#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ksu s LYS 3 N 0.00 4.41 -0.29 1.09 2.20 -1.26 -4.99 119.74 120.90 3ksu s LYS 3 Ca 0.00 1.03 -0.29 0.00 -0.36 0.00 0.00 55.97 56.35 3ksu s LYS 3 Cb 0.00 -3.04 -0.02 0.00 -1.51 0.00 0.00 37.83 33.26 3ksu s LYS 3 CO 0.00 0.47 1.75 0.71 -0.36 0.00 0.00 175.35 177.92 3ksu s TYR 4 N -1.36 1.88 0.25 4.03 4.12 -1.26 -4.84 117.35 120.16 3ksu s TYR 4 Ca 0.40 0.58 0.05 0.00 0.02 0.00 0.00 57.07 58.12 3ksu s TYR 4 Cb -0.20 -4.10 0.28 0.00 -1.52 0.00 0.00 41.96 36.42 3ksu s TYR 4 CO 0.23 -3.00 1.58 0.45 0.02 0.00 0.00 175.55 174.83 3ksu h HIS 5 N 12.23 0.26 -3.54 2.71 3.86 -1.98 -3.46 115.15 125.24 3ksu h HIS 5 Ca -0.34 -0.10 -0.20 0.00 -1.16 0.00 0.00 60.37 58.57 3ksu h HIS 5 Cb 1.17 -0.05 -0.27 0.00 1.06 0.00 0.00 27.41 29.32 3ksu h HIS 5 CO 0.95 0.74 -0.61 0.34 0.86 0.00 0.00 177.93 180.21 3ksu s ASP 6 N -6.89 -0.07 -0.12 2.45 3.68 -1.26 -5.05 116.67 109.41 3ksu s ASP 6 Ca -0.04 0.13 0.16 0.00 2.13 0.00 0.00 52.55 54.93 3ksu s ASP 6 Cb 0.12 0.18 0.56 0.00 -1.45 0.00 0.00 42.92 42.33 3ksu s ASP 6 CO 0.79 -0.06 1.47 -0.11 0.13 0.00 0.00 175.17 177.40 3ksu n LEU 7 N 2.89 4.08 -4.90 -1.34 7.94 -1.26 -5.01 117.00 119.40 3ksu n LEU 7 Ca -0.13 -2.56 -0.29 0.00 -1.11 0.00 0.00 56.01 51.92 3ksu n LEU 7 Cb 0.59 -0.49 -0.03 0.00 0.53 0.00 0.00 43.42 44.02 3ksu n LEU 7 CO 0.23 0.73 0.28 -1.59 -1.11 0.00 0.00 177.39 175.94 3ksu s LYS 8 N -2.03 3.66 -0.98 1.96 -2.85 -1.26 -4.00 119.74 114.23 3ksu s LYS 8 Ca 0.41 0.12 0.00 0.00 -1.00 0.00 0.00 55.97 55.51 3ksu s LYS 8 Cb 0.29 -2.56 0.00 0.00 -2.06 0.00 0.00 37.83 33.50 3ksu s LYS 8 CO 0.16 0.11 0.00 0.09 0.10 0.00 0.00 175.35 175.82 3ksu n ASN 9 N -1.18 -4.99 -4.89 0.03 3.02 0.15 -4.98 115.26 102.42 3ksu n ASN 9 Ca -0.01 0.23 -0.33 0.00 -0.03 0.00 0.00 54.58 54.44 3ksu n ASN 9 Cb 0.54 -3.30 -0.05 0.00 -0.61 0.00 0.00 39.78 36.36 3ksu n ASN 9 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3ksu s LYS 10 N -2.57 3.67 -0.25 3.52 1.02 -1.26 -4.79 119.74 119.09 3ksu s LYS 10 Ca 0.00 0.02 -0.09 0.00 0.02 0.00 0.00 55.97 55.92 3ksu s LYS 10 Cb 0.00 -2.90 -0.04 0.00 -0.52 0.00 0.00 37.83 34.37 3ksu s LYS 10 CO 0.00 0.50 0.11 0.08 -0.92 0.00 0.00 175.35 175.12 3ksu s VAL 11 N -1.55 4.71 -0.13 3.17 1.01 -1.26 0.02 120.40 126.37 3ksu s VAL 11 Ca 0.38 -0.04 0.01 0.00 0.00 0.00 0.00 61.98 62.32 3ksu s VAL 11 Cb -0.13 -3.21 0.02 0.00 0.00 0.00 0.00 36.38 33.07 3ksu s VAL 11 CO 0.22 0.33 -0.13 -0.63 0.00 0.00 0.00 175.10 174.88 3ksu s ILE 12 N 1.49 1.41 -0.22 2.22 1.01 0.71 -0.76 121.20 127.06 3ksu s ILE 12 Ca 0.06 -0.55 -0.10 0.00 0.00 0.00 0.00 60.65 60.06 3ksu s ILE 12 Cb -0.15 -1.33 -0.05 0.00 0.01 0.00 0.00 42.46 40.94 3ksu s ILE 12 CO 0.06 0.43 0.15 -0.69 0.00 0.00 0.00 174.94 174.89 3ksu s VAL 13 N 1.36 5.38 -0.24 2.92 1.01 0.43 -0.85 120.40 130.41 3ksu s VAL 13 Ca 0.01 0.21 0.02 0.00 0.00 0.00 0.00 61.98 62.22 3ksu s VAL 13 Cb -0.13 -3.49 0.05 0.00 0.00 0.00 0.00 36.38 32.80 3ksu s VAL 13 CO -0.07 0.39 -0.13 -0.63 0.00 0.00 0.00 175.10 174.66 3ksu s ILE 14 N 0.72 2.11 -0.14 2.22 1.01 -0.70 0.45 121.20 126.87 3ksu s ILE 14 Ca 0.08 -1.45 -0.29 0.00 0.00 0.00 0.00 60.65 58.99 3ksu s ILE 14 Cb -0.12 -2.15 -0.02 0.00 0.01 0.00 0.00 42.46 40.17 3ksu s ILE 14 CO 0.01 0.10 1.29 0.00 0.00 0.00 0.00 174.94 176.35 3ksu s ALA 15 N 1.16 3.64 -0.15 9.38 0.00 0.27 -1.05 121.76 135.02 3ksu s ALA 15 Ca -0.06 0.53 -0.01 0.00 0.00 0.00 0.00 51.96 52.43 3ksu s ALA 15 Cb -0.18 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.32 3ksu s ALA 15 CO -0.07 -1.14 0.13 0.41 0.00 0.00 0.00 175.76 175.09 3ksu n GLY 16 N 3.63 0.64 1.38 0.00 0.00 -0.99 -2.35 105.19 107.49 3ksu n GLY 16 Ca 0.14 -0.52 0.07 0.00 0.00 0.00 0.00 46.02 45.71 3ksu n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ksu n GLY 17 N -0.79 2.27 0.01 -0.02 0.00 0.30 -3.77 105.19 103.18 3ksu n GLY 17 Ca -0.01 -0.69 0.05 0.00 0.00 0.00 0.00 46.02 45.37 3ksu n GLY 17 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 3ksu n ILE 18 N 0.81 0.02 -4.22 -0.61 -5.35 -1.26 -3.31 119.36 105.43 3ksu n ILE 18 Ca 0.21 -0.24 -0.13 0.00 -0.27 0.00 0.00 62.75 62.32 3ksu n ILE 18 Cb 0.78 0.24 -0.10 0.00 -1.74 0.00 0.00 39.64 38.82 3ksu n ILE 18 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 3ksu s LYS 19 N -2.70 1.11 7.30 6.28 -2.85 -1.26 -4.60 119.74 123.03 3ksu s LYS 19 Ca -0.04 -1.55 0.00 0.00 -1.00 0.00 0.00 55.97 53.38 3ksu s LYS 19 Cb 0.06 -0.07 0.00 0.00 -2.06 0.00 0.00 37.83 35.76 3ksu s LYS 19 CO 0.42 -0.22 0.00 0.09 0.10 0.00 0.00 175.35 175.75 3ksu n ASN 20 N -0.23 0.00 -0.17 0.03 3.02 -1.26 -2.59 115.26 114.05 3ksu n ASN 20 Ca -0.05 0.00 -0.07 0.00 -0.03 0.00 0.00 54.58 54.44 3ksu n ASN 20 Cb 0.64 0.00 0.02 0.00 -0.61 0.00 0.00 39.78 39.84 3ksu n ASN 20 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 3ksu h LEU 21 N 0.00 0.53 -0.51 3.41 5.85 -1.93 -2.92 115.31 119.73 3ksu h LEU 21 Ca 0.00 -0.01 0.09 0.00 0.84 0.00 0.00 57.88 58.80 3ksu h LEU 21 Cb 0.00 -0.12 -0.07 0.00 0.37 0.00 0.00 40.66 40.84 3ksu h LEU 21 CO 0.00 0.38 0.10 1.23 -0.34 0.00 0.00 178.44 179.81 3ksu h GLY 22 N 0.64 0.63 1.11 3.75 0.00 -1.59 0.93 103.07 108.54 3ksu h GLY 22 Ca 0.19 -0.03 -0.11 0.00 0.00 0.00 0.00 47.33 47.38 3ksu h GLY 22 CO -0.06 -0.07 -0.09 0.00 0.00 0.00 0.00 176.54 176.31 3ksu h ALA 23 N 1.40 0.78 -0.26 3.60 0.00 -1.49 -1.77 119.26 121.52 3ksu h ALA 23 Ca 0.26 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 3ksu h ALA 23 Cb 0.35 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3ksu h ALA 23 CO -0.34 0.67 -0.28 1.25 0.00 0.00 0.00 179.25 180.55 3ksu h LEU 24 N 0.93 0.54 -0.71 0.00 5.85 -1.28 -1.70 115.31 118.94 3ksu h LEU 24 Ca 0.15 -0.20 -0.08 0.00 0.84 0.00 0.00 57.88 58.59 3ksu h LEU 24 Cb 0.66 -0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 3ksu h LEU 24 CO 0.05 0.80 0.12 0.74 -0.34 0.00 0.00 178.44 179.81 3ksu h THR 25 N 0.46 1.26 -0.57 1.05 2.02 -0.68 -2.50 112.91 113.96 3ksu h THR 25 Ca 0.06 -1.02 -0.09 0.00 0.77 0.00 0.00 66.41 66.13 3ksu h THR 25 Cb 0.73 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 3ksu h THR 25 CO 0.06 0.39 -0.01 0.00 0.37 0.00 0.00 175.52 176.32 3ksu h ALA 26 N 1.08 0.76 -0.39 6.16 0.00 -0.98 -2.24 119.26 123.66 3ksu h ALA 26 Ca 0.21 -0.31 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 3ksu h ALA 26 Cb 0.42 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 3ksu h ALA 26 CO 0.01 0.61 -0.14 0.87 0.00 0.00 0.00 179.25 180.59 3ksu h LYS 27 N 0.89 0.71 -0.55 0.00 1.57 -1.27 -0.84 116.57 117.07 3ksu h LYS 27 Ca 0.16 -0.24 -0.09 0.00 -1.87 0.00 0.00 60.65 58.61 3ksu h LYS 27 Cb 0.56 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 3ksu h LYS 27 CO 0.03 0.82 -0.01 1.15 -0.57 0.00 0.00 179.45 180.86 3ksu h THR 28 N 0.64 1.26 -0.01 -0.16 2.02 -1.34 -2.85 112.91 112.46 3ksu h THR 28 Ca 0.10 -1.12 -0.16 0.00 0.77 0.00 0.00 66.41 66.00 3ksu h THR 28 Cb 0.61 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 3ksu h THR 28 CO 0.04 0.40 -0.75 -0.26 0.37 0.00 0.00 175.52 175.32 3ksu h PHE 29 N 0.88 0.12 0.00 3.16 0.04 -1.16 -3.31 116.94 116.67 3ksu h PHE 29 Ca 0.16 -0.06 0.00 0.00 2.80 0.00 0.00 57.97 60.87 3ksu h PHE 29 Cb 0.53 -0.02 0.00 0.00 2.20 0.00 0.00 35.95 38.67 3ksu h PHE 29 CO 0.03 0.80 0.00 0.00 -0.60 0.00 0.00 178.31 178.54 3ksu n ALA 30 N -2.43 2.32 0.21 2.45 0.00 -0.34 -2.92 120.51 119.80 3ksu n ALA 30 Ca -0.02 -0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.48 3ksu n ALA 30 Cb 0.72 -1.05 0.47 0.00 0.00 0.00 0.00 19.45 19.59 3ksu n ALA 30 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 3ksu h LEU 31 N 0.00 0.00-10.02 0.00 3.38 -1.65 -3.42 115.31 103.60 3ksu h LEU 31 Ca 0.00 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.44 3ksu h LEU 31 Cb 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 3ksu h LEU 31 CO 0.00 0.28 -0.44 -1.61 0.09 0.00 0.00 178.44 176.76 3ksu s GLU 32 N -3.94 2.41 -1.20 1.13 2.02 -1.15 -5.04 118.70 112.94 3ksu s GLU 32 Ca -0.01 -1.64 -0.21 0.00 0.02 0.00 0.00 54.97 53.12 3ksu s GLU 32 Cb 0.12 -2.21 -0.01 0.00 0.10 0.00 0.00 