#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dkj s ASN 10 N 0.00 3.88 0.57 -2.13 3.84 -1.26 -5.01 114.94 114.83 3dkj s ASN 10 Ca 0.00 -1.22 0.26 0.00 0.21 0.00 0.00 52.86 52.11 3dkj s ASN 10 Cb 0.00 -1.18 1.63 0.00 -0.55 0.00 0.00 41.25 41.15 3dkj s ASN 10 CO 0.00 -0.25 2.19 -0.29 -2.79 0.00 0.00 177.10 175.96 3dkj h ILE 11 N 6.66 0.64 0.00 -5.21 6.09 -1.91 0.96 117.51 124.74 3dkj h ILE 11 Ca -0.17 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.32 3dkj h ILE 11 Cb 1.07 0.96 0.00 0.00 0.47 0.00 0.00 36.82 39.31 3dkj h ILE 11 CO 0.42 0.00 0.00 -0.07 -3.07 0.00 0.00 178.15 175.43 3dkj h LEU 12 N 0.00 0.00 -3.03 2.19 4.07 -1.92 -2.39 115.31 114.23 3dkj h LEU 12 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 3dkj h LEU 12 Cb 0.14 0.00 0.00 0.00 1.08 0.00 0.00 40.66 41.88 3dkj h LEU 12 CO -0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 177.54 3dkj n LEU 13 N -2.56 3.33 -2.12 1.67 4.77 0.32 -4.68 117.00 117.72 3dkj n LEU 13 Ca 0.01 -2.39 -0.27 0.00 -0.03 0.00 0.00 56.01 53.34 3dkj n LEU 13 Cb 0.25 -0.36 0.03 0.00 -2.33 0.00 0.00 43.42 41.02 3dkj n LEU 13 CO 0.22 0.71 0.47 0.00 -1.33 0.00 0.00 177.39 177.47 3dkj n ALA 14 N 0.14 5.33 -2.27 -1.18 0.00 -0.90 -4.99 120.51 116.64 3dkj n ALA 14 Ca 0.15 -3.75 -0.15 0.00 0.00 0.00 0.00 53.44 49.70 3dkj n ALA 14 Cb 0.61 -0.67 -0.10 0.00 0.00 0.00 0.00 19.45 19.29 3dkj n ALA 14 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3dkj s THR 15 N -4.70 0.76 0.26 0.00 -1.32 -1.26 -4.36 115.64 105.03 3dkj s THR 15 Ca 0.54 -2.00 -0.30 0.00 -1.21 0.00 0.00 61.69 58.72 3dkj s THR 15 Cb 0.43 -2.23 -0.10 0.00 -1.51 0.00 0.00 72.50 69.09 3dkj s THR 15 CO 0.01 -0.39 1.48 -1.81 -2.21 0.00 0.00 174.62 171.70 3dkj s ASP 16 N -3.22 6.58 0.28 8.08 1.01 -1.26 -4.92 116.67 123.22 3dkj s ASP 16 Ca 0.27 2.74 0.01 0.00 0.71 0.00 0.00 52.55 56.28 3dkj s ASP 16 Cb 0.06 -2.63 0.67 0.00 1.01 0.00 0.00 42.92 42.04 3dkj s ASP 16 CO 0.06 -0.75 1.67 0.28 0.21 0.00 0.00 175.17 176.64 3dkj h SER 17 N 4.93 0.11 -0.08 0.27 0.02 -1.99 -1.66 113.55 115.14 3dkj h SER 17 Ca -0.46 0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 60.65 3dkj h SER 17 Cb 1.22 0.21 -0.01 0.00 0.14 0.00 0.00 62.40 63.96 3dkj h SER 17 CO 0.78 -0.08 0.02 0.10 -1.14 0.00 0.00 176.83 176.50 3dkj h TYR 18 N 0.28 0.19 -0.03 3.45 -0.00 -2.02 -1.72 116.97 117.13 3dkj h TYR 18 Ca 0.53 -0.00 0.01 0.00 -0.00 0.00 0.00 58.73 59.26 3dkj h TYR 18 Cb 1.02 -0.06 -0.00 0.00 -0.00 0.00 0.00 36.73 37.69 3dkj h