14 3kj6 s SER 162 N -4.16 -0.37 0.14 -1.22 0.15 -0.24 -4.98 113.70 103.03 3kj6 s SER 162 Ca 0.45 0.60 0.07 0.00 0.70 0.00 0.00 55.95 57.77 3kj6 s SER 162 Cb -0.09 1.09 -0.04 0.00 -1.71 0.00 0.00 66.02 65.27 3kj6 s SER 162 CO 0.30 -0.10 -0.02 0.26 1.20 0.00 0.00 173.24 174.89 3kj6 s TRP 163 N 1.12 2.86 0.41 3.44 0.51 -1.26 -0.55 118.94 125.46 3kj6 s TRP 163 Ca -0.07 -0.11 0.02 0.00 -2.12 0.00 0.00 56.10 53.82 3kj6 s TRP 163 Cb -0.03 -1.43 -0.01 0.00 -0.81 0.00 0.00 33.47 31.19 3kj6 s TRP 163 CO -0.13 0.49 0.60 0.95 -0.51 0.00 0.00 176.95 178.35 3kj6 s THR 164 N -1.51 4.10 0.78 2.01 -4.23 -0.31 -5.01 115.64 111.47 3kj6 s THR 164 Ca 0.26 -0.65 -0.10 0.00 -1.18 0.00 0.00 61.69 60.01 3kj6 s THR 164 Cb -0.10 -3.48 0.08 0.00 1.34 0.00 0.00 72.50 70.34 3kj6 s THR 164 CO 0.17 -0.29 1.13 -1.81 -0.54 0.00 0.00 174.62 173.28 3kj6 s ASP 165 N -4.19 4.51 0.11 3.99 1.01 -1.26 -4.57 116.67 116.27 3kj6 s ASP 165 Ca 0.47 0.62 -0.35 0.00 0.71 0.00 0.00 52.55 54.00 3kj6 s ASP 165 Cb -0.10 -1.13 -0.15 0.00 1.01 0.00 0.00 42.92 42.55 3kj6 s ASP 165 CO 0.36 -1.86 1.52 1.67 0.21 0.00 0.00 175.17 177.07 3kj6 n GLN 166 N -3.21 1.80 -1.86 8.23 7.27 -1.26 -4.77 117.38 123.57 3kj6 n GLN 166 Ca 0.09 0.65 -0.36 0.00 0.07 0.00 0.00 57.00 57.44 3kj6 n GLN 166 Cb 0.61 -2.38 0.05 0.00 2.41 0.00 0.00 30.24 30.93 3kj6 n GLN 166 CO 0.00 0.00 0.00 0.34 0.07 0.00 0.00 177.06 177.47 3kj6 s ASP 167 N 1.02 4.89 0.01 1.69 2.15 0.09 -4.81 116.67 121.71 3kj6 s ASP 167 Ca 0.82 2.45 -0.09 0.00 0.43 0.00 0.00 52.55 56.16 3kj6 s ASP 167 Cb -0.78 -2.60 -0.05 0.00 -0.30 0.00 0.00 42.92 39.19 3kj6 s ASP 167 CO 0.42 -1.80 1.12 0.28 -0.17 0.00 0.00 175.17 175.02 3kj6 h SER 168 N 0.63 -0.27 0.14 -0.34 0.02 -1.91 -2.38 113.55 109.45 3kj6 h SER 168 Ca -0.50 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.45 3kj6 h SER 168 Cb 1.31 0.07 0.00 0.00 0.14 0.00 0.00 62.40 63.92 3kj6 h SER 168 CO 0.54 -0.19 -0.07 0.11 -1.14 0.00 0.00 176.83 176.08 3kj6 h LYS 169 N -0.32 -0.18 0.00 3.45 6.56 -1.93 -3.33 116.57 120.81 3kj6 h LYS 169 Ca -0.03 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.57 3kj6 h LYS 169 Cb 0.24 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 31.95 3kj6 h LYS 169 CO 0.05 -0.12 0.00 -3.47 -2.06 0.00 0.00 179.45 173.85 3kj6 n ASP 170 N -3.40 0.18 -4.21 0.86 2.03 -1.26 -4.86 116.55 105.90 3kj6 n ASP 170 Ca -0.02 0.56 -0.33 0.00 0.52 0.00 0.00 