34.13 32.13 3ksu s GLU 32 CO 0.66 -0.12 1.82 -1.12 0.02 0.00 0.00 175.26 176.52 3ksu s SER 33 N -4.01 5.89 0.18 -0.19 0.01 -1.26 -4.59 113.70 109.74 3ksu s SER 33 Ca 0.44 -1.90 0.10 0.00 1.31 0.00 0.00 55.95 55.90 3ksu s SER 33 Cb -0.01 -2.58 -0.04 0.00 0.21 0.00 0.00 66.02 63.60 3ksu s SER 33 CO 0.25 -2.15 -0.20 0.54 0.41 0.00 0.00 173.24 172.09 3ksu s VAL 34 N 7.71 2.63 -0.40 3.43 0.11 -1.26 0.34 120.40 132.95 3ksu s VAL 34 Ca 0.61 -1.86 -0.12 0.00 -2.93 0.00 0.00 61.98 57.68 3ksu s VAL 34 Cb 0.01 -2.26 0.04 0.00 -1.53 0.00 0.00 36.38 32.64 3ksu s VAL 34 CO 0.08 -0.08 0.26 0.20 -3.33 0.00 0.00 175.10 172.23 3ksu s ASN 35 N -2.61 5.86 -0.23 3.54 0.02 0.10 -1.56 114.94 120.05 3ksu s ASN 35 Ca 0.21 -1.09 -0.07 0.00 -1.02 0.00 0.00 52.86 50.89 3ksu s ASN 35 Cb -0.09 -2.07 -0.03 0.00 0.02 0.00 0.00 41.25 39.09 3ksu s ASN 35 CO 0.11 -0.45 0.06 -0.76 0.02 0.00 0.00 177.10 176.08 3ksu s LEU 36 N 1.57 3.46 -0.31 0.60 1.43 0.12 -0.21 118.68 125.34 3ksu s LEU 36 Ca 0.03 -0.17 -0.10 0.00 -1.03 0.00 0.00 54.13 52.86 3ksu s LEU 36 Cb -0.20 -1.91 -0.01 0.00 0.03 0.00 0.00 46.19 44.09 3ksu s LEU 36 CO 0.07 0.00 0.16 0.54 0.23 0.00 0.00 176.35 177.36 3ksu s VAL 37 N 1.38 4.72 -0.28 -1.59 0.11 -0.03 -0.67 120.40 124.03 3ksu s VAL 37 Ca 0.05 -0.36 -0.08 0.00 -2.93 0.00 0.00 61.98 58.66 3ksu s VAL 37 Cb -0.15 -3.39 -0.01 0.00 -1.53 0.00 0.00 36.38 31.29 3ksu s VAL 37 CO 0.03 0.07 0.10 -0.76 -3.33 0.00 0.00 175.10 171.21 3ksu s LEU 38 N 1.63 3.75 0.23 2.54 1.43 -0.05 -1.72 118.68 126.49 3ksu s LEU 38 Ca 0.05 -0.41 -0.13 0.00 -1.03 0.00 0.00 54.13 52.61 3ksu s LEU 38 Cb -0.17 -1.94 -0.08 0.00 0.03 0.00 0.00 46.19 44.03 3ksu s LEU 38 CO 0.07 -0.12 0.61 -2.28 0.23 0.00 0.00 176.35 174.86 3ksu s HIS 39 N 1.59 3.48 -0.06 0.29 5.65 -0.21 -1.52 115.29 124.52 3ksu s HIS 39 Ca 0.05 1.04 -0.08 0.00 0.25 0.00 0.00 55.06 56.32 3ksu s HIS 39 Cb -0.16 -2.38 0.02 0.00 -1.18 0.00 0.00 32.58 28.88 3ksu s HIS 39 CO 0.04 0.28 0.21 1.52 -0.65 0.00 0.00 174.74 176.14 3ksu s TYR 40 N -1.73 -0.18 -0.01 3.88 1.13 -0.83 -0.54 117.35 119.07 3ksu s TYR 40 Ca 0.46 0.42 -0.23 0.00 -1.41 0.00 0.00 57.07 56.31 3ksu s TYR 40 Cb -0.12 0.06 -0.19 0.00 -1.10 0.00 0.00 41.96 40.61 3ksu s TYR 40 CO 0.20 -0.17 1.24 0.45 -2.51 0.00 0.00 175.55 174.76 3ksu h HIS 41 N 5.36 0.22 -3.33 -3.49 3.86 -1.89 -2.43 115.15 113.45 3ksu h HIS 41 Ca -0.27 -0.08 -0.62 0.00 -1.16 0.00 0.00 60.37 58.24 3ksu h HIS 41 Cb 1.19 -0.04 -0.17 0.00 1.06 0.00 0.00 27.41 29.45 3ksu h HIS 41 CO 0.45 0.69 -0.57 -0.65 0.86 0.00 0.00 177.93 178.70 3ksu s GLN 42 N -4.01 3.93 0.58 2.45 -0.21 -1.26 -4.11 119.66 117.02 3ksu s GLN 42 Ca -0.15 -0.37 0.31 0.00 0.02 0.00 0.00 55.36 55.17 3ksu s GLN 42 Cb 0.03 -3.21 1.79 0.00 1.00 0.00 0.00 33.01 32.62 3ksu s GLN 42 CO 0.72 0.23 2.22 0.00 -2.12 0.00 0.00 175.29 176.33 3ksu h ALA 43 N 6.84 1.39 0.00 6.09 0.00 -1.95 -2.30 119.26 129.33 3ksu h ALA 43 Ca -0.36 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3ksu h ALA 43 Cb 1.17 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3ksu h ALA 43 CO 0.69 0.04 0.00 0.36 0.00 0.00 0.00 179.25 180.34 3ksu n LYS 44 N -3.69 0.17 -0.33 0.00 0.00 -1.26 -2.98 118.16 110.06 3ksu n LYS 44 Ca -0.03 0.27 0.04 0.00 -0.00 0.00 0.00 58.31 58.59 3ksu n LYS 44 Cb 0.13 -1.75 0.18 0.00 -0.00 0.00 0.00 35.03 33.58 3ksu n LYS 44 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 3ksu n ASP 45 N -2.06 2.72 -0.07 -5.58 8.00 -0.86 -4.39 116.55 114.30 3ksu n ASP 45 Ca 0.04 -2.27 0.01 0.00 0.71 0.00 0.00 54.79 53.27 3ksu n ASP 45 Cb 0.31 -0.45 0.30 0.00 -0.02 0.00 0.00 41.12 41.26 3ksu n ASP 45 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3ksu h SER 46 N 1.95 0.62 0.57 -2.24 4.64 -1.73 -1.31 113.55 116.06 3ksu h SER 46 Ca 0.00 -0.07 -0.14 0.00 -0.47 0.00 0.00 61.79 61.11 3ksu h SER 46 Cb 0.92 -0.16 -0.02 0.00 -0.31 0.00 0.00 62.40 62.84 3ksu h SER 46 CO 0.15 0.55 -0.64 0.44 -0.87 0.00 0.00 176.83 176.45 3ksu h ASP 47 N 0.68 0.07 -0.21 4.97 5.19 -1.88 -0.56 116.42 124.68 3ksu h ASP 47 Ca 0.17 -0.05 -0.08 0.00 -0.62 0.00 0.00 57.03 56.45 3ksu h ASP 47 Cb 0.12 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 39.61 3ksu h ASP 47 CO -0.02 0.70 -0.19 0.74 -3.12 0.00 0.00 179.24 177.35 3ksu h THR 48 N 0.05 1.32 -0.34 0.35 2.02 -1.78 -1.93 112.91 112.60 3ksu h THR 48 Ca -0.01 -1.35 0.04 0.00 0.77 0.00 0.00 66.41 65.86 3ksu h THR 48 Cb 1.15 1.73 -0.04 0.00 -1.74 0.00 0.00 68.15 69.25 3ksu h THR 48 CO 0.09 0.41 0.13 0.00 0.37 0.00 0.00 175.52 176.52 3ksu h ALA 49 N 0.66 0.40 -0.03 6.16 0.00 -1.15 -1.52 119.26 123.78 3ksu h ALA 49 Ca 0.04 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 3ksu h ALA 49 Cb 0.73 0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 3ksu h ALA 49 CO 0.05 -0.27 -0.54 -0.91 0.00 0.00 0.00 179.25 177.58 3ksu h ASN 50 N 0.28 0.08 -0.31 0.00 2.35 -1.13 0.13 115.58 116.97 3ksu h ASN 50 Ca 0.15 -0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.83 3ksu h ASN 50 Cb 0.12 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 3ksu h ASN 50 CO -0.15 0.61 0.09 0.50 -1.65 0.00 0.00 177.43 176.83 3ksu h LYS 51 N 0.06 0.49 -0.31 0.81 3.64 -1.19 -1.77 116.57 118.29 3ksu h LYS 51 Ca -0.00 -0.11 -0.06 0.00 -1.27 0.00 0.00 60.65 59.21 3ksu h LYS 51 Cb 0.98 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.72 3ksu h LYS 51 CO 0.07 0.54 -0.02 1.25 -2.27 0.00 0.00 179.45 179.02 3ksu h LEU 52 N 0.34 0.56 -0.55 5.20 5.85 -1.01 -2.62 115.31 123.09 3ksu h LEU 52 Ca 0.10 -0.33 0.11 0.00 0.84 0.00 0.00 57.88 58.60 3ksu h LEU 52 Cb 0.26 -0.15 -0.09 0.00 0.37 0.00 0.00 40.66 41.05 3ksu h LEU 52 CO -0.00 0.75 0.01 0.50 -0.34 0.00 0.00 178.44 179.36 3ksu h LYS 53 N 0.35 0.12 -0.80 1.25 3.64 -0.76 -0.95 116.57 119.42 3ksu h LYS 53 Ca 0.08 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.48 3ksu h LYS 53 Cb 0.48 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.23 3ksu h LYS 53 CO 0.02 0.08 0.52 -0.44 -2.27 0.00 0.00 179.45 177.36 3ksu h ASP 54 N 0.12 0.87 0.93 4.20 3.45 -1.14 -1.28 116.42 123.58 3ksu h ASP 54 Ca 0.28 -0.01 -0.19 0.00 0.43 0.00 0.00 57.03 57.54 3ksu h ASP 54 Cb 0.43 -0.20 -0.03 0.00 -0.56 0.00 0.00 39.33 38.97 3ksu h ASP 54 CO -0.46 0.61 -0.91 1.05 -1.57 0.00 0.00 179.24 177.96 3ksu h GLU 55 N 1.03 0.00 0.00 3.56 4.11 -1.11 -3.07 114.58 119.10 3ksu h GLU 55 Ca 0.31 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.61 3ksu h GLU 55 Cb -0.03 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.20 3ksu h GLU 55 CO -0.10 0.91 -0.65 -0.07 0.07 0.00 0.00 179.01 179.18 3ksu h LEU 56 N 0.00 0.00 -1.09 3.06 3.38 -0.98 -2.09 115.31 117.59 3ksu h LEU 56 Ca -0.01 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.87 3ksu h LEU 56 Cb 1.62 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.36 3ksu h LEU 56 CO 0.12 0.65 -0.45 -0.33 0.09 0.00 0.00 178.44 178.51 3ksu h GLU 57 N 0.00 0.00 -0.00 1.13 4.39 -1.26 -2.35 114.58 116.48 3ksu h GLU 57 Ca -0.01 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.69 3ksu h GLU 57 Cb 1.15 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.80 3ksu h GLU 57 CO 0.08 0.45 -0.10 -0.25 -1.16 0.00 0.00 179.01 178.04 3ksu n ASP 58 N -3.99 0.28 0.04 1.42 8.00 -1.02 -2.44 116.55 118.84 3ksu n ASP 58 Ca -0.02 -0.27 0.13 0.00 0.71 0.00 0.00 54.79 55.34 3ksu n ASP 58 Cb 0.48 -0.16 0.39 0.00 -0.02 0.00 0.00 41.12 41.80 3ksu n ASP 58 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ksu n GLN 59 N -1.17 0.14 -0.23 -1.24 3.00 -0.82 -4.95 117.38 112.11 3ksu n GLN 59 Ca 0.12 0.08 0.00 0.00 -0.01 0.00 0.00 57.00 57.19 3ksu n GLN 59 Cb 0.28 -1.62 0.00 0.00 0.00 0.00 0.00 30.24 28.90 3ksu n GLN 59 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3ksu n GLY 60 N 1.41 1.12 3.63 1.08 0.00 -1.02 -4.78 105.19 106.63 3ksu n GLY 60 Ca 0.06 -0.19 -0.26 0.00 0.00 0.00 0.00 46.02 45.63 3ksu n GLY 60 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ksu s ALA 61 N -2.00 3.12 -0.09 4.61 0.00 -0.97 -4.36 121.76 122.07 3ksu s ALA 61 Ca 0.00 -1.46 -0.11 0.00 0.00 0.00 0.00 51.96 50.39 3ksu s ALA 61 Cb 0.00 -0.87 -0.05 0.00 0.00 0.00 