TYR 18 CO -0.22 0.19 0.03 0.87 -0.00 0.00 0.00 178.16 179.03 3dkj h LYS 19 N 0.20 0.00 -0.36 0.10 1.57 -1.68 -0.52 116.57 115.88 3dkj h LYS 19 Ca 0.05 0.00 0.08 0.00 -1.87 0.00 0.00 60.65 58.91 3dkj h LYS 19 Cb 0.11 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.40 3dkj h LYS 19 CO -0.00 0.00 0.25 0.28 -0.57 0.00 0.00 179.45 179.41 3dkj h VAL 20 N 0.00 0.88 -0.01 0.50 2.07 -1.41 -2.66 116.25 115.62 3dkj h VAL 20 Ca 0.01 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.49 3dkj h VAL 20 Cb 0.08 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 30.60 3dkj h VAL 20 CO -0.00 0.02 -0.24 0.35 0.02 0.00 0.00 177.57 177.72 3dkj n THR 21 N -4.46 0.00 0.17 2.57 -2.24 -0.21 -4.44 114.28 105.67 3dkj n THR 21 Ca 0.05 -0.24 0.04 0.00 -2.27 0.00 0.00 64.05 61.63 3dkj n THR 21 Cb 0.34 0.85 0.26 0.00 -2.10 0.00 0.00 70.33 69.68 3dkj n THR 21 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 3dkj h HIS 22 N 2.30 0.00 -0.39 4.78 -0.00 -1.44 -3.11 115.15 117.29 3dkj h HIS 22 Ca 0.00 0.00 0.11 0.00 -0.00 0.00 0.00 60.37 60.48 3dkj h HIS 22 Cb 0.66 0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 28.05 3dkj h HIS 22 CO 0.00 0.43 0.34 0.10 -0.00 0.00 0.00 177.93 178.80 3dkj h TYR 23 N 0.00 0.00 -0.06 2.45 -0.00 -1.80 -0.04 116.97 117.53 3dkj h TYR 23 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 3dkj h TYR 23 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.75 3dkj h TYR 23 CO 0.00 0.00 0.00 1.63 -0.00 0.00 0.00 178.16 179.79 3dkj n LYS 24 N -4.04 1.64 -0.03 0.10 5.02 -1.18 -4.32 118.16 115.36 3dkj n LYS 24 Ca 0.07 -0.94 -0.02 0.00 -2.02 0.00 0.00 58.31 55.40 3dkj n LYS 24 Cb 0.52 -1.45 -0.06 0.00 -0.02 0.00 0.00 35.03 34.02 3dkj n LYS 24 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3dkj n GLN 25 N 0.15 2.06 -1.33 1.97 6.02 -0.04 -5.01 117.38 121.19 3dkj n GLN 25 Ca 0.18 -0.02 -0.34 0.00 -0.01 0.00 0.00 57.00 56.81 3dkj n GLN 25 Cb 0.33 -1.20 0.10 0.00 1.02 0.00 0.00 30.24 30.49 3dkj n GLN 25 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 3dkj s TYR 26 N -2.30 1.95 0.34 1.08 1.51 -1.15 -4.93 117.35 113.86 3dkj s TYR 26 Ca -0.04 1.62 -0.28 0.00 -1.01 0.00 0.00 57.07 57.36 3dkj s TYR 26 Cb 0.03 -3.50 -0.12 0.00 -0.11 0.00 0.00 41.96 38.26 3dkj s TYR 26 CO 0.33 -2.74 1.38 -2.30 -1.11 0.00 0.00 175.55 171.11 3dkj n PRO 27 N -2.88 2.33 -1.21 -1.71 -0.02 -1.26 -4.95 135.00 125.30 3dkj n PRO 27 Ca 0.14 0.82 -0.35 0.00 -2.02 0.00 0.00 63.50 62.09 3dkj n PRO 27 Cb 0.50 -2.47 0.10 0.00 -0.02 0.00 0.00 33.50 31.61 3dkj n PRO 27 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3dkj n PRO 28 N 0.78 0.29 -2.52 0.52 -0.02 -1.26 -3.38 135.00 129.41 3dkj n PRO 28 Ca 0.05 0.15 -0.16 0.00 -2.02 0.00 0.00 63.50 61.52 3dkj n PRO 28 Cb 0.37 -2.13 0.01 0.00 -0.02 0.00 0.00 33.50 31.72 3dkj n PRO 28 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3dkj n ASN 29 N -1.65 -4.83 -4.64 2.55 4.13 -1.26 -4.73 115.26 104.82 3dkj n ASN 29 Ca 0.12 -0.10 -0.38 0.00 1.68 0.00 0.00 54.58 55.90 3dkj n ASN 29 Cb 0.50 -3.84 -0.08 0.00 -1.54 0.00 0.00 39.78 34.81 3dkj n ASN 29 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3dkj s THR 30 N -2.88 5.21 -0.72 3.41 2.01 -1.22 -0.54 115.64 120.91 3dkj s THR 30 Ca 0.09 0.57 0.14 0.00 0.31 0.00 0.00 61.69 62.80 3dkj s THR 30 Cb -0.04 -3.68 -0.14 0.00 0.01 0.00 0.00 72.50 68.65 3dkj s THR 30 CO 0.12 0.23 0.61 -1.54 -0.69 0.00 0.00 174.62 173.35 3dkj n SER 31 N 4.78 0.74 -3.70 3.53 3.41 0.12 -4.76 113.62 117.74 3dkj n SER 31 Ca -0.09 -0.87 -0.11 0.00 -0.26 0.00 0.00 58.87 57.54 3dkj n SER 31 Cb 0.51 0.95 -0.11 0.00 -0.26 0.00 0.00 64.21 65.30 3dkj n SER 31 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3dkj s LYS 32 N -2.26 0.37 -0.11 4.33 2.47 -1.19 -4.02 119.74 119.32 3dkj s LYS 32 Ca 0.06 0.78 0.02 0.00 -1.56 0.00 0.00 55.97 55.27 3dkj s LYS 32 Cb 0.11 -0.02 0.01 0.00 -1.46 0.00 0.00 37.83 36.47 3dkj s LYS 32 CO 0.55 -0.17 -0.17 0.08 0.16 0.00 0.00 175.35 175.80 3dkj s VAL 33 N 1.47 1.65 -0.08 4.02 1.01 -1.26 -1.40 120.40 125.81 3dkj s VAL 33 Ca -0.09 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.17 3dkj s VAL 33 Cb -0.09 -1.48 0.01 0.00 0.00 0.00 0.00 36.38 34.82 3dkj s VAL 33 CO -0.12 0.47 -0.16 -0.47 0.00 0.00 0.00 175.10 174.81 3dkj s TYR 34 N 0.83 1.89 0.12 5.22 5.04 0.38 -3.65 117.35 127.18 3dkj s TYR 34 Ca -0.09 -0.77 0.03 0.00 -2.44 0.00 0.00 57.07 53.80 3dkj s TYR 34 Cb -0.16 -1.33 -0.04 0.00 0.35 0.00 0.00 41.96 40.78 3dkj s TYR 34 CO 0.00 -0.36 -0.08 -1.12 -1.34 0.00 0.00 175.55 172.66 3dkj s SER 35 N 0.64 1.40 0.07 4.32 0.01 0.06 -0.90 113.70 119.30 3dkj s SER 35 Ca -0.14 -1.02 -0.07 0.00 1.31 0.00 0.00 55.95 56.03 3dkj s SER 35 Cb -0.16 0.06 -0.01 0.00 0.21 0.00 0.00 66.02 66.11 3dkj s SER 35 CO 0.04 -0.42 0.13 -0.72 0.41 0.00 0.00 173.24 172.68 3dkj s TYR 36 N -3.51 0.23 -0.07 2.43 -0.85 -0.05 0.23 117.35 115.76 3dkj s TYR 36 Ca 0.14 -0.65 0.05 0.00 -0.52 0.00 0.00 57.07 56.10 3dkj s TYR 36 Cb 0.04 -0.14 -0.01 0.00 0.38 0.00 0.00 