54.79 55.51 3kj6 n ASP 170 Cb 0.08 -0.60 -0.06 0.00 -0.72 0.00 0.00 41.12 39.82 3kj6 n ASP 170 CO 0.00 0.00 0.00 -1.54 -1.92 0.00 0.00 177.20 173.74 3kj6 n SER 171 N -1.72 -0.33 -3.87 1.67 3.41 -0.90 -4.91 113.62 106.98 3kj6 n SER 171 Ca 0.01 -1.25 -0.24 0.00 -0.26 0.00 0.00 58.87 57.14 3kj6 n SER 171 Cb 0.11 -1.82 -0.08 0.00 -0.26 0.00 0.00 64.21 62.15 3kj6 n SER 171 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 3kj6 s THR 172 N -4.15 0.38 -0.06 6.66 -1.32 -1.26 -4.72 115.64 111.18 3kj6 s THR 172 Ca 0.11 -2.00 0.06 0.00 -1.21 0.00 0.00 61.69 58.64 3kj6 s THR 172 Cb -0.06 -2.36 -0.01 0.00 -1.51 0.00 0.00 72.50 68.56 3kj6 s THR 172 CO 0.98 0.00 -0.24 -0.31 -2.21 0.00 0.00 174.62 172.84 3kj6 s TYR 173 N -3.26 2.48 0.04 9.09 2.02 -0.28 -0.73 117.35 126.71 3kj6 s TYR 173 Ca 0.28 -0.67 0.07 0.00 -0.37 0.00 0.00 57.07 56.38 3kj6 s TYR 173 Cb 0.02 -1.61 -0.02 0.00 -0.40 0.00 0.00 41.96 39.94 3kj6 s TYR 173 CO 0.18 -0.18 -0.21 -1.12 -1.57 0.00 0.00 175.55 172.65 3kj6 s SER 174 N -0.19 2.53 0.08 2.29 0.01 -1.26 -0.74 113.70 116.41 3kj6 s SER 174 Ca -0.02 -0.51 0.07 0.00 1.31 0.00 0.00 55.95 56.80 3kj6 s SER 174 Cb -0.14 -0.22 -0.03 0.00 0.21 0.00 0.00 66.02 65.84 3kj6 s SER 174 CO 0.03 0.18 -0.18 -0.32 0.41 0.00 0.00 173.24 173.36 3kj6 s MET 175 N -1.09 1.04 -0.08 12.44 1.75 0.20 -1.16 119.30 132.40 3kj6 s MET 175 Ca 0.08 -1.03 0.02 0.00 -1.25 0.00 0.00 55.69 53.51 3kj6 s MET 175 Cb -0.09 -1.19 0.01 0.00 2.84 0.00 0.00 34.83 36.41 3kj6 s MET 175 CO 0.01 0.28 -0.14 0.45 -0.65 0.00 0.00 175.02 174.97 3kj6 s SER 176 N -1.68 2.15 -0.13 1.11 0.15 0.29 0.15 113.70 115.74 3kj6 s SER 176 Ca 0.04 -0.37 0.01 0.00 0.70 0.00 0.00 55.95 56.33 3kj6 s SER 176 Cb -0.10 -0.98 0.02 0.00 -1.71 0.00 0.00 66.02 63.26 3kj6 s SER 176 CO 0.03 0.04 -0.15 -0.55 1.20 0.00 0.00 173.24 173.81 3kj6 s SER 177 N 0.76 2.58 -0.20 5.45 0.15 -0.54 -1.07 113.70 120.83 3kj6 s SER 177 Ca -0.12 -0.46 0.01 0.00 0.70 0.00 0.00 55.95 56.08 3kj6 s SER 177 Cb -0.16 -1.14 0.05 0.00 -1.71 0.00 0.00 66.02 63.06 3kj6 s SER 177 CO 0.02 -0.02 -0.08 -0.89 1.20 0.00 0.00 173.24 173.47 3kj6 s THR 178 N 1.27 1.52 -0.24 6.45 2.01 -0.17 -1.69 115.64 124.78 3kj6 s THR 178 Ca -0.00 -0.97 -0.21 0.00 0.31 0.00 0.00 61.69 60.82 3kj6 s THR 178 Cb -0.14 -1.64 -0.02 0.00 0.01 0.00 0.00 72.50 70.71 3kj6 s THR 178 CO -0.07 0.11 0.64 -1.48 -0.69 0.00 0.00 174.62 173.14 3kj6 s