0.00 23.12 22.20 3ksu s ALA 61 CO 0.00 0.43 0.25 0.15 0.00 0.00 0.00 175.76 176.59 3ksu s LYS 62 N -3.06 3.78 -0.10 0.00 -0.14 -0.60 -3.98 119.74 115.64 3ksu s LYS 62 Ca 0.27 0.08 -0.01 0.00 -1.36 0.00 0.00 55.97 54.95 3ksu s LYS 62 Cb -0.09 -3.25 0.03 0.00 -1.68 0.00 0.00 37.83 32.84 3ksu s LYS 62 CO 0.18 0.63 -0.00 0.08 -0.76 0.00 0.00 175.35 175.48 3ksu s VAL 63 N -0.71 0.49 -0.12 3.17 1.01 -1.26 0.15 120.40 123.14 3ksu s VAL 63 Ca 0.18 -0.05 -0.02 0.00 0.00 0.00 0.00 61.98 62.09 3ksu s VAL 63 Cb -0.14 -0.69 -0.03 0.00 0.00 0.00 0.00 36.38 35.53 3ksu s VAL 63 CO 0.07 0.20 -0.05 0.00 0.00 0.00 0.00 175.10 175.32 3ksu s ALA 64 N 1.92 3.01 0.10 5.51 0.00 0.16 -5.00 121.76 127.44 3ksu s ALA 64 Ca 0.04 -0.84 0.01 0.00 0.00 0.00 0.00 51.96 51.17 3ksu s ALA 64 Cb -0.13 -1.42 -0.04 0.00 0.00 0.00 0.00 23.12 21.53 3ksu s ALA 64 CO -0.06 0.38 0.23 -0.51 0.00 0.00 0.00 175.76 175.80 3ksu s LEU 65 N -0.18 4.33 -0.24 0.00 1.43 -1.26 -0.87 118.68 121.90 3ksu s LEU 65 Ca 0.03 0.22 -0.03 0.00 -1.03 0.00 0.00 54.13 53.32 3ksu s LEU 65 Cb -0.13 -2.92 0.13 0.00 0.03 0.00 0.00 46.19 43.30 3ksu s LEU 65 CO 0.03 0.12 0.36 -0.47 0.23 0.00 0.00 176.35 176.62 3ksu s TYR 66 N -1.60 -0.76 0.05 0.29 5.04 -0.57 -4.90 117.35 114.90 3ksu s TYR 66 Ca 0.35 0.76 -0.16 0.00 -2.44 0.00 0.00 57.07 55.58 3ksu s TYR 66 Cb -0.12 -0.03 -0.06 0.00 0.35 0.00 0.00 41.96 42.10 3ksu s TYR 66 CO 0.28 -0.70 0.49 1.14 -1.34 0.00 0.00 175.55 175.41 3ksu s GLN 67 N 2.52 4.03 -0.15 4.97 1.03 -1.26 -1.96 119.66 128.84 3ksu s GLN 67 Ca 0.12 0.54 -0.30 0.00 0.04 0.00 0.00 55.36 55.75 3ksu s GLN 67 Cb -0.15 -3.18 0.13 0.00 0.03 0.00 0.00 33.01 29.84 3ksu s GLN 67 CO -0.15 0.64 1.04 0.45 -2.54 0.00 0.00 175.29 174.72 3ksu s SER 68 N -1.21 -0.31 0.41 12.60 0.15 -0.91 -4.95 113.70 119.48 3ksu s SER 68 Ca 0.28 0.25 0.20 0.00 0.70 0.00 0.00 55.95 57.37 3ksu s SER 68 Cb -0.17 0.27 0.85 0.00 -1.71 0.00 0.00 66.02 65.26 3ksu s SER 68 CO 0.17 -0.35 1.82 0.44 1.20 0.00 0.00 173.24 176.51 3ksu h ASP 69 N 2.34 0.00 -6.16 5.45 3.32 -1.86 -3.32 116.42 116.19 3ksu h ASP 69 Ca -0.17 0.00 -0.42 0.00 0.02 0.00 0.00 57.03 56.46 3ksu h ASP 69 Cb 1.18 0.00 0.10 0.00 0.22 0.00 0.00 39.33 40.83 3ksu h ASP 69 CO 0.29 0.31 -0.93 -0.11 -1.72 0.00 0.00 179.24 177.08 3ksu n LEU 70 N -3.62 -3.08 -0.00 1.55 7.94 -1.26 -4.94 117.00 113.59 3ksu n LEU 70 Ca -0.01 -0.99 0.00 0.00 -1.11 0.00 0.00 56.01 53.90 3ksu n LEU 70 Cb 0.44 -2.46 -0.00 0.00 0.53 0.00 0.00 43.42 41.92 3ksu n LEU 70 CO 0.35 0.44 -0.37 -1.54 -1.11 0.00 0.00 177.39 175.16 3ksu n SER 71 N -2.72 3.70 -4.31 1.96 3.41 -1.26 -4.92 113.62 109.47 3ksu n SER 71 Ca -0.09 -0.13 -0.23 0.00 -0.26 0.00 0.00 58.87 58.16 3ksu n SER 71 Cb 0.59 1.00 -0.10 0.00 -0.26 0.00 0.00 64.21 65.45 3ksu n SER 71 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3ksu s ASN 72 N -1.75 2.40 0.37 4.04 2.20 -1.26 -4.82 114.94 116.11 3ksu s ASN 72 Ca -0.00 -1.50 0.05 0.00 -0.94 0.00 0.00 52.86 50.47 3ksu s ASN 72 Cb 0.00 0.18 0.70 0.00 -2.00 0.00 0.00 41.25 40.13 3ksu s ASN 72 CO 0.00 -0.75 1.98 -0.08 -2.94 0.00 0.00 177.10 175.31 3ksu h GLU 73 N 2.02 0.62 -0.27 3.55 4.81 -1.96 -2.41 114.58 120.94 3ksu h GLU 73 Ca -0.38 -0.07 -0.00 0.00 -0.13 0.00 0.00 59.36 58.78 3ksu h GLU 73 Cb 1.26 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.50 3ksu h GLU 73 CO 0.64 0.49 0.16 1.49 -0.73 0.00 0.00 179.01 181.05 3ksu h GLU 74 N 0.63 0.36 -0.28 1.92 4.81 -1.98 0.27 114.58 120.30 3ksu h GLU 74 Ca 0.16 -0.03 -0.11 0.00 -0.13 0.00 0.00 59.36 59.25 3ksu h GLU 74 Cb 0.07 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.36 3ksu h GLU 74 CO -0.02 0.29 -0.27 0.93 -0.73 0.00 0.00 179.01 179.21 3ksu h GLU 75 N 0.33 0.56 -0.19 1.92 5.08 -1.94 -1.58 114.58 118.77 3ksu h GLU 75 Ca 0.09 -0.23 -0.05 0.00 -1.00 0.00 0.00 59.36 58.18 3ksu h GLU 75 Cb 0.02 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 3ksu h GLU 75 CO -0.02 0.78 -0.09 0.28 -1.00 0.00 0.00 179.01 178.96 3ksu h VAL 76 N 0.49 1.31 -0.56 3.13 2.07 -1.17 -2.60 116.25 118.93 3ksu h VAL 76 Ca 0.07 -1.14 0.09 0.00 0.82 0.00 0.00 66.70 66.54 3ksu h VAL 76 Cb 0.72 1.65 -0.07 0.00 -1.52 0.00 0.00 31.29 32.07 3ksu h VAL 76 CO 0.06 0.34 0.18 0.00 0.02 0.00 0.00 177.57 178.16 3ksu h ALA 77 N 0.70 0.69 0.00 1.67 0.00 -0.37 -2.38 119.26 119.56 3ksu h ALA 77 Ca 0.04 0.09 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 3ksu h ALA 77 Cb 0.57 0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 3ksu h ALA 77 CO 0.03 -0.24 -0.22 0.87 0.00 0.00 0.00 179.25 179.69 3ksu h LYS 78 N 0.34 0.00 -0.21 0.00 1.57 -1.26 -0.68 116.57 116.32 3ksu h LYS 78 Ca 0.28 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.05 3ksu h LYS 78 Cb 0.35 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 3ksu h LYS 78 CO -0.31 0.22 0.08 1.25 -0.57 0.00 0.00 179.45 180.12 3ksu h LEU 79 N 0.00 0.30 -0.40 2.94 5.85 -1.02 -1.37 115.31 121.61 3ksu h LEU 79 Ca -0.00 -0.18 -0.11 0.00 0.84 0.00 0.00 57.88 58.43 3ksu h LEU 79 Cb 0.48 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 3ksu h LEU 79 CO 0.03 0.40 -0.51 -0.26 -0.34 0.00 0.00 178.44 177.76 3ksu h PHE 80 N 0.19 0.00 -0.06 1.25 0.04 -1.30 -1.85 116.94 115.21 3ksu h PHE 80 Ca 0.07 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.84 3ksu h PHE 80 Cb 0.20 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.34 3ksu h PHE 80 CO -0.01 0.51 0.03 -0.44 -0.60 0.00 0.00 178.31 177.80 3ksu h ASP 81 N 0.00 0.08 -0.99 2.17 3.32 -1.13 -1.68 116.42 118.19 3ksu h ASP 81 Ca -0.01 -0.12 0.10 0.00 0.02 0.00 0.00 57.03 57.02 3ksu h ASP 81 Cb 1.22 -0.02 -0.08 0.00 0.22 0.00 0.00 39.33 40.68 3ksu h ASP 81 CO 0.07 0.18 0.63 0.15 -1.72 0.00 0.00 179.24 178.54 3ksu h PHE 82 N -0.03 1.15 -0.04 4.55 3.57 -1.13 -0.93 116.94 124.08 3ksu h PHE 82 Ca 0.02 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.55 3ksu h PHE 82 Cb 0.12 -0.37 -0.00 0.00 2.79 0.00 0.00 35.95 38.49 3ksu h PHE 82 CO -0.03 0.51 0.01 0.00 -2.23 0.00 0.00 178.31 176.57 3ksu h ALA 83 N 1.50 0.05 -0.58 2.41 0.00 -1.16 -2.73 119.26 118.75 3ksu h ALA 83 Ca 0.46 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 55.22 3ksu h ALA 83 Cb 0.35 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3ksu h ALA 83 CO -0.23 -0.31 0.30 0.93 0.00 0.00 0.00 179.25 179.94 3ksu h GLU 84 N -0.19 0.81 -0.56 0.00 5.08 -1.13 -1.61 114.58 116.98 3ksu h GLU 84 Ca 0.01 -0.09 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 3ksu h GLU 84 Cb 0.27 -0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.33 3ksu h GLU 84 CO 0.00 0.61 0.15 -0.22 -1.00 0.00 0.00 179.01 178.55 3ksu h LYS 85 N 0.81 0.86 0.00 2.33 3.11 -1.06 -1.87 116.57 120.75 3ksu h LYS 85 Ca 0.21 -0.17 -0.35 0.00 -2.81 0.00 0.00 60.65 57.52 3ksu h LYS 85 Cb 0.05 -0.13 -0.07 0.00 -1.00 0.00 0.00 32.23 31.08 3ksu h LYS 85 CO -0.03 0.76 -2.24 0.39 -2.81 0.00 0.00 179.45 175.52 3ksu n GLU 86 N -4.28 0.68 0.00 1.90 1.02 -1.04 -4.67 120.64 114.24 3ksu n GLU 86 Ca 0.04 0.07 0.00 0.00 -0.02 0.00 0.00 57.16 57.25 3ksu n GLU 86 Cb 0.22 -1.58 0.00 0.00 -0.02 0.00 0.00 31.44 30.06 3ksu n GLU 86 CO 0.00 0.00 0.00 1.19 1.18 0.00 0.00 177.13 179.50 3ksu n PHE 87 N -2.84 0.00 -2.34 -0.32 3.72 -0.62 -5.12 117.46 109.94 3ksu n PHE 87 Ca -0.30 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.10 3ksu n PHE 87 Cb 1.13 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.67 3ksu n PHE 87 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3ksu n GLY 88 N 0.30 -2.14 3.66 1.37 0.00 -0.70 -4.97 105.19 102.70 3ksu n GLY 88 Ca 0.00 -1.63 -0.41 0.00 0.00 0.00 0.00 46.02 43.98 3ksu n GLY 88 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3ksu n LYS 89 N -0.12 1.66 -2.80 1.61 5.02 -1.26 -3.82 118.16 118.45 3ksu n LYS 89 Ca 0.00 0.59 -0.35 0.00 -2.02 0.00 0.00 58.31 56.53 3ksu n LYS 89 Cb 0.00 -2.22 -0.07 0.00 -0.02 0.00 0.00 35.03 32.73 3ksu n LYS 89 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3ksu s VAL 90 N -1.22 4.28 -0.15 -0.18 1.01 0.50 -4.69 120.40 119.95 3ksu s VAL 90 Ca 0.62 1.69 0.02 0.00 0.00 0.00 0.00 61.98 64.31 3ksu s VAL 90 Cb -0.54 -3.85 -0.10 0.00 0.00 0.00 0.00 36.38 31.89 3ksu s VAL 90 CO 0.58 -0.04 -0.13 0.47 0.00 0.00 0.00 175.10 175.98 3ksu n ASP 91 N 0.08 2.75 -3.82 3.32 8.00 0.06 -0.38 116.55 126.56 3ksu n ASP 91 Ca 0.04 -0.08 -0.21 0.00 0.71 0.00 0.00 54.79 55.25 3ksu n ASP 91 Cb 0.52 -0.19 -0.17 0.00 -0.02 0.00 0.00 41.12 41.25 3ksu n ASP 91 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3ksu s ILE 92 N -2.31 0.37 -0.14 0.53 1.01 -0.56 -1.03 121.20 119.08 3ksu s ILE 92 Ca -0.20 0.04 0.02 0.00 0.00 0.00 0.00 60.65 60.51 3ksu s ILE 92 Cb 0.05 -0.48 0.01 0.00 0.01 0.00 0.00 42.46 42.06 3ksu s ILE 92 CO 0.37 0.22 -0.21 0.00 0.00 0.00 0.00 174.94 175.32 3ksu s ALA 93 N 1.43 2.16 -0.20 9.38 0.00 0.36 -0.42 121.76 134.46 3ksu s ALA 93 Ca -0.03 -1.04 0.01 0.00 0.00 0.00 0.00 51.96 50.90 3ksu s ALA 93 Cb -0.13 -0.98 0.03 0.00 0.00 0.00 0.00 23.12 22.04 3ksu s ALA 93 CO -0.03 -0.06 -0.15 0.42 0.00 0.00 0.00 175.76 175.94 3ksu s ILE 94 N 0.88 1.95 -0.49 0.00 -1.09 0.17 -1.08 121.20 121.54 3ksu s ILE 94 Ca -0.06 -1.09 -0.16 0.00 -2.23 0.00 0.00 60.65 57.11 3ksu s ILE 94 Cb -0.15 -1.89 0.08 0.00 -1.58 0.00 0.00 42.46 38.92 3ksu s ILE 94 CO -0.03 0.32 0.45 0.21 -1.23 0.00 0.00 174.94 174.67 3ksu s ASN 95 N 1.29 6.17 -0.16 3.58 2.47 0.46 -0.56 114.94 128.18 3ksu s ASN 95 Ca 0.00 -1.32 0.09 0.00 0.42 0.00 0.00 52.86 52.05 3ksu s ASN 95 Cb -0.15 -2.21 -0.23 0.00 -1.45 0.00 0.00 41.25 37.21 3ksu s ASN 95 CO -0.10 -0.73 0.21 0.35 -3.72 0.00 0.00 177.10 173.12 3ksu n THR 96 N 5.28 1.54 -3.77 -5.21 -2.24 -0.99 0.10 114.28 109.00 3ksu n THR 96 Ca -0.12 -0.75 -0.13 0.00 -2.27 0.00 0.00 64.05 60.79 3ksu n THR 96 Cb 0.43 -1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 67.53 3ksu n THR 96 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3ksu s VAL 97 N -2.54 0.03 0.00 2.28 0.11 -1.24 -4.68 120.40 114.36 3ksu s VAL 97 Ca -0.16 -0.24 0.00 0.00 -2.93 0.00 0.00 61.98 58.65 3ksu s VAL 97 Cb 0.07 -0.53 0.00 0.00 -1.53 0.00 0.00 36.38 34.39 3ksu s VAL 97 CO 0.77 -0.13 0.00 0.61 -3.33 0.00 0.00 175.10 173.02 3ksu n GLY 98 N 2.11 1.05 3.77 6.54 0.00 -1.26 -4.66 105.19 112.74 3ksu n GLY 98 Ca -0.17 -1.72 -0.38 0.00 0.00 0.00 0.00 46.02 43.74 3ksu n GLY 98 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3ksu s LYS 99 N 1.65 4.67 0.72 1.61 -2.85 -1.26 -5.06 119.74 119.22 3ksu s LYS 99 Ca 0.00 1.35 -0.02 0.00 -1.00 0.00 0.00 55.97 56.29 3ksu s LYS 99 Cb 0.00 -3.05 0.12 0.00 -2.06 0.00 0.00 37.83 32.84 3ksu s LYS 99 CO 0.00 0.42 0.99 0.14 0.10 0.00 0.00 175.35 177.00 3ksu s VAL 100 N -1.38 2.20 0.13 1.79 -7.23 -1.26 -5.06 120.40 109.59 3ksu s VAL 100 Ca 0.44 -0.54 -0.30 0.00 -1.81 0.00 0.00 61.98 59.78 3ksu s VAL 100 Cb -0.22 -2.67 -0.06 0.00 0.56 0.00 0.00 36.38 33.99 3ksu s VAL 100 CO 0.27 0.00 1.00 -0.76 -0.31 0.00 0.00 175.10 175.30 3ksu s LEU 101 N -5.16 4.49 0.00 1.32 1.43 -0.11 -4.92 118.68 115.74 3ksu s LEU 101 Ca 0.65 1.87 0.11 0.00 -1.03 0.00 0.00 54.13 55.74 3ksu s LEU 101 Cb -0.06 -3.59 -0.02 0.00 0.03 0.00 0.00 46.19 42.55 3ksu s LEU 101 CO 0.44 -0.11 0.66 0.29 0.23 0.00 0.00 176.35 177.86 3ksu n LYS 102 N 2.71 2.14 -4.39 1.70 4.01 -1.26 -4.69 118.16 118.38 3ksu n LYS 102 Ca 0.03 -0.58 -0.28 0.00 -0.51 0.00 0.00 58.31 56.96 3ksu n LYS 102 Cb 0.48 -1.11 -0.12 0.00 -0.51 0.00 0.00 35.03 33.77 3ksu n LYS 102 CO 0.00 0.00 0.00 0.21 -1.11 0.00 0.00 177.40 176.50 3ksu s LYS 103 N -1.54 1.54 0.57 1.97 2.20 -1.26 -5.13 119.74 118.10 3ksu s LYS 103 Ca 0.09 -1.42 -0.20 0.00 -0.36 0.00 0.00 55.97 54.08 3ksu s LYS 103 Cb 0.09 -1.91 -0.04 0.00 -1.51 0.00 0.00 37.83 34.46 3ksu s LYS 103 CO 0.30 0.43 1.31 -2.14 -0.36 0.00 0.00 175.35 174.89 3ksu s PRO 104 N -2.42 3.00 0.29 4.03 0.02 -1.26 -4.94 135.00 133.73 3ksu s PRO 104 Ca 0.18 2.11 -0.01 0.00 0.02 0.00 0.00 61.00 63.30 3ksu s PRO 104 Cb -0.09 -2.12 0.44 0.00 0.02 0.00 0.00 34.50 32.75 3ksu s PRO 104 CO 0.09 -1.26 1.90 0.82 -0.33 0.00 0.00 177.00 178.22 3ksu h ILE 105 N 1.17 1.21 -0.37 2.83 2.04 -2.00 -2.29 117.51 120.10 3ksu h ILE 105 Ca -0.51 -0.60 0.04 0.00 1.00 0.00 0.00 64.86 64.79 3ksu h ILE 105 Cb 1.31 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 37.75 3ksu h ILE 105 CO 0.56 0.25 0.25 0.58 0.00 0.00 0.00 178.15 179.79 3ksu h VAL 106 N 0.92 1.00 -0.56 1.67 2.07 -2.03 -2.19 116.25 117.13 3ksu h VAL 106 Ca 0.23 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.63 3ksu h VAL 106 Cb 0.10 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.49 3ksu h VAL 106 CO -0.03 0.06 0.00 -0.62 0.02 0.00 0.00 177.57 177.00 3ksu n GLU 107 N -4.48 2.39 -4.82 1.57 1.02 -0.88 -4.89 120.64 110.54 3ksu n GLU 107 Ca 0.04 -2.15 -0.33 0.00 -0.02 0.00 0.00 57.16 54.70 3ksu n GLU 107 Cb 0.18 -1.48 -0.13 0.00 -0.02 0.00 0.00 31.44 29.99 3ksu n GLU 107 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3ksu s THR 108 N -1.26 3.10 0.58 2.62 2.01 -0.82 -4.95 115.64 116.93 3ksu s THR 108 Ca 0.40 -0.68 0.03 0.00 0.31 0.00 0.00 61.69 61.75 3ksu s THR 108 Cb 0.21 -2.26 0.06 0.00 0.01 0.00 0.00 72.50 70.53 3ksu s THR 108 CO 0.28 0.56 0.81 -0.94 -0.69 0.00 0.00 174.62 174.64 3ksu s SER 109 N -0.27 5.05 0.28 3.53 1.04 -1.26 -4.97 113.70 117.10 3ksu s SER 109 Ca 0.02 -0.29 0.06 0.00 0.48 0.00 0.00 55.95 56.22 3ksu s SER 109 Cb -0.13 -0.44 0.42 0.00 0.10 0.00 0.00 66.02 65.97 3ksu s SER 109 CO 0.03 -1.32 1.68 -0.08 0.98 0.00 0.00 173.24 174.53 3ksu h GLU 110 N 0.00 0.27 -0.27 4.02 4.81 -1.99 -2.49 114.58 118.93 3ksu h GLU 110 Ca -0.38 -0.13 -0.17 0.00 -0.13 0.00 0.00 59.36 58.54 3ksu h GLU 110 Cb 1.29 -0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.66 3ksu h GLU 110 CO 0.46 0.65 -0.52 0.00 -0.73 0.00 0.00 179.01 178.87 3ksu h ALA 111 N 1.33 0.57 0.00 2.92 0.00 -1.99 -2.23 119.26 119.86 3ksu h ALA 111 Ca 0.02 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3ksu h ALA 111 Cb 0.84 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.55 3ksu h ALA 111 CO 0.07 0.68 0.00 1.05 0.00 0.00 0.00 179.25 181.05 3ksu h GLU 112 N 0.61 0.00 -0.08 0.00 4.11 -1.93 -1.28 114.58 116.01 3ksu h GLU 112 Ca 0.02 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 59.32 3ksu h GLU 112 Cb 1.10 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.36 3ksu h GLU 112 CO 0.11 0.00 -0.47 0.74 0.07 0.00 0.00 179.01 179.46 3ksu h PHE 113 N 0.00 0.63 -0.34 2.06 0.04 -1.43 -2.93 116.94 114.96 3ksu h PHE 113 Ca 0.00 -0.29 -0.08 0.00 2.80 0.00 0.00 57.97 60.41 3ksu h PHE 113 Cb 0.91 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.95 3ksu h PHE 113 CO 0.00 1.06 -0.12 0.22 -0.60 0.00 0.00 178.31 178.87 3ksu h ASP 114 N 0.02 0.58 -0.07 2.17 1.82 -1.33 -1.89 116.42 117.71 3ksu h ASP 114 Ca -0.04 -0.16 -0.09 0.00 -0.39 0.00 0.00 57.03 56.36 3ksu h ASP 114 Cb 1.13 -0.15 -0.01 0.00 0.68 0.00 0.00 39.33 40.97 3ksu h ASP 114 CO 0.10 0.73 -0.23 0.00 -1.61 0.00 0.00 179.24 178.23 3ksu h ALA 115 N 1.33 1.13 -0.12 -0.78 0.00 -1.32 -1.97 119.26 117.52 3ksu h ALA 115 Ca 0.10 -0.33 -0.11 0.00 0.00 0.00 0.00 54.91 54.57 3ksu h ALA 115 Cb 0.52 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3ksu h ALA 115 CO 0.03 0.55 -0.41 0.52 0.00 0.00 0.00 179.25 179.94 3ksu h MET 116 N 0.43 0.27 -0.48 0.00 2.86 -1.25 -2.77 114.93 114.00 3ksu h MET 116 Ca 0.07 -0.13 -0.11 0.00 -2.06 0.00 0.00 59.70 57.47 3ksu h MET 116 Cb 0.63 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.28 3ksu h MET 116 CO 0.05 0.64 -0.13 -0.44 1.06 0.00 0.00 176.91 178.09 3ksu h ASP 117 N 0.23 0.94 -0.67 1.22 3.32 -1.05 -2.28 116.42 118.13 3ksu h ASP 117 Ca 0.02 -0.37 -0.03 0.00 0.02 0.00 0.00 57.03 56.67 3ksu h ASP 117 Cb 0.83 -0.26 -0.03 0.00 0.22 0.00 0.00 39.33 40.09 3ksu h ASP 117 CO 0.07 1.09 0.30 0.74 -1.72 0.00 0.00 179.24 179.71 3ksu h THR 118 N 0.77 1.23 0.05 0.35 2.02 -1.27 0.20 112.91 116.27 3ksu h THR 118 Ca 0.12 -0.69 -0.00 0.00 0.77 0.00 0.00 66.41 66.61 3ksu h THR 118 Cb 0.68 0.44 0.00 0.00 -1.74 0.00 0.00 68.15 67.54 3ksu h THR 118 CO 0.05 0.28 -0.03 0.40 0.37 0.00 0.00 175.52 176.59 3ksu h ILE 119 N 0.94 1.06 -0.58 3.11 2.04 -1.51 -2.14 117.51 120.43 3ksu h ILE 119 Ca 0.23 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.70 