41.96 42.24 3dkj s TYR 36 CO -0.02 -0.47 -0.24 0.12 -1.52 0.00 0.00 175.55 173.41 3dkj s PHE 37 N -3.59 2.42 0.11 -3.49 5.36 0.16 -1.39 117.98 117.56 3dkj s PHE 37 Ca 0.03 -0.80 -0.01 0.00 -0.96 0.00 0.00 56.93 55.19 3dkj s PHE 37 Cb 0.04 -1.60 -0.04 0.00 -0.34 0.00 0.00 43.02 41.09 3dkj s PHE 37 CO -0.09 -0.27 0.04 -1.83 -1.46 0.00 0.00 175.22 171.60 3dkj s GLU 38 N -0.00 0.83 -0.60 10.12 -1.05 -0.64 -1.28 118.70 126.08 3dkj s GLU 38 Ca -0.08 -1.36 -0.12 0.00 -0.15 0.00 0.00 54.97 53.27 3dkj s GLU 38 Cb -0.15 0.24 0.15 0.00 -0.44 0.00 0.00 34.13 33.93 3dkj s GLU 38 CO 0.05 -0.22 0.51 0.00 0.95 0.00 0.00 175.26 176.55 3dkj n ARG 40 N 4.60 1.78 -2.87 0.00 1.74 -0.20 -0.88 116.66 120.83 3dkj n ARG 40 Ca -0.02 0.63 -0.41 0.00 -0.77 0.00 0.00 57.85 57.28 3dkj n ARG 40 Cb 0.42 -2.26 -0.04 0.00 -1.02 0.00 0.00 32.46 29.55 3dkj n ARG 40 CO 0.00 0.00 0.00 -2.00 -1.52 0.00 0.00 177.63 174.11 3dkj s GLU 41 N -2.08 4.52 -0.97 5.56 2.12 -1.26 -4.57 118.70 122.01 3dkj s GLU 41 Ca 0.61 1.18 -0.13 0.00 0.36 0.00 0.00 54.97 56.98 3dkj s GLU 41 Cb -0.54 -3.43 0.01 0.00 0.26 0.00 0.00 34.13 30.44 3dkj s GLU 41 CO 0.58 0.08 0.65 0.66 -0.54 0.00 0.00 175.26 176.70 3dkj n TYR 54 N 3.51 -1.88 0.31 5.30 4.02 -1.26 -5.01 117.16 122.15 3dkj n TYR 54 Ca 0.02 0.57 0.14 0.00 -0.01 0.00 0.00 57.90 58.62 3dkj n TYR 54 Cb 0.51 -2.91 0.40 0.00 -0.02 0.00 0.00 39.34 37.32 3dkj n TYR 54 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 3dkj h GLU 55 N -1.14 0.00 -3.98 -0.72 5.08 -2.01 -3.45 114.58 108.36 3dkj h GLU 55 Ca -0.63 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 57.49 3dkj h GLU 55 Cb 1.38 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.37 3dkj h GLU 55 CO 0.42 0.00 -0.72 -1.83 -1.00 0.00 0.00 179.01 175.88 3dkj s GLU 56 N -3.36 0.20 -0.00 2.33 -1.05 -1.26 -1.12 118.70 114.44 3dkj s GLU 56 Ca 0.05 -0.24 0.08 0.00 -0.15 0.00 0.00 54.97 54.71 3dkj s GLU 56 Cb 0.08 -0.09 -0.02 0.00 -0.44 0.00 0.00 34.13 33.65 3dkj s GLU 56 CO 0.59 0.02 -0.24 0.95 0.95 0.00 0.00 175.26 177.53 3dkj s THR 57 N -0.46 2.23 -0.26 1.83 -4.23 0.57 -4.86 115.64 110.44 3dkj s THR 57 Ca -0.04 -1.15 -0.27 0.00 -1.18 0.00 0.00 61.69 59.05 3dkj s THR 57 Cb -0.03 -1.82 0.00 0.00 1.34 0.00 0.00 72.50 71.99 3dkj s THR 57 CO -0.00 0.51 0.94 -0.69 -0.54 0.00 0.00 174.62 174.83 3dkj s VAL 58 N -0.70 4.72 -0.46 2.29 1.01 -1.26 -1.39 120.40 124.61 3dkj s VAL 58 Ca 0.11 1.70 -0.28 0.00 0.00 0.00 0.00 61.98 63.51 3dkj s VAL 58 Cb -0.10 -4.24 0.03 0.00 