LEU 179 N 1.44 4.08 -0.22 4.42 2.34 -1.12 -0.19 118.68 129.44 3kj6 s LEU 179 Ca -0.02 0.76 -0.11 0.00 0.06 0.00 0.00 54.13 54.83 3kj6 s LEU 179 Cb -0.16 -2.89 -0.05 0.00 -0.56 0.00 0.00 46.19 42.53 3kj6 s LEU 179 CO -0.08 -0.36 0.17 0.42 -1.06 0.00 0.00 176.35 175.45 3kj6 s THR 180 N 2.39 5.36 0.43 5.48 -4.23 -1.14 -2.41 115.64 121.53 3kj6 s THR 180 Ca 0.27 0.23 0.03 0.00 -1.18 0.00 0.00 61.69 61.04 3kj6 s THR 180 Cb -0.16 -3.51 -0.03 0.00 1.34 0.00 0.00 72.50 70.15 3kj6 s THR 180 CO 0.09 0.37 0.08 -0.76 -0.54 0.00 0.00 174.62 173.86 3kj6 s LEU 181 N 0.87 2.13 0.91 4.79 1.43 -0.59 -4.90 118.68 123.32 3kj6 s LEU 181 Ca 0.09 -1.63 -0.12 0.00 -1.03 0.00 0.00 54.13 51.43 3kj6 s LEU 181 Cb -0.13 -0.34 0.19 0.00 0.03 0.00 0.00 46.19 45.95 3kj6 s LEU 181 CO 0.03 -0.86 1.25 -0.89 0.23 0.00 0.00 176.35 176.11 3kj6 s THR 182 N -3.10 2.02 0.11 5.49 2.01 -1.26 -1.94 115.64 118.96 3kj6 s THR 182 Ca 0.20 -0.16 -0.15 0.00 0.31 0.00 0.00 61.69 61.89 3kj6 s THR 182 Cb 0.03 -2.86 -0.06 0.00 0.01 0.00 0.00 72.50 69.63 3kj6 s THR 182 CO 0.11 0.00 1.49 0.50 -0.69 0.00 0.00 174.62 176.03 3kj6 h LYS 183 N -1.41 0.66 -0.40 4.92 3.64 -1.75 -2.51 116.57 119.73 3kj6 h LYS 183 Ca -0.42 -0.28 -0.06 0.00 -1.27 0.00 0.00 60.65 58.63 3kj6 h LYS 183 Cb 1.23 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.01 3kj6 h LYS 183 CO 0.36 0.86 0.03 -0.44 -2.27 0.00 0.00 179.45 177.99 3kj6 h ASP 184 N 0.44 0.67 -0.06 4.20 3.32 -1.94 0.62 116.42 123.67 3kj6 h ASP 184 Ca 0.08 -0.29 0.03 0.00 0.02 0.00 0.00 57.03 56.87 3kj6 h ASP 184 Cb 0.65 -0.18 -0.04 0.00 0.22 0.00 0.00 39.33 39.98 3kj6 h ASP 184 CO 0.04 0.79 -0.17 -0.33 -1.72 0.00 0.00 179.24 177.86 3kj6 h GLU 185 N 0.53 -0.23 -0.00 3.56 4.39 -1.93 -2.26 114.58 118.64 3kj6 h GLU 185 Ca 0.12 0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.75 3kj6 h GLU 185 Cb 0.43 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.12 3kj6 h GLU 185 CO 0.02 -0.16 -0.41 -0.92 -1.16 0.00 0.00 179.01 176.38 3kj6 h TYR 186 N -0.24 0.01 0.00 4.33 3.20 -1.32 -2.74 116.97 120.21 3kj6 h TYR 186 Ca 0.07 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 3kj6 h TYR 186 Cb 0.34 -0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.61 3kj6 h TYR 186 CO -0.25 0.42 -0.11 0.93 -1.64 0.00 0.00 178.16 177.51 3kj6 h GLU 187 N 0.01 0.00 -0.00 1.82 4.39 -0.46 -3.21 114.58 117.13 3kj6 h GLU 187 Ca -0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3kj6 h GLU 187 Cb 0.73 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.38 3kj6 h GLU 187 CO 0.05 0.11 -0.06 0.54 -1.16 0.00 0.00 179.01 178.50 3kj6 n ARG 188 N -3.23 0.14 -4.36 2.33 1.74 -0.89 -4.85 116.66 107.55 3kj6 n ARG 188 Ca 0.01 -0.02 -0.18 0.00 -0.77 0.00 0.00 57.85 56.89 3kj6 n ARG 188 Cb 0.39 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 30.23 3kj6 n ARG 188 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3kj6 s HIS 189 N -2.88 1.69 0.00 -1.55 3.76 -1.21 -5.10 115.29 110.00 3kj6 s HIS 189 Ca 0.18 -0.76 -0.04 0.00 -0.15 0.00 0.00 55.06 54.28 3kj6 s HIS 189 Cb 0.19 -0.93 -0.01 0.00 1.11 0.00 0.00 32.58 32.94 3kj6 s HIS 189 CO 0.53 0.16 -0.09 0.09 -0.85 0.00 0.00 174.74 174.58 3kj6 n ASN 190 N -0.44 1.02 -4.70 1.40 3.02 -1.26 -4.79 115.26 109.51 3kj6 n ASN 190 Ca -0.06 0.15 -0.42 0.00 -0.03 0.00 0.00 54.58 54.21 3kj6 n ASN 190 Cb 0.63 -0.39 -0.03 0.00 -0.61 0.00 0.00 39.78 39.38 3kj6 n ASN 190 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3kj6 s SER 191 N -5.62 7.06 -0.32 6.41 0.15 -1.26 -2.14 113.70 117.98 3kj6 s SER 191 Ca -0.07 1.92 0.01 0.00 0.70 0.00 0.00 55.95 58.50 3kj6 s SER 191 Cb 0.01 -2.57 0.10 0.00 -1.71 0.00 0.00 66.02 61.85 3kj6 s SER 191 CO 0.11 -0.53 0.08 -0.31 1.20 0.00 0.00 173.24 173.78 3kj6 s TYR 192 N 1.70 2.33 0.02 3.44 2.02 -0.72 -1.45 117.35 124.70 3kj6 s TYR 192 Ca 0.58 -2.11 0.02 0.00 -0.37 0.00 0.00 57.07 55.18 3kj6 s TYR 192 Cb -0.27 -2.08 -0.04 0.00 -0.40 0.00 0.00 41.96 39.18 3kj6 s TYR 192 CO 0.26 -0.90 0.02 0.99 -1.57 0.00 0.00 175.55 174.34 3kj6 s THR 193 N 1.40 4.22 -0.36 -0.71 2.01 0.64 -2.32 115.64 120.53 3kj6 s THR 193 Ca 0.10 -0.66 0.02 0.00 0.31 0.00 0.00 61.69 61.46 3kj6 s THR 193 Cb -0.18 -2.92 0.11 0.00 0.01 0.00 0.00 72.50 69.52 3kj6 s THR 193 CO -0.20 0.31 0.12 0.00 -0.69 0.00 0.00 174.62 174.16 3kj6 s GLU 195 N 0.99 4.14 -0.19 0.00 2.02 -1.09 -2.26 118.70 122.30 3kj6 s GLU 195 Ca 0.12 -0.24 0.00 0.00 0.02 0.00 0.00 54.97 54.87 3kj6 s GLU 195 Cb -0.20 -3.47 0.02 0.00 0.10 0.00 0.00 34.13 30.58 3kj6 s GLU 195 CO -0.13 0.20 -0.17 0.00 0.02 0.00 0.00 175.26 175.18 3kj6 s ALA 196 N 0.65 2.42 -0.21 5.21 0.00 0.27 -1.51 121.76 128.59 3kj6 s ALA 196 Ca 0.08 -1.23 -0.09 0.00 0.00 0.00 0.00 51.96 50.71 3kj6 s ALA 196 Cb -0.12 -1.29 -0.05 0.00 0.00 0.00 0.00 23.12 21.67 3kj6 s ALA 196 CO 0.01 -0.40 0.12 0.95 0.00 