3ksu h ILE 119 Cb 0.16 1.29 -0.03 0.00 -0.74 0.00 0.00 36.82 37.50 3ksu h ILE 119 CO -0.02 0.09 0.23 0.78 0.00 0.00 0.00 178.15 179.22 3ksu h ASN 120 N -0.23 0.76 -0.50 1.72 2.35 -1.17 -1.36 115.58 117.15 3ksu h ASN 120 Ca -0.01 -0.10 -0.07 0.00 -0.55 0.00 0.00 56.30 55.58 3ksu h ASN 120 Cb 0.20 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.35 3ksu h ASN 120 CO 0.01 0.69 0.08 0.78 -1.65 0.00 0.00 177.43 177.34 3ksu h ASN 121 N 0.82 0.85 -0.15 5.81 2.35 -0.60 -1.42 115.58 123.24 3ksu h ASN 121 Ca 0.20 -0.19 -0.04 0.00 -0.55 0.00 0.00 56.30 55.72 3ksu h ASN 121 Cb 0.17 -0.22 -0.00 0.00 0.05 0.00 0.00 38.32 38.31 3ksu h ASN 121 CO -0.02 0.87 -0.04 0.50 -1.65 0.00 0.00 177.43 177.08 3ksu h LYS 122 N 0.84 0.30 -0.83 0.81 3.64 -0.79 -1.94 116.57 118.61 3ksu h LYS 122 Ca 0.17 -0.12 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 3ksu h LYS 122 Cb 0.39 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.16 3ksu h LYS 122 CO 0.01 0.59 0.49 0.28 -2.27 0.00 0.00 179.45 178.55 3ksu h VAL 123 N -0.01 1.23 -0.46 2.00 2.07 -1.26 -1.43 116.25 118.39 3ksu h VAL 123 Ca 0.04 -0.52 -0.13 0.00 0.82 0.00 0.00 66.70 66.91 3ksu h VAL 123 Cb 0.48 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.32 3ksu h VAL 123 CO 0.02 0.25 -0.21 0.00 0.02 0.00 0.00 177.57 177.64 3ksu h ALA 124 N 1.39 0.75 -0.41 1.67 0.00 -1.19 0.26 119.26 121.73 3ksu h ALA 124 Ca 0.30 -0.39 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3ksu h ALA 124 Cb -0.03 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3ksu h ALA 124 CO -0.05 0.66 0.26 -0.92 0.00 0.00 0.00 179.25 179.20 3ksu h TYR 125 N 0.81 0.48 -0.31 0.00 3.20 -1.11 -2.21 116.97 117.83 3ksu h TYR 125 Ca 0.11 0.01 -0.08 0.00 3.14 0.00 0.00 58.73 61.91 3ksu h TYR 125 Cb 0.77 -0.16 -0.02 0.00 1.54 0.00 0.00 36.73 38.87 3ksu h TYR 125 CO 0.05 0.30 -0.15 0.74 -1.64 0.00 0.00 178.16 177.45 3ksu h PHE 126 N 0.52 0.58 -0.01 -3.82 0.05 -0.99 -2.11 116.94 111.17 3ksu h PHE 126 Ca 0.15 -0.10 -0.00 0.00 3.82 0.00 0.00 57.97 61.84 3ksu h PHE 126 Cb -0.03 -0.15 -0.00 0.00 2.00 0.00 0.00 35.95 37.76 3ksu h PHE 126 CO -0.06 0.66 0.00 0.35 -0.18 0.00 0.00 178.31 179.09 3ksu h PHE 127 N 0.49 0.01 -0.05 -0.55 3.57 -0.30 0.48 116.94 120.60 3ksu h PHE 127 Ca 0.09 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.60 3ksu h PHE 127 Cb 0.55 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.27 3ksu h PHE 127 CO 0.02 0.07 -0.01 0.82 -2.23 0.00 0.00 178.31 176.98 3ksu h ILE 128 N -0.05 0.95 -0.42 1.41 2.04 -1.34 -0.09 117.51 120.00 3ksu h ILE 128 Ca 0.00 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.90 3ksu h ILE 128 Cb 0.06 0.95 -0.04 0.00 -0.74 0.00 0.00 36.82 37.05 3ksu h ILE 128 CO -0.00 0.00 0.21 0.50 0.00 0.00 0.00 178.15 178.86 3ksu h LYS 129 N -0.00 0.41 0.00 2.37 3.64 -1.26 -2.70 116.57 119.02 3ksu h LYS 129 Ca 0.03 -0.02 -0.13 0.00 -1.27 0.00 0.00 60.65 59.25 3ksu h LYS 129 Cb 0.04 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 3ksu h LYS 129 CO -0.05 0.27 -0.61 1.96 -2.27 0.00 0.00 179.45 178.74 3ksu h GLN 130 N 0.42 0.00 0.12 1.90 1.08 -0.77 -3.14 115.11 114.72 3ksu h GLN 130 Ca 0.18 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.38 3ksu h GLN 130 Cb 0.09 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.53 3ksu h GLN 130 CO -0.13 0.61 -0.06 0.00 -0.95 0.00 0.00 178.83 178.30 3ksu h ALA 131 N 1.39 -0.16 -0.55 3.87 0.00 -0.90 -3.21 119.26 119.70 3ksu h ALA 131 Ca -0.01 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 54.82 3ksu h ALA 131 Cb 1.38 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 19.20 3ksu h ALA 131 CO 0.08 -0.50 0.37 0.00 0.00 0.00 0.00 179.25 179.19 3ksu h ALA 132 N 0.52 1.72 0.00 0.00 0.00 -1.51 -1.40 119.26 118.59 3ksu h ALA 132 Ca -0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3ksu h ALA 132 Cb 0.28 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.89 3ksu h ALA 132 CO 0.03 0.22 0.00 1.17 0.00 0.00 0.00 179.25 180.67 3ksu n LYS 133 N -4.47 0.01 -0.27 0.00 4.81 -1.19 -2.90 118.16 114.15 3ksu n LYS 133 Ca 0.06 0.11 0.08 0.00 -0.87 0.00 0.00 58.31 57.69 3ksu n LYS 133 Cb 0.13 -1.51 0.14 0.00 0.02 0.00 0.00 35.03 33.81 3ksu n LYS 133 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 3ksu n HIS 134 N -1.52 0.00 -5.06 5.64 8.25 -0.56 -5.07 115.22 116.90 3ksu n HIS 134 Ca 0.06 -1.00 -0.32 0.00 -0.26 0.00 0.00 57.72 56.20 3ksu n HIS 134 Cb 0.27 -0.16 -0.14 0.00 1.12 0.00 0.00 29.99 31.08 3ksu n HIS 134 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 3ksu s MET 135 N -2.59 2.33 0.75 -0.41 0.00 -1.00 -0.37 119.30 118.00 3ksu s MET 135 Ca 0.30 -0.80 -0.13 0.00 0.00 0.00 0.00 55.69 55.06 3ksu s MET 135 Cb 0.28 -2.23 0.05 0.00 0.00 0.00 0.00 34.83 32.92 3ksu s MET 135 CO -0.00 0.60 1.14 -0.80 0.00 0.00 0.00 175.02 175.95 3ksu s ASN 136 N -0.70 4.32 0.86 1.11 0.01 0.49 -4.85 114.94 116.18 3ksu s ASN 136 Ca 0.11 2.09 -0.11 0.00 -0.71 0.00 0.00 52.86 54.24 3ksu s ASN 136 Cb -0.10 -2.56 0.11 0.00 0.41 0.00 0.00 41.25 39.11 3ksu s ASN 136 CO -0.00 -2.17 1.14 -2.84 -1.51 0.00 0.00 177.10 171.73 3ksu s PRO 137 N -4.33 1.41 -1.47 -0.60 0.02 -1.26 -3.28 135.00 125.49 3ksu s PRO 137 Ca 0.68 1.51 0.00 0.00 0.02 0.00 0.00 61.00 63.20 3ksu s PRO 137 Cb -0.23 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.52 3ksu s PRO 137 CO 0.49 -2.34 0.00 0.09 -0.33 0.00 0.00 177.00 174.91 3ksu n ASN 138 N -3.89 -4.77 -4.94 2.53 5.03 -0.94 -5.02 115.26 103.26 3ksu n ASN 138 Ca 0.12 0.15 -0.24 0.00 0.87 0.00 0.00 54.58 55.48 3ksu n ASN 138 Cb 0.52 -3.79 0.04 0.00 -1.02 0.00 0.00 39.78 35.54 3ksu n ASN 138 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 3ksu s GLY 139 N -2.52 1.71 -0.08 7.41 0.00 -1.21 -4.89 107.32 107.73 3ksu s GLY 139 Ca 0.00 -1.03 0.01 0.00 0.00 0.00 0.00 44.72 43.70 3ksu s GLY 139 CO 0.00 -0.71 -0.09 0.30 0.00 0.00 0.00 173.10 172.60 3ksu s HIS 140 N -2.96 1.33 -0.13 1.90 3.76 -0.20 -0.36 115.29 118.63 3ksu s HIS 140 Ca 0.57 -0.56 -0.02 0.00 -0.15 0.00 0.00 55.06 54.90 3ksu s HIS 140 Cb -0.10 -1.07 -0.02 0.00 1.11 0.00 0.00 32.58 32.49 3ksu s HIS 140 CO 0.42 -0.37 -0.07 0.42 -0.85 0.00 0.00 174.74 174.29 3ksu s ILE 141 N 1.22 3.63 -0.06 0.60 1.01 0.18 -0.49 121.20 127.28 3ksu s ILE 141 Ca -0.05 -0.46 -0.00 0.00 0.00 0.00 0.00 60.65 60.14 3ksu s ILE 141 Cb -0.14 -2.56 0.03 0.00 0.01 0.00 0.00 42.46 39.80 3ksu s ILE 141 CO -0.02 0.52 -0.01 -0.63 0.00 0.00 0.00 174.94 174.79 3ksu s ILE 142 N 0.18 0.42 -0.14 2.92 1.01 -0.24 -1.04 121.20 124.32 3ksu s ILE 142 Ca -0.04 0.04 -0.03 0.00 0.00 0.00 0.00 60.65 60.62 3ksu s ILE 142 Cb -0.14 -0.53 -0.03 0.00 0.01 0.00 0.00 42.46 41.77 3ksu s ILE 142 CO 0.03 0.24 -0.03 -0.89 0.00 0.00 0.00 174.94 174.30 3ksu s THR 143 N 1.58 3.95 -0.46 2.92 2.01 -0.87 -0.41 115.64 124.37 3ksu s THR 143 Ca -0.01 -0.35 -0.23 0.00 0.31 0.00 0.00 61.69 61.41 3ksu s THR 143 Cb -0.13 -2.71 0.03 0.00 0.01 0.00 0.00 72.50 69.70 3ksu s THR 143 CO -0.04 0.52 0.79 -0.63 -0.69 0.00 0.00 174.62 174.57 3ksu s ILE 144 N 0.04 4.64 -0.50 1.82 -1.09 0.12 -1.75 121.20 124.48 3ksu s ILE 144 Ca 0.01 0.39 -0.22 0.00 -2.23 0.00 0.00 60.65 58.59 3ksu s ILE 144 Cb -0.13 -4.33 0.04 0.00 -1.58 0.00 0.00 42.46 36.45 3ksu s ILE 144 CO 0.03 -0.74 0.79 0.00 -1.23 0.00 0.00 174.94 173.79 3ksu s ALA 145 N 3.30 3.27 0.02 9.38 0.00 0.35 -4.80 121.76 133.28 3ksu s ALA 145 Ca 0.29 -1.26 0.06 0.00 0.00 0.00 0.00 51.96 51.06 3ksu s ALA 145 Cb -0.12 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.46 3ksu s ALA 145 CO 0.22 -2.09 -0.17 0.95 0.00 0.00 0.00 175.76 174.67 3ksu s THR 146 N 3.34 1.38 -0.16 0.00 -4.23 -1.26 -4.07 115.64 110.64 3ksu s THR 146 Ca 0.26 -0.96 0.01 0.00 -1.18 0.00 0.00 61.69 59.83 3ksu s THR 146 Cb -0.14 -1.19 0.01 0.00 1.34 0.00 0.00 72.50 72.51 3ksu s THR 146 CO 0.19 0.22 -0.18 -0.55 -0.54 0.00 0.00 174.62 173.76 3ksu s SER 147 N -0.86 3.40 0.24 3.99 0.15 -1.26 -5.01 113.70 114.34 3ksu s SER 147 Ca 0.05 -0.55 0.00 0.00 0.70 0.00 0.00 55.95 56.16 3ksu s SER 147 Cb -0.08 -1.51 0.27 0.00 -1.71 0.00 0.00 66.02 62.99 3ksu s SER 147 CO 