0.00 0.00 0.00 36.38 32.07 3dkj s VAL 58 CO 0.00 -0.21 1.10 0.12 0.00 0.00 0.00 175.10 176.12 3dkj s PHE 59 N 3.12 2.86 -0.12 5.22 5.36 -0.60 -4.53 117.98 129.28 3dkj s PHE 59 Ca 0.39 0.71 -0.13 0.00 -0.96 0.00 0.00 56.93 56.94 3dkj s PHE 59 Cb -0.14 -4.31 0.03 0.00 -0.34 0.00 0.00 43.02 38.26 3dkj s PHE 59 CO 0.09 -1.21 0.37 -0.47 -1.46 0.00 0.00 175.22 172.54 3dkj s TYR 60 N 4.29 -0.38 0.00 10.12 5.04 -1.26 0.06 117.35 135.23 3dkj s TYR 60 Ca 0.46 0.89 0.00 0.00 -2.44 0.00 0.00 57.07 55.98 3dkj s TYR 60 Cb -0.08 0.14 0.00 0.00 0.35 0.00 0.00 41.96 42.37 3dkj s TYR 60 CO 0.30 -0.23 0.00 0.41 -1.34 0.00 0.00 175.55 174.69 3dkj n GLY 61 N 2.62 1.22 0.28 8.97 0.00 -1.26 -3.19 105.19 113.82 3dkj n GLY 61 Ca -0.14 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.82 3dkj n GLY 61 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dkj h LEU 62 N 0.00 0.81 -1.04 0.99 5.85 -1.94 -2.96 115.31 117.02 3dkj h LEU 62 Ca 0.00 -0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.76 3dkj h LEU 62 Cb 0.00 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 40.76 3dkj h LEU 62 CO 0.00 0.61 0.63 -0.61 -0.34 0.00 0.00 178.44 178.74 3dkj h GLN 63 N 0.94 1.07 -0.17 1.25 4.15 -1.96 0.58 115.11 120.96 3dkj h GLN 63 Ca 0.25 -0.06 0.05 0.00 0.77 0.00 0.00 58.65 59.66 3dkj h GLN 63 Cb -0.07 -0.24 -0.06 0.00 0.21 0.00 0.00 27.48 27.32 3dkj h GLN 63 CO -0.05 0.70 -0.18 -0.92 -1.93 0.00 0.00 178.83 176.46 3dkj h TYR 64 N 1.10 -0.46 -0.42 3.99 3.20 -1.84 -2.41 116.97 120.13 3dkj h TYR 64 Ca 0.44 0.03 -0.04 0.00 3.14 0.00 0.00 58.73 62.30 3dkj h TYR 64 Cb 0.27 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 38.75 3dkj h TYR 64 CO -0.00 -0.25 0.09 0.82 -1.64 0.00 0.00 178.16 177.18 3dkj h ILE 65 N -0.20 1.24 -0.31 1.81 2.04 -1.01 -1.01 117.51 120.05 3dkj h ILE 65 Ca 0.11 -0.83 0.07 0.00 1.00 0.00 0.00 64.86 65.21 3dkj h ILE 65 Cb 0.37 0.96 -0.07 0.00 -0.74 0.00 0.00 36.82 37.35 3dkj h ILE 65 CO -0.29 0.29 -0.13 -0.07 0.00 0.00 0.00 178.15 177.94 3dkj h LEU 66 N 0.55 -0.44 -0.07 1.44 3.38 -0.85 -0.49 115.31 118.83 3dkj h LEU 66 Ca 0.13 0.11 -0.12 0.00 0.09 0.00 0.00 57.88 58.09 3dkj h LEU 66 Cb 0.34 0.25 0.01 0.00 0.09 0.00 0.00 40.66 41.35 3dkj h LEU 66 CO 0.00 -0.16 -0.44 0.78 0.09 0.00 0.00 178.44 178.71 3dkj h ASN 67 N -0.07 0.51 -0.19 -0.43 2.35 -1.39 -0.51 115.58 115.84 3dkj h ASN 67 Ca 0.16 -0.67 -0.18 0.00 -0.55 0.00 0.00 56.30 55.06 3dkj h ASN 67 Cb 0.31 -0.15 -0.00 0.00 0.05 0.00 0.00 38.32 38.53 3dkj h ASN 67 