0.00 0.00 175.76 176.44 3kj6 s THR 197 N 1.32 5.14 0.07 0.00 -4.23 0.87 -1.22 115.64 117.58 3kj6 s THR 197 Ca 0.05 0.10 0.02 0.00 -1.18 0.00 0.00 61.69 60.67 3kj6 s THR 197 Cb -0.13 -3.36 -0.03 0.00 1.34 0.00 0.00 72.50 70.31 3kj6 s THR 197 CO -0.11 0.41 -0.07 -2.28 -0.54 0.00 0.00 174.62 172.03 3kj6 s HIS 198 N 0.67 0.76 0.50 3.99 2.46 -1.26 -2.72 115.29 119.70 3kj6 s HIS 198 Ca 0.06 -0.72 0.25 0.00 0.47 0.00 0.00 55.06 55.13 3kj6 s HIS 198 Cb -0.12 -0.45 1.34 0.00 -0.13 0.00 0.00 32.58 33.21 3kj6 s HIS 198 CO 0.01 -0.13 1.93 -0.22 -2.47 0.00 0.00 174.74 173.86 3kj6 h LYS 199 N 3.73 0.11 -0.98 2.88 3.64 -1.94 -2.22 116.57 121.79 3kj6 h LYS 199 Ca -0.35 -0.01 0.12 0.00 -1.27 0.00 0.00 60.65 59.14 3kj6 h LYS 199 Cb 1.18 -0.02 -0.08 0.00 -0.41 0.00 0.00 32.23 32.89 3kj6 h LYS 199 CO 0.53 0.07 0.61 0.00 -2.27 0.00 0.00 179.45 178.39 3kj6 h THR 200 N 0.11 0.91 -3.99 1.00 1.03 -1.90 -3.43 112.91 106.65 3kj6 h THR 200 Ca 0.36 -0.33 -0.21 0.00 -0.01 0.00 0.00 66.41 66.22 3kj6 h THR 200 Cb 1.27 -0.14 -0.20 0.00 -1.07 0.00 0.00 68.15 68.01 3kj6 h THR 200 CO -0.04 0.18 -0.71 -0.55 -0.01 0.00 0.00 175.52 174.38 3kj6 s SER 201 N -5.67 0.55 0.29 0.00 0.15 -0.84 -5.02 113.70 103.16 3kj6 s SER 201 Ca -0.12 -0.61 0.22 0.00 0.70 0.00 0.00 55.95 56.14 3kj6 s SER 201 Cb 0.22 0.09 0.13 0.00 -1.71 0.00 0.00 66.02 64.75 3kj6 s SER 201 CO 0.81 -0.31 1.27 0.00 1.20 0.00 0.00 173.24 176.21 3kj6 h THR 202 N 4.32 0.06 -3.59 6.45 1.03 -1.84 -3.38 112.91 115.96 3kj6 h THR 202 Ca -0.34 -1.11 -0.65 0.00 -0.01 0.00 0.00 66.41 64.31 3kj6 h THR 202 Cb 1.20 1.77 -0.15 0.00 -1.07 0.00 0.00 68.15 69.89 3kj6 h THR 202 CO 0.45 0.04 0.14 -0.44 -0.01 0.00 0.00 175.52 175.70 3kj6 s SER 203 N -5.77 6.34 0.11 0.00 0.01 -1.26 -5.02 113.70 108.10 3kj6 s SER 203 Ca 0.03 -0.29 -0.34 0.00 1.31 0.00 0.00 55.95 56.66 3kj6 s SER 203 Cb 0.08 -2.32 -0.13 0.00 0.21 0.00 0.00 66.02 63.85 3kj6 s SER 203 CO 0.74 -0.78 1.68 -2.65 0.41 0.00 0.00 173.24 172.64 3kj6 n PRO 204 N 6.28 2.25 -2.18 12.44 -0.02 -1.26 -4.93 135.00 147.58 3kj6 n PRO 204 Ca -0.01 0.82 -0.41 0.00 -2.02 0.00 0.00 63.50 61.87 3kj6 n PRO 204 Cb 0.48 -2.62 -0.03 0.00 -0.02 0.00 0.00 33.50 31.31 3kj6 n PRO 204 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3kj6 s ILE 205 N 1.79 3.11 -0.04 4.25 1.01 -0.36 -4.82 121.20 126.14 3kj6 s ILE 205 Ca 0.82 0.91 0.02 0.00 0.00 0.00 0.00 60.65 62.40 3kj6 s