0.01 0.06 1.62 -0.07 1.20 0.00 0.00 173.24 176.06 3ksu h LEU 148 N 7.46 0.53 -0.31 3.45 3.38 -1.96 -1.86 115.31 126.00 3ksu h LEU 148 Ca -0.35 -0.23 -0.12 0.00 0.09 0.00 0.00 57.88 57.28 3ksu h LEU 148 Cb 1.18 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 3ksu h LEU 148 CO 0.58 0.87 -0.26 0.25 0.09 0.00 0.00 178.44 179.97 3ksu h LEU 149 N 0.42 0.76 -1.03 1.67 5.85 -1.95 -2.43 115.31 118.60 3ksu h LEU 149 Ca 0.04 -0.45 -0.09 0.00 0.84 0.00 0.00 57.88 58.22 3ksu h LEU 149 Cb 0.86 -0.21 -0.01 0.00 0.37 0.00 0.00 40.66 41.67 3ksu h LEU 149 CO 0.07 1.05 -0.24 0.00 -0.34 0.00 0.00 178.44 178.99 3ksu h ALA 150 N 0.73 1.19 -0.09 1.25 0.00 -1.82 -1.42 119.26 119.09 3ksu h ALA 150 Ca 0.06 -0.32 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 3ksu h ALA 150 Cb 0.82 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 3ksu h ALA 150 CO 0.07 0.52 -0.49 0.00 0.00 0.00 0.00 179.25 179.35 3ksu h ALA 151 N 1.39 1.01 0.06 0.00 0.00 -1.34 0.12 119.26 120.51 3ksu h ALA 151 Ca 0.06 -0.46 -0.22 0.00 0.00 0.00 0.00 54.91 54.28 3ksu h ALA 151 Cb 0.62 -0.09 0.02 0.00 0.00 0.00 0.00 17.79 18.34 3ksu h ALA 151 CO 0.04 0.65 -0.91 -0.92 0.00 0.00 0.00 179.25 178.11 3ksu h TYR 152 N 0.19 0.79 0.00 0.00 3.20 -1.11 -3.32 116.97 116.72 3ksu h TYR 152 Ca 0.01 -0.48 0.00 0.00 3.14 0.00 0.00 58.73 61.40 3ksu h TYR 152 Cb 0.93 -0.07 0.00 0.00 1.54 0.00 0.00 36.73 39.13 3ksu h TYR 152 CO 0.02 1.32 -0.63 1.79 -1.64 0.00 0.00 178.16 179.02 3ksu h THR 153 N 0.04 0.00 0.00 1.81 1.35 -1.34 -3.48 112.91 111.29 3ksu h THR 153 Ca -0.13 -0.91 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 3ksu h THR 153 Cb 1.62 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 69.62 3ksu h THR 153 CO 0.18 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.06 3ksu n GLY 154 N 1.18 0.86 3.16 5.82 0.00 -0.03 -4.99 105.19 111.20 3ksu n GLY 154 Ca 0.02 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.61 3ksu n GLY 154 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ksu n PHE 155 N -2.00 4.08 -3.10 1.61 3.72 -0.82 -4.66 117.46 116.29 3ksu n PHE 155 Ca 0.00 -2.95 -0.39 0.00 -0.05 0.00 0.00 57.45 54.06 3ksu n PHE 155 Cb 0.00 -2.48 -0.06 0.00 -0.94 0.00 0.00 39.48 36.00 3ksu n PHE 155 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 3ksu s TYR 156 N 3.12 3.78 0.24 1.38 1.51 -1.25 -4.72 117.35 121.40 3ksu s TYR 156 Ca 0.48 1.41 -0.06 0.00 -1.01 0.00 0.00 57.07 57.89 3ksu s TYR 156 Cb 0.08 -2.69 -0.06 0.00 -0.11 0.00 0.00 41.96 39.18 3ksu s TYR 156 CO -0.00 0.42 0.51 -1.54 -1.11 0.00 0.00 175.55 173.83 3ksu s SER 157 N -0.59 6.51 -0.21 2.29 1.04 -1.26 -4.92 113.70 116.56 3ksu s SER 157 Ca 0.34 0.74 0.19 0.00 0.48 0.00 0.00 55.95 57.70 3ksu s SER 157 Cb -0.20 -2.15 0.48 0.00 0.10 0.00 0.00 66.02 64.24 3ksu s SER 157 CO 0.22 -0.10 1.15 1.07 0.98 0.00 0.00 173.24 176.55 3ksu n THR 158 N -0.46 1.36 0.00 2.02 5.66 -1.26 -5.05 114.28 116.55 3ksu n THR 158 Ca -0.01 -2.83 0.00 0.00 -3.05 0.00 0.00 64.05 58.15 3ksu n THR 158 Cb 0.53 0.59 0.00 0.00 -1.55 0.00 0.00 70.33 69.90 3ksu n THR 158 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 3ksu n ALA 164 N -0.44 0.00 -0.14 1.79 0.00 -1.26 -5.03 120.51 115.43 3ksu n ALA 164 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.53 3ksu n ALA 164 Cb 0.90 0.00 0.02 0.00 0.00 0.00 0.00 19.45 20.37 3ksu n ALA 164 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3ksu h PRO 165 N 0.00 0.46 -0.22 0.00 0.11 -2.01 -2.66 132.00 127.68 3ksu h PRO 165 Ca 0.00 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 66.00 3ksu h PRO 165 Cb 0.00 -0.10 -0.01 0.00 0.11 0.00 0.00 31.00 30.99 3ksu h PRO 165 CO 0.00 0.31 -0.20 0.28 -0.21 0.00 0.00 178.00 178.18 3ksu h VAL 166 N 0.48 1.24 -0.46 3.15 2.07 -1.98 0.12 116.25 120.86 3ksu h VAL 166 Ca 0.18 -1.10 -0.06 0.00 0.82 0.00 0.00 66.70 66.53 3ksu h VAL 166 Cb 0.05 1.30 -0.02 0.00 -1.52 0.00 0.00 31.29 31.09 3ksu h VAL 166 CO -0.10 0.35 0.04 -0.33 0.02 0.00 0.00 177.57 177.55 3ksu h GLU 167 N 0.35 0.73 -0.20 1.57 5.08 -1.96 -0.63 114.58 119.53 3ksu h GLU 167 Ca 0.06 -0.17 -0.12 0.00 -1.00 0.00 0.00 59.36 58.13 3ksu h GLU 167 Cb 0.56 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 3ksu h GLU 167 CO 0.04 0.72 -0.33 1.25 -1.00 0.00 0.00 179.01 179.69 3ksu h HIS 168 N 0.69 0.72 -0.42 4.33 -0.00 -0.99 -2.76 115.15 116.74 3ksu h HIS 168 Ca 0.14 -0.25 -0.07 0.00 -0.00 0.00 0.00 60.37 60.20 3ksu h HIS 168 Cb 0.37 -0.14 -0.02 0.00 -0.00 0.00 0.00 27.41 27.62 3ksu h HIS 168 CO 0.02 0.98 -0.02 1.88 -0.00 0.00 0.00 177.93 180.79 3ksu h TYR 169 N 0.25 0.72 -0.45 5.26 0.05 -0.68 -2.10 116.97 120.03 3ksu h TYR 169 Ca 0.02 -0.09 -0.05 0.00 0.05 0.00 0.00 58.73 58.65 3ksu h TYR 169 Cb 0.92 -0.20 -0.02 0.00 1.01 0.00 0.00 36.73 38.44 3ksu h TYR 169 CO 0.09 0.69 0.06 1.15 -1.05 0.00 0.00 178.16 179.10 3ksu h THR 170 N 0.64 1.25 -0.06 -2.88 2.02 -1.14 -0.99 112.91 111.74 3ksu h THR 170 Ca 0.13 -0.91 -0.20 0.00 0.77 0.00 0.00 66.41 66.20 3ksu h THR 170 Cb 0.42 0.98 0.01 0.00 -1.74 0.00 0.00 68.15 67.82 3ksu h THR 170 CO 0.02 0.32 -0.74 -0.09 0.37 0.00 0.00 175.52 175.40 3ksu h ARG 171 N 0.60 0.61 -0.36 6.66 9.65 -1.39 -2.18 114.38 127.98 3ksu h ARG 171 Ca 0.13 -0.57 -0.13 0.00 -1.10 0.00 0.00 59.98 58.31 3ksu h ARG 171 Cb 0.39 0.14 -0.01 0.00 -1.39 0.00 0.00 29.97 29.11 3ksu h ARG 171 CO 0.01 1.19 -0.30 0.00 2.80 0.00 0.00 179.97 183.67 3ksu h ALA 172 N 0.44 0.80 -0.00 2.80 0.00 -1.42 -2.86 119.26 119.01 3ksu h ALA 172 Ca -0.07 -0.41 -0.16 0.00 0.00 0.00 0.00 54.91 54.26 3ksu h ALA 172 Cb 1.40 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 3ksu h ALA 172 CO 0.15 0.65 -0.77 0.00 0.00 0.00 0.00 179.25 179.27 3ksu h ALA 173 N 1.01 0.72 -0.32 0.00 0.00 -1.20 -2.57 119.26 116.90 3ksu h ALA 173 Ca 0.07 -0.69 -0.12 0.00 0.00 0.00 0.00 54.91 54.17 3ksu h ALA 173 Cb 0.83 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 3ksu h ALA 173 CO 0.07 0.94 -0.29 0.66 0.00 0.00 0.00 179.25 180.62 3ksu h SER 174 N 0.02 0.68 -0.44 0.00 4.64 -1.38 -1.91 113.55 115.15 3ksu h SER 174 Ca -0.01 -0.26 -0.04 0.00 -0.47 0.00 0.00 61.79 61.01 3ksu h SER 174 Cb 1.36 -0.19 -0.02 0.00 -0.31 0.00 0.00 62.40 63.24 3ksu h SER 174 CO 0.10 0.94 0.13 0.11 -0.87 0.00 0.00 176.83 177.24 3ksu h LYS 175 N 0.57 0.69 0.00 4.77 1.57 -1.47 -2.92 116.57 119.78 3ksu h LYS 175 Ca 0.07 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.64 3ksu h LYS 175 Cb 0.79 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.99 3ksu h LYS 175 CO 0.06 0.67 -0.25 0.93 -0.57 0.00 0.00 179.45 180.30 3ksu h GLU 176 N 0.58 0.00 -0.56 3.15 4.39 -1.36 -3.15 114.58 117.63 3ksu h GLU 176 Ca 0.14 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.84 3ksu h GLU 176 Cb 0.27 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.92 3ksu h GLU 176 CO -0.00 0.25 0.00 1.28 -1.16 0.00 0.00 179.01 179.38 3ksu n LEU 177 N -3.35 3.87 -0.11 1.33 4.77 -0.73 -4.50 117.00 118.29 3ksu n LEU 177 Ca 0.01 -2.20 -0.07 0.00 -0.03 0.00 0.00 56.01 53.71 3ksu n LEU 177 Cb 0.48 -0.44 0.01 0.00 -2.33 0.00 0.00 43.42 41.14 3ksu n LEU 177 CO 0.34 0.84 0.99 -0.03 -1.33 0.00 0.00 177.39 178.20 3ksu h MET 178 N 3.36 0.39 -0.68 3.23 4.05 -1.47 0.37 114.93 124.18 3ksu h MET 178 Ca 0.00 -0.02 -0.08 0.00 -0.28 0.00 0.00 59.70 59.32 3ksu h MET 178 Cb 1.08 -0.09 -0.03 0.00 -0.80 0.00 0.00 31.60 31.76 3ksu h MET 178 CO 0.08 0.26 0.12 -0.22 0.23 0.00 0.00 176.91 177.37 3ksu h LYS 179 N 0.40 1.12 0.00 0.39 1.63 -1.83 -2.03 116.57 116.24 3ksu h LYS 179 Ca 0.16 -0.29 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 3ksu h LYS 179 Cb 0.05 -0.13 0.00 0.00 -0.60 0.00 0.00 32.23 31.55 3ksu h LYS 179 CO -0.10 1.01 0.00 0.94 -3.45 0.00 0.00 179.45 177.86 3ksu n GLN 180 N -4.21 0.06 -3.12 1.90 -0.06 -1.00 -4.92 117.38 106.03 3ksu n GLN 180 Ca 0.05 0.09 -0.17 0.00 -2.00 0.00 0.00 57.00 54.96 3ksu n GLN 180 Cb 0.29 -1.50 0.05 0.00 -4.06 0.00 0.00 30.24 25.02 3ksu n GLN 180 CO 0.00 0.00 0.00 1.04 -0.20 0.00 0.00 177.06 177.90 3ksu n GLN 181 N -1.46 -5.03 -3.55 3.69 6.02 0.03 -4.10 117.38 112.98 3ksu n GLN 181 Ca 0.07 0.64 -0.37 