CO -0.36 1.10 -0.54 0.50 -1.65 0.00 0.00 177.43 176.48 3dkj h LYS 68 N -0.04 0.78 0.00 0.81 3.64 -1.12 -3.41 116.57 117.24 3dkj h LYS 68 Ca -0.04 -0.49 -0.02 0.00 -1.27 0.00 0.00 60.65 58.84 3dkj h LYS 68 Cb 1.11 0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.98 3dkj h LYS 68 CO 0.09 1.12 -1.06 0.66 -2.27 0.00 0.00 179.45 177.99 3dkj n TYR 69 N -3.99 0.00 -0.04 1.91 0.53 -0.20 -4.88 117.16 110.49 3dkj n TYR 69 Ca -0.04 0.00 -0.00 0.00 -1.02 0.00 0.00 57.90 56.84 3dkj n TYR 69 Cb 0.62 -0.04 -0.11 0.00 -1.03 0.00 0.00 39.34 38.78 3dkj n TYR 69 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 3dkj n LEU 70 N -2.02 0.00 -4.85 7.72 4.77 -0.89 -4.91 117.00 116.82 3dkj n LEU 70 Ca -0.01 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 55.65 3dkj n LEU 70 Cb 0.52 0.18 -0.05 0.00 -2.33 0.00 0.00 43.42 41.74 3dkj n LEU 70 CO 0.02 0.18 0.50 -1.59 -1.33 0.00 0.00 177.39 175.17 3dkj s LYS 71 N -2.62 3.95 2.21 3.23 -2.85 -0.25 -4.69 119.74 118.72 3dkj s LYS 71 Ca -0.06 0.72 0.00 0.00 -1.00 0.00 0.00 55.97 55.63 3dkj s LYS 71 Cb 0.06 -2.33 0.00 0.00 -2.06 0.00 0.00 37.83 33.50 3dkj s LYS 71 CO 0.56 -0.00 0.00 0.41 0.10 0.00 0.00 175.35 176.42 3dkj n GLY 72 N -0.91 -1.15 3.55 0.59 0.00 0.22 -4.61 105.19 102.87 3dkj n GLY 72 Ca 0.04 -1.28 -0.41 0.00 0.00 0.00 0.00 46.02 44.37 3dkj n GLY 72 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dkj s LYS 73 N 0.00 3.27 0.00 1.61 2.20 -1.26 -4.08 119.74 121.48 3dkj s LYS 73 Ca 0.00 -0.46 0.18 0.00 -0.36 0.00 0.00 55.97 55.34 3dkj s LYS 73 Cb 0.00 -4.42 -0.04 0.00 -1.51 0.00 0.00 37.83 31.87 3dkj s LYS 73 CO 0.00 -2.14 0.91 1.33 -0.36 0.00 0.00 175.35 175.09 3dkj n VAL 74 N 6.44 0.00 -5.06 4.02 0.24 -0.09 -4.89 118.33 118.99 3dkj n VAL 74 Ca 0.09 -0.27 -0.32 0.00 -2.04 0.00 0.00 64.34 61.79 3dkj n VAL 74 Cb 0.49 1.18 -0.16 0.00 -1.47 0.00 0.00 33.84 33.88 3dkj n VAL 74 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3dkj s VAL 75 N -2.21 2.43 0.18 3.34 1.01 -1.06 -4.49 120.40 119.59 3dkj s VAL 75 Ca 0.14 -0.89 0.05 0.00 0.00 0.00 0.00 61.98 61.27 3dkj s VAL 75 Cb 0.15 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.52 3dkj s VAL 75 CO 0.51 0.55 -0.08 0.42 0.00 0.00 0.00 175.10 176.50 3dkj s THR 76 N 0.27 1.20 0.26 3.92 -4.23 -1.26 -4.43 115.64 111.38 3dkj s THR 76 Ca -0.14 -2.07 -0.02 0.00 -1.18 0.00 0.00 61.69 58.28 3dkj s THR 76 Cb -0.17 -2.00 0.25 0.00 1.34 0.00 0.00 72.50 71.92 3dkj s THR 76 CO 0.07 -0.62 1.83 0.50 -0.54 0.00 0.00 174.62 175.87 