ILE 205 Cb -0.65 -3.58 0.01 0.00 0.01 0.00 0.00 42.46 38.24 3kj6 s ILE 205 CO 0.40 0.13 -0.09 -0.69 0.00 0.00 0.00 174.94 174.70 3kj6 s VAL 206 N 0.13 0.85 0.07 2.92 1.01 -1.26 -0.57 120.40 123.55 3kj6 s VAL 206 Ca 0.57 -0.37 0.04 0.00 0.00 0.00 0.00 61.98 62.22 3kj6 s VAL 206 Cb -0.37 -0.77 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 3kj6 s VAL 206 CO 0.39 0.27 -0.11 -0.54 0.00 0.00 0.00 175.10 175.11 3kj6 s LYS 207 N 0.36 0.75 0.19 2.72 -0.14 -0.96 -5.01 119.74 117.66 3kj6 s LYS 207 Ca -0.06 -0.98 -0.24 0.00 -1.36 0.00 0.00 55.97 53.33 3kj6 s LYS 207 Cb -0.11 -0.57 0.05 0.00 -1.68 0.00 0.00 37.83 35.52 3kj6 s LYS 207 CO 0.01 0.11 0.87 0.45 -0.76 0.00 0.00 175.35 176.03 3kj6 s SER 208 N -1.98 -0.22 0.13 2.83 0.15 -1.26 0.77 113.70 114.13 3kj6 s SER 208 Ca -0.01 -0.45 -0.21 0.00 0.70 0.00 0.00 55.95 55.98 3kj6 s SER 208 Cb -0.07 0.56 0.06 0.00 -1.71 0.00 0.00 66.02 64.86 3kj6 s SER 208 CO 0.01 -1.04 0.54 0.72 1.20 0.00 0.00 173.24 174.67 3kj6 s PHE 209 N -3.49 -0.44 -0.14 3.44 -0.12 -0.98 -5.00 117.98 111.25 3kj6 s PHE 209 Ca 0.11 0.25 -0.02 0.00 -0.05 0.00 0.00 56.93 57.22 3kj6 s PHE 209 Cb -0.03 0.44 -0.02 0.00 -0.63 0.00 0.00 43.02 42.78 3kj6 s PHE 209 CO 0.03 -0.78 -0.08 1.21 -0.05 0.00 0.00 175.22 175.55 3kj6 s ASN 210 N -2.62 4.44 0.52 1.98 3.84 -1.26 -1.75 114.94 120.08 3kj6 s ASN 210 Ca 0.00 -0.22 0.25 0.00 0.21 0.00 0.00 52.86 53.10 3kj6 s ASN 210 Cb -0.00 -1.69 1.40 0.00 -0.55 0.00 0.00 41.25 40.41 3kj6 s ASN 210 CO -0.11 0.17 2.08 -0.09 -2.79 0.00 0.00 177.10 176.37 3kj6 h ARG 211 N 6.66 0.00 0.00 0.43 2.43 -1.74 -3.31 114.38 118.85 3kj6 h ARG 211 Ca -0.29 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 3kj6 h ARG 211 Cb 1.20 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.75 3kj6 h ARG 211 CO 0.59 0.12 0.00 0.09 -1.51 0.00 0.00 179.97 179.26 3kj6 n ASN 212 N -3.84 0.00 0.10 -3.80 3.02 -1.26 -4.12 115.26 105.35 3kj6 n ASN 212 Ca -0.02 0.57 0.06 0.00 -0.03 0.00 0.00 54.58 55.15 3kj6 n ASN 212 Cb 0.21 -0.48 0.30 0.00 -0.61 0.00 0.00 39.78 39.20 3kj6 n ASN 212 CO 0.00 0.00 0.00 -1.84 -2.62 0.00 0.00 177.26 172.80 3kj6 n GLU 213 N -1.94 0.07 0.00 3.52 0.28 -1.25 -5.27 120.64 116.05 3kj6 n GLU 213 Ca 0.00 0.53 0.14 0.00 -0.16 0.00 0.00 57.16 57.68 3kj6 n GLU 213 Cb 0.00 -1.84 0.62 0.00 1.43 0.00 0.00 31.44 31.65 3kj6 n GLU 213 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97