0.00 -0.01 0.00 0.00 57.00 57.33 3ksu n GLN 181 Cb 0.26 -5.04 -0.09 0.00 1.02 0.00 0.00 30.24 26.39 3ksu n GLN 181 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 3ksu s ILE 182 N -3.15 5.29 0.09 5.09 -1.09 -0.64 -2.22 121.20 124.58 3ksu s ILE 182 Ca 0.35 0.35 -0.31 0.00 -2.23 0.00 0.00 60.65 58.81 3ksu s ILE 182 Cb -0.16 -3.58 -0.07 0.00 -1.58 0.00 0.00 42.46 37.07 3ksu s ILE 182 CO 0.44 0.28 1.36 -0.44 -1.23 0.00 0.00 174.94 175.35 3ksu s SER 183 N 1.25 6.87 -0.20 3.58 0.01 0.52 -4.61 113.70 121.11 3ksu s SER 183 Ca 0.11 2.26 0.01 0.00 1.31 0.00 0.00 55.95 59.63 3ksu s SER 183 Cb -0.14 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.55 3ksu s SER 183 CO 0.07 -0.63 -0.09 -0.69 0.41 0.00 0.00 173.24 172.31 3ksu s VAL 184 N 1.23 1.60 0.26 3.43 1.01 -1.26 0.48 120.40 127.14 3ksu s VAL 184 Ca 0.64 -1.02 0.02 0.00 0.00 0.00 0.00 61.98 61.62 3ksu s VAL 184 Cb -0.35 -1.71 -0.05 0.00 0.00 0.00 0.00 36.38 34.27 3ksu s VAL 184 CO 0.30 0.13 0.07 0.20 0.00 0.00 0.00 175.10 175.80 3ksu s ASN 185 N 1.41 1.42 0.03 3.32 0.01 -0.20 -1.35 114.94 119.57 3ksu s ASN 185 Ca -0.02 -1.35 0.01 0.00 -0.71 0.00 0.00 52.86 50.79 3ksu s ASN 185 Cb -0.17 0.11 -0.02 0.00 0.41 0.00 0.00 41.25 41.58 3ksu s ASN 185 CO -0.08 -0.68 -0.05 0.00 -1.51 0.00 0.00 177.10 174.79 3ksu s ALA 186 N -3.65 0.31 -0.13 0.60 0.00 0.73 -2.05 121.76 117.57 3ksu s ALA 186 Ca 0.35 -0.65 0.03 0.00 0.00 0.00 0.00 51.96 51.69 3ksu s ALA 186 Cb 0.08 0.10 0.01 0.00 0.00 0.00 0.00 23.12 23.30 3ksu s ALA 186 CO 0.13 -0.10 -0.22 0.42 0.00 0.00 0.00 175.76 175.99 3ksu s ILE 187 N -1.39 2.02 -0.42 0.00 1.01 -0.72 -0.20 121.20 121.51 3ksu s ILE 187 Ca -0.13 -0.96 -0.06 0.00 0.00 0.00 0.00 60.65 59.50 3ksu s ILE 187 Cb -0.10 -1.78 0.10 0.00 0.01 0.00 0.00 42.46 40.70 3ksu s ILE 187 CO -0.00 0.54 0.24 0.00 0.00 0.00 0.00 174.94 175.72 3ksu s ALA 188 N 0.73 3.23 0.67 9.38 0.00 0.13 -0.49 121.76 135.40 3ksu s ALA 188 Ca -0.09 -2.43 -0.14 0.00 0.00 0.00 0.00 51.96 49.29 3ksu s ALA 188 Cb -0.16 -2.54 0.00 0.00 0.00 0.00 0.00 23.12 20.42 3ksu s ALA 188 CO 0.00 -1.78 1.10 -2.14 0.00 0.00 0.00 175.76 172.95 3ksu s PRO 189 N 1.26 2.77 0.17 0.00 0.02 -1.26 -1.85 135.00 136.10 3ksu s PRO 189 Ca 0.06 1.35 -0.03 0.00 0.02 0.00 0.00 61.00 62.40 3ksu s PRO 189 Cb -0.24 -1.95 0.04 0.00 0.02 0.00 0.00 34.50 32.37 3ksu s PRO 189 CO -0.02 -1.27 0.18 0.41 -0.33 0.00 0.00 177.00 175.97 3ksu n GLY 190 N -0.65 -1.84 3.63 0.52 0.00 -0.92 -4.86 105.19 101.06 3ksu n GLY 190 Ca 0.10 -1.56 -0.48 0.00 0.00 0.00 0.00 46.02 44.08 3ksu n GLY 190 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3ksu n PRO 191 N -1.72 1.69 -4.66 1.61 -0.02 -1.26 -4.55 135.00 126.10 3ksu n PRO 191 Ca 0.02 0.61 -0.30 0.00 -2.02 0.00 0.00 63.50 61.81 3ksu n PRO 191 Cb 0.09 -2.26 -0.09 0.00 -0.02 0.00 0.00 33.50 31.21 3ksu n PRO 191 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3ksu s MET 192 N 0.21 2.09 0.45 -0.52 -1.94 -1.26 -0.53 119.30 117.81 3ksu s MET 192 Ca 0.76 -2.25 -0.24 0.00 -1.71 0.00 0.00 55.69 52.25 3ksu s MET 192 Cb -0.77 -1.61 -0.07 0.00 2.01 0.00 0.00 34.83 34.39 3ksu s MET 192 CO 0.46 -0.22 1.27 0.34 -0.01 0.00 0.00 175.02 176.86 3ksu s ASP 193 N -3.81 6.03 0.38 3.03 3.68 -1.26 -4.93 116.67 119.79 3ksu s ASP 193 Ca 0.20 2.57 0.15 0.00 2.13 0.00 0.00 52.55 57.60 3ksu s ASP 193 Cb 0.05 -2.63 1.00 0.00 -1.45 0.00 0.00 42.92 39.89 3ksu s ASP 193 CO 0.11 -1.03 1.81 0.74 0.13 0.00 0.00 175.17 176.93 3ksu h THR 194 N 2.05 0.65 -1.00 1.71 2.02 -2.01 -2.86 112.91 113.46 3ksu h THR 194 Ca -0.50 -0.17 0.22 0.00 0.77 0.00 0.00 66.41 66.73 3ksu h THR 194 Cb 1.26 0.10 -0.11 0.00 -1.74 0.00 0.00 68.15 67.67 3ksu h THR 194 CO 0.61 0.09 0.62 0.77 0.37 0.00 0.00 175.52 177.97 3ksu h SER 195 N 0.50 0.67 0.56 4.18 4.64 -1.99 -2.27 113.55 119.85 3ksu h SER 195 Ca 0.53 0.10 -0.06 0.00 -0.47 0.00 0.00 61.79 61.89 3ksu h SER 195 Cb 1.18 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.25 3ksu h SER 195 CO -0.26 0.19 -0.30 -0.26 -0.87 0.00 0.00 176.83 175.33 3ksu h PHE 196 N 0.63 0.00 -0.00 4.77 -1.00 -1.89 0.08 116.94 119.53 3ksu h PHE 196 Ca 0.59 0.00 0.00 0.00 2.81 0.00 0.00 57.97 61.37 3ksu h PHE 196 Cb 1.10 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.66 3ksu h PHE 196 CO -0.00 0.30 -0.42 1.19 -1.61 0.00 0.00 178.31 177.77 3ksu n PHE 197 N -3.74 0.00 0.59 -0.55 3.72 -0.86 -2.36 117.46 114.25 3ksu n PHE 197 Ca -0.01 0.00 0.11 0.00 -0.05 0.00 0.00 57.45 57.50 3ksu n PHE 197 Cb 0.40 -0.25 0.01 0.00 -0.94 0.00 0.00 39.48 38.70 3ksu n PHE 197 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3ksu n TYR 198 N -1.38 0.23 -2.25 1.38 4.01 -0.97 -0.93 117.16 117.25 3ksu n TYR 198 Ca 0.07 0.07 -0.04 0.00 -0.16 0.00 0.00 57.90 57.84 3ksu n TYR 198 Cb 0.34 -0.40 0.02 0.00 -0.31 0.00 0.00 39.34 38.98 3ksu n TYR 198 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3ksu n GLY 199 N 1.38 -0.34 0.62 2.72 0.00 -0.10 -4.61 105.19 104.87 3ksu n GLY 199 Ca 0.02 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3ksu n GLY 199 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 3ksu n GLN 200 N -1.86 0.00 0.00 1.61 7.27 -0.51 -5.01 117.38 118.88 3ksu n GLN 200 Ca -0.02 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.05 3ksu n GLN 200 Cb 0.53 -0.16 0.00 0.00 2.41 0.00 0.00 30.24 33.02 3ksu n GLN 200 CO 0.00 0.00 0.00 -1.91 0.07 0.00 0.00 177.06 175.22 3ksu n GLU 201 N -2.41 1.76 -1.38 3.69 0.00 -1.26 -4.89 120.64 116.14 3ksu n GLU 201 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 3ksu n GLU 201 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31.44 31.44 3ksu n GLU 201 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3ksu n MET 214 N -0.22 -3.69 -3.60 5.31 -0.00 -1.26 -4.74 117.12 108.93 3ksu n MET 214 Ca 0.00 2.84 -0.23 0.00 -0.00 0.00 0.00 57.70 60.31 3ksu n MET 214 Cb 0.00 -3.49 0.00 0.00 -0.00 0.00 0.00 33.22 29.74 3ksu n MET 214 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3ksu s GLY 215 N -4.76 2.16 -0.23 3.17 0.00 -1.26 -5.13 107.32 101.27 3ksu s GLY 215 Ca 0.00 -1.64 0.02 0.00 0.00 0.00 0.00 44.72 43.10 3ksu s GLY 215 CO 0.00 -1.81 -0.12 -1.31 0.00 0.00 0.00 173.10 169.86 3ksu s ASN 216 N -4.32 3.98 -0.19 1.64 0.01 -1.26 -4.91 114.94 109.89 3ksu s ASN 216 Ca 0.44 -1.16 0.13 0.00 -0.71 0.00 0.00 52.86 51.56 3ksu s ASN 216 Cb -0.03 -1.45 0.71 0.00 0.41 0.00 0.00 41.25 40.88 3ksu s ASN 216 CO 0.27 -0.15 1.58 0.00 -1.51 0.00 0.00 177.10 177.29 3ksu n GLN 217 N 4.53 4.28 -3.58 -0.60 6.02 -1.26 -4.98 117.38 121.79 3ksu n GLN 217 Ca -0.15 -2.72 -0.36 0.00 -0.01 0.00 0.00 57.00 53.76 3ksu n GLN 217 Cb 0.44 -2.13 -0.06 0.00 1.02 0.00 0.00 30.24 29.52 3ksu n GLN 217 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3ksu s LEU 218 N -2.31 4.40 0.15 1.08 1.43 -1.26 -4.81 118.68 117.36 3ksu s LEU 218 Ca 0.47 0.81 -0.31 0.00 -1.03 0.00 0.00 54.13 54.08 3ksu s LEU 218 Cb 0.35 -2.76 -0.08 0.00 0.03 0.00 0.00 46.19 43.73 3ksu s LEU 218 CO 0.15 0.25 1.34 -0.89 0.23 0.00 0.00 176.35 177.43 3ksu s THR 219 N -1.26 3.30 0.14 5.49 2.01 0.31 -4.99 115.64 120.64 3ksu s THR 219 Ca 0.28 1.00 0.03 0.00 0.31 0.00 0.00 61.69 63.31 3ksu s THR 219 Cb -0.15 -3.64 -0.04 0.00 0.01 0.00 0.00 72.50 68.69 3ksu s THR 219 CO 0.15 0.11 0.20 -0.75 -0.69 0.00 0.00 174.62 173.65 3ksu s LYS 220 N 0.53 3.19 0.45 4.92 2.20 -1.26 -4.54 119.74 125.24 3ksu s LYS 220 Ca 0.61 -0.69 0.21 0.00 -0.36 0.00 0.00 55.97 55.73 3ksu s LYS 220 Cb -0.36 -2.83 1.09 0.00 -1.51 0.00 0.00 37.83 34.22 3ksu s LYS 220 CO 0.34 0.52 1.95 -0.84 -0.36 0.00 0.00 175.35 176.96 3ksu h ILE 221 N 1.90 0.86 0.00 5.43 3.07 -1.98 -2.23 117.51 124.57 3ksu h ILE 221 Ca -0.48 -0.86 0.00 0.00 1.55 0.00 0.00 64.86 65.07 3ksu h ILE 221 Cb 1.19 1.51 0.00 0.00 -0.27 0.00 0.00 36.82 39.25 3ksu h ILE 221 CO 0.67 0.22 0.00 -0.33 -1.05 0.00 0.00 178.15 177.66 3ksu h GLU 222 N 0.00 0.00 0.00 0.16 3.07 -1.98 -1.61 114.58 114.22 3ksu h GLU 222 Ca -0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3ksu h GLU 222 Cb 0.49 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.40 3ksu h GLU 222 CO 0.03 0.00 -1.04 -0.25 -1.40 0.00 0.00 179.01 176.34 3ksu n ASP 223 N -2.79 0.61 -0.12 1.42 8.00 -0.84 -4.50 116.55 118.33 3ksu n ASP 223 Ca -0.00 -0.23 -0.16 0.00 0.71 0.00 0.00 54.79 55.11 3ksu n ASP 223 Cb 0.19 0.82 -0.12 0.00 -0.02 0.00 0.00 41.12 42.00 3ksu n ASP 223 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3ksu n ILE 224 N -1.96 1.40 -0.20 0.53 2.08 -0.78 -4.53 119.36 115.91 3ksu n ILE 224 Ca 0.02 -0.57 -0.01 0.00 0.56 0.00 0.00 62.75 62.75 3ksu n ILE 224 Cb 0.44 -1.27 0.09 0.00 -0.75 0.00 0.00 39.64 38.15 3ksu n ILE 224 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 3ksu h ALA 225 N 0.10 0.76 0.00 -1.39 0.00 -1.55 -2.18 119.26 115.00 3ksu h ALA 225 Ca -0.55 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.43 3ksu h ALA 225 Cb 1.89 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.69 3ksu h ALA 225 CO -0.07 -0.16 0.00 -1.00 0.00 0.00 0.00 179.25 178.02 3ksu h PRO 226 N 0.44 0.00 -0.21 0.00 0.13 -1.81 -2.42 132.00 128.12 3ksu h PRO 226 Ca 0.29 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 65.23 3ksu h PRO 226 Cb 0.