3dkj h LYS 77 N 2.67 0.91 -0.50 3.99 1.63 -2.00 -1.23 116.57 122.05 3dkj h LYS 77 Ca -0.37 -0.05 -0.06 0.00 -0.85 0.00 0.00 60.65 59.32 3dkj h LYS 77 Cb 1.20 -0.21 -0.02 0.00 -0.60 0.00 0.00 32.23 32.61 3dkj h LYS 77 CO 0.64 0.60 0.08 0.93 -3.45 0.00 0.00 179.45 178.25 3dkj h GLU 78 N 0.94 0.82 -0.47 1.90 3.07 -1.99 -1.97 114.58 116.87 3dkj h GLU 78 Ca 0.45 -0.22 -0.10 0.00 -0.50 0.00 0.00 59.36 58.99 3dkj h GLU 78 Cb 0.39 -0.10 -0.02 0.00 -0.84 0.00 0.00 28.75 28.19 3dkj h GLU 78 CO -0.25 0.81 -0.12 0.87 -1.40 0.00 0.00 179.01 178.92 3dkj h LYS 79 N 0.70 0.88 0.05 2.33 1.57 -1.84 -0.77 116.57 119.48 3dkj h LYS 79 Ca 0.15 -0.31 -0.00 0.00 -1.87 0.00 0.00 60.65 58.62 3dkj h LYS 79 Cb 0.39 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.64 3dkj h LYS 79 CO 0.01 0.95 -0.02 0.82 -0.57 0.00 0.00 179.45 180.64 3dkj h ILE 80 N 0.79 0.99 -0.27 1.86 2.04 -1.16 -1.85 117.51 119.91 3dkj h ILE 80 Ca 0.13 -0.12 0.05 0.00 1.00 0.00 0.00 64.86 65.91 3dkj h ILE 80 Cb 0.64 1.08 -0.04 0.00 -0.74 0.00 0.00 36.82 37.76 3dkj h ILE 80 CO 0.04 0.03 -0.00 -0.61 0.00 0.00 0.00 178.15 177.62 3dkj h GLN 81 N -0.11 0.08 -0.19 2.37 5.75 -1.25 0.11 115.11 121.86 3dkj h GLN 81 Ca -0.01 -0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.53 3dkj h GLN 81 Cb 0.10 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 28.59 3dkj h GLN 81 CO 0.01 0.05 -0.05 1.49 -2.65 0.00 0.00 178.83 177.68 3dkj h GLU 82 N 0.08 -0.01 -0.26 1.69 4.81 -1.05 -0.83 114.58 119.00 3dkj h GLU 82 Ca 0.13 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3dkj h GLU 82 Cb 0.17 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.54 3dkj h GLU 82 CO -0.22 -0.01 0.17 0.00 -0.73 0.00 0.00 179.01 178.23 3dkj h ALA 83 N 1.18 0.33 -0.72 2.92 0.00 -1.15 -1.34 119.26 120.47 3dkj h ALA 83 Ca 0.09 -0.02 0.14 0.00 0.00 0.00 0.00 54.91 55.12 3dkj h ALA 83 Cb 0.15 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 17.74 3dkj h ALA 83 CO -0.20 -0.19 0.24 -0.22 0.00 0.00 0.00 179.25 178.88 3dkj h LYS 84 N 0.35 0.36 -0.29 0.00 3.64 -0.12 -0.55 116.57 119.96 3dkj h LYS 84 Ca 0.10 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.31 3dkj h LYS 84 Cb -0.03 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.70 3dkj h LYS 84 CO -0.02 0.24 -0.36 -0.44 -2.27 0.00 0.00 179.45 176.59 3dkj h ASP 85 N 0.37 0.83 0.07 4.20 3.32 -0.74 -2.23 116.42 122.23 3dkj h ASP 85 Ca 0.40 -0.49 -0.00 0.00 0.02 0.00 0.00 57.03 56.95 3dkj h ASP 85 Cb 0.62 -0.23 0.00 0.00 0.22 0.00 0.00 39.33 39.94 3dkj h ASP 85 CO -0.43 1.16 -0.03 0.58 -1.72 0.00 0.00 179.24 178.79 3dkj h VAL 86 N 0.52 1.07 -0.17 -1.35 2.07 -0.95 -3.17 116.25 114.28 3dkj h VAL 86 Ca 0.04 -0.47 -0.07 0.00 0.82 0.00 0.00 66.70 67.02 3dkj h VAL 86 Cb 0.95 1.