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.44 3ksu h PRO 226 CO -0.26 0.00 -0.62 0.82 -0.23 0.00 0.00 178.00 177.71 3ksu h ILE 227 N 0.00 1.30 0.01 -3.56 2.04 -1.63 -1.81 117.51 113.85 3ksu h ILE 227 Ca 0.00 -1.84 -0.00 0.00 1.00 0.00 0.00 64.86 64.02 3ksu h ILE 227 Cb 0.40 1.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.26 3ksu h ILE 227 CO 0.00 0.58 -0.00 0.40 0.00 0.00 0.00 178.15 179.13 3ksu h ILE 228 N 0.54 1.02 -0.59 -0.67 2.04 -1.20 -1.30 117.51 117.36 3ksu h ILE 228 Ca -0.01 -0.10 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 3ksu h ILE 228 Cb 1.21 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 38.35 3ksu h ILE 228 CO 0.13 0.03 0.32 0.50 0.00 0.00 0.00 178.15 179.13 3ksu h LYS 229 N -0.05 0.83 -0.15 2.37 3.11 -1.50 -3.03 116.57 118.14 3ksu h LYS 229 Ca -0.00 -0.10 0.02 0.00 -2.81 0.00 0.00 60.65 57.76 3ksu h LYS 229 Cb 0.05 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 31.10 3ksu h LYS 229 CO 0.00 0.63 0.05 0.35 -2.81 0.00 0.00 179.45 177.67 3ksu h PHE 230 N 0.81 0.08 -0.79 1.91 3.57 -1.19 -2.81 116.94 118.52 3ksu h PHE 230 Ca 0.21 0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.79 3ksu h PHE 230 Cb 0.05 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.72 3ksu h PHE 230 CO -0.01 0.04 0.52 -0.07 -2.23 0.00 0.00 178.31 176.55 3ksu h LEU 231 N 0.12 0.72 0.00 0.59 3.38 -1.14 0.40 115.31 119.38 3ksu h LEU 231 Ca 0.07 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.04 3ksu h LEU 231 Cb 0.04 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.65 3ksu h LEU 231 CO -0.07 0.45 -0.01 0.35 0.09 0.00 0.00 178.44 179.25 3ksu n THR 232 N -4.49 0.28 0.00 0.22 -2.24 -1.15 -2.79 114.28 104.10 3ksu n THR 232 Ca 0.12 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 3ksu n THR 232 Cb 0.25 -0.53 0.00 0.00 -2.10 0.00 0.00 70.33 67.96 3ksu n THR 232 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 3ksu n THR 233 N -1.86 0.00 0.33 4.28 -2.24 -0.48 -4.81 114.28 109.50 3ksu n THR 233 Ca 0.06 0.00 0.15 0.00 -2.27 0.00 0.00 64.05 61.99 3ksu n THR 233 Cb 0.38 -0.01 0.49 0.00 -2.10 0.00 0.00 70.33 69.10 3ksu n THR 233 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 3ksu h ASP 234 N 0.00 0.00 -0.47 3.42 3.45 -1.71 -3.04 116.42 118.07 3ksu h ASP 234 Ca 0.00 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.46 3ksu h ASP 234 Cb 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.77 3ksu h ASP 234 CO 0.00 0.00 0.00 0.61 -1.57 0.00 0.00 179.24 178.28 3ksu n GLY 235 N 0.42 2.68 0.34 2.75 0.00 0.13 -4.64 105.19 106.88 3ksu n GLY 235 Ca 0.02 -0.74 0.18 0.00 0.00 0.00 0.00 46.02 45.48 3ksu n GLY 235 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 3ksu h TRP 236 N 3.23 0.00 0.00 1.61 5.08 -1.40 -1.36 115.95 123.11 3ksu h TRP 236 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.97 3ksu h TRP 236 Cb 1.68 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.84 3ksu h TRP 236 CO 0.88 0.00 -0.03 1.87 -1.28 0.00 0.00 178.44 179.87 3ksu n TRP 237 N -3.36 0.59 -2.48 0.12 -0.00 -1.26 -4.70 117.44 106.35 3ksu n TRP 237 Ca 0.00 0.17 -0.43 0.00 -0.00 0.00 0.00 57.50 57.24 3ksu n TRP 237 Cb 0.32 -0.77 -0.02 0.00 -0.00 0.00 0.00 31.31 30.83 3ksu n TRP 237 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 3ksu s ILE 238 N -3.07 4.31 -0.08 5.87 1.01 -0.51 -5.01 121.20 123.73 3ksu s ILE 238 Ca 0.12 1.55 -0.06 0.00 0.00 0.00 0.00 60.65 62.25 3ksu s ILE 238 Cb 0.15 -4.14 0.02 0.00 0.01 0.00 0.00 42.46 38.50 3ksu s ILE 238 CO 0.58 -0.30 0.20 0.21 0.00 0.00 0.00 174.94 175.63 3ksu s ASN 239 N 2.11 -0.21 -0.01 3.58 2.47 -1.26 -4.85 114.94 116.78 3ksu s ASN 239 Ca 0.53 0.41 0.00 0.00 0.42 0.00 0.00 52.86 54.22 3ksu s ASN 239 Cb -0.18 0.39 0.00 0.00 -1.45 0.00 0.00 41.25 40.01 3ksu s ASN 239 CO 0.16 -0.09 0.00 0.61 -3.72 0.00 0.00 177.10 174.06 3ksu n GLY 240 N 3.25 0.45 3.59 1.21 0.00 -0.46 -5.00 105.19 108.23 3ksu n GLY 240 Ca -0.16 -0.46 -0.32 0.00 0.00 0.00 0.00 46.02 45.08 3ksu n GLY 240 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ksu s GLN 241 N -0.86 2.52 -0.33 1.61 -1.52 -1.25 -4.42 119.66 115.42 3ksu s GLN 241 Ca 0.00 -0.74 -0.10 0.00 -1.95 0.00 0.00 55.36 52.57 3ksu s GLN 241 Cb 0.00 -2.48 0.01 0.00 -0.22 0.00 0.00 33.01 30.32 3ksu s GLN 241 CO 0.00 0.60 0.16 0.99 -0.25 0.00 0.00 175.29 176.78 3ksu s THR 242 N -1.00 4.49 -0.23 -0.19 2.01 -1.26 -0.19 115.64 119.27 3ksu s THR 242 Ca 0.17 -0.61 -0.19 0.00 0.31 0.00 0.00 61.69 61.37 3ksu s THR 242 Cb -0.11 -3.37 -0.03 0.00 0.01 0.00 0.00 72.50 69.00 3ksu s THR 242 CO 0.08 -0.03 0.54 -0.63 -0.69 0.00 0.00 174.62 173.89 3ksu s ILE 243 N 1.57 5.07 -0.35 1.82 -1.09 0.72 -4.91 121.20 124.04 3ksu s ILE 243 Ca 0.03 0.97 -0.18 0.00 -2.23 0.00 0.00 60.65 59.25 3ksu s ILE 243 Cb -0.18 -3.86 -0.00 0.00 -1.58 0.00 0.00 42.46 36.84 3ksu s ILE 243 CO 0.06 0.11 0.50 -0.36 -1.23 0.00 0.00 174.94 174.02 3ksu s PHE 244 N 2.06 3.18 -0.42 3.97 0.40 -1.26 0.17 117.98 126.08 3ksu s PHE 244 Ca 0.24 0.17 0.04 0.00 -0.60 0.00 0.00 56.93 56.77 3ksu s PHE 244 Cb -0.16 -2.91 0.11 0.00 0.51 0.00 0.00 43.02 40.58 3ksu s PHE 244 CO 0.09 -0.53 0.15 0.00 0.70 0.00 0.00 175.22 175.63 3ksu s ALA 245 N 2.37 3.06 0.00 5.36 0.00 -0.77 -4.88 121.76 126.89 3ksu s ALA 245 Ca 0.18 -2.87 0.00 0.00 0.00 0.00 0.00 51.96 49.27 3ksu s ALA 245 Cb -0.16 -2.05 0.00 0.00 0.00 0.00 0.00 23.12 20.91 3ksu s ALA 245 CO 0.13 -1.85 0.17 0.27 0.00 0.00 0.00 175.76 174.48 3ksu n ASN 246 N 3.72 0.18 0.00 0.00 0.23 -1.26 -2.17 115.26 115.95 3ksu n ASN 246 Ca 0.04 -1.03 0.00 0.00 -0.53 0.00 0.00 54.58 53.07 3ksu n ASN 246 Cb 0.37 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.07 3ksu n ASN 246 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3ksu n GLY 247 N -0.01 0.45 0.21 4.83 0.00 -1.26 -1.78 105.19 107.63 3ksu n GLY 247 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ksu n GLY 247 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ksu n GLY 248 N -1.82 0.44 3.57 -0.02 0.00 -1.26 -5.06 105.19 101.04 3ksu n GLY 248 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3ksu n GLY 248 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ksu s TYR 249 N -2.12 3.20 -1.14 1.61 1.51 -0.73 -4.92 117.35 114.75 3ksu s TYR 249 Ca 0.00 0.29 0.17 0.00 -1.01 0.00 0.00 57.07 56.52 3ksu s TYR 249 Cb 0.00 -2.87 -0.11 0.00 -0.11 0.00 0.00 41.96 38.87 3ksu s TYR 249 CO 0.00 -0.47 0.80 2.41 -1.11 0.00 0.00 175.55 177.17 3ksu n THR 250 N 5.36 0.00 -4.00 -0.71 -1.04 -1.26 -4.58 114.28 108.04 3ksu n THR 250 Ca -0.05 -0.19 -0.10 0.00 -2.04 0.00 0.00 64.05 61.67 3ksu n THR 250 Cb 0.49 1.09 -0.07 0.00 -1.82 0.00 0.00 70.33 70.02 3ksu n THR 250 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3ksu s THR 251 N -2.35 0.04 0.00 12.58 -1.32 -1.26 -3.88 115.64 119.44 3ksu s THR 251 Ca 0.10 -1.47 0.00 0.00 -1.21 0.00 0.00 61.69 59.11 3ksu s THR 251 Cb 0.13 -2.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.12 3ksu s THR 251 CO 0.59 -0.20 0.00 -2.11 -2.21 0.00 0.00 174.62 170.69