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.09 3dkj h VAL 86 CO 0.09 0.12 -0.20 1.88 0.02 0.00 0.00 177.57 179.47 3dkj h TYR 87 N -0.30 0.31 -0.68 1.57 0.99 -1.10 0.11 116.97 117.88 3dkj h TYR 87 Ca -0.01 -0.05 0.07 0.00 2.00 0.00 0.00 58.73 60.74 3dkj h TYR 87 Cb 0.26 -0.08 -0.06 0.00 1.00 0.00 0.00 36.73 37.85 3dkj h TYR 87 CO -0.00 0.48 0.37 -0.22 -0.00 0.00 0.00 178.16 178.78 3dkj h LYS 88 N 0.27 0.64 0.14 4.88 1.63 -1.43 0.16 116.57 122.86 3dkj h LYS 88 Ca 0.05 -0.04 -0.28 0.00 -0.85 0.00 0.00 60.65 59.52 3dkj h LYS 88 Cb 0.51 -0.15 0.01 0.00 -0.60 0.00 0.00 32.23 32.01 3dkj h LYS 88 CO 0.03 0.43 -1.26 0.93 -3.45 0.00 0.00 179.45 176.13 3dkj h GLU 89 N 0.66 0.37 -0.37 1.90 4.39 -1.33 -0.27 114.58 119.94 3dkj h GLU 89 Ca 0.31 -0.59 -0.06 0.00 0.34 0.00 0.00 59.36 59.37 3dkj h GLU 89 Cb 0.23 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 29.08 3dkj h GLU 89 CO -0.20 1.26 0.01 1.25 -1.16 0.00 0.00 179.01 180.17 3dkj h HIS 90 N 0.12 0.71 0.00 4.33 2.76 -0.51 -3.15 115.15 119.41 3dkj h HIS 90 Ca -0.16 -0.12 0.00 0.00 -2.20 0.00 0.00 60.37 57.89 3dkj h HIS 90 Cb 1.96 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 30.74 3dkj h HIS 90 CO 0.08 0.74 -0.92 1.19 -1.30 0.00 0.00 177.93 177.71 3dkj n PHE 91 N -4.49 0.60 -3.58 5.26 3.01 0.52 -4.97 117.46 113.81 3dkj n PHE 91 Ca -0.01 0.17 -0.22 0.00 1.01 0.00 0.00 57.45 58.40 3dkj n PHE 91 Cb 0.27 -0.70 0.08 0.00 -0.01 0.00 0.00 39.48 39.12 3dkj n PHE 91 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3dkj n GLN 92 N -2.27 -7.33 -3.64 -1.08 1.13 -0.15 -4.94 117.38 99.10 3dkj n GLN 92 Ca 0.01 0.81 -0.03 0.00 -1.94 0.00 0.00 57.00 55.86 3dkj n GLN 92 Cb 0.48 -5.83 -0.03 0.00 0.11 0.00 0.00 30.24 24.97 3dkj n GLN 92 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 3dkj s ASP 93 N -3.65 -0.05 0.00 1.08 2.15 -0.98 -5.04 116.67 110.19 3dkj s ASP 93 Ca 0.41 0.04 0.10 0.00 0.43 0.00 0.00 52.55 53.53 3dkj s ASP 93 Cb -0.18 0.04 0.42 0.00 -0.30 0.00 0.00 42.92 42.90 3dkj s ASP 93 CO 0.74 -0.06 1.30 0.47 -0.17 0.00 0.00 175.17 177.45 3dkj n ASP 94 N 0.32 0.78 0.23 -0.34 8.00 -1.26 -4.11 116.55 120.17 3dkj n ASP 94 Ca 0.01 -1.84 0.02 0.00 0.71 0.00 0.00 54.79 53.69 3dkj n ASP 94 Cb 0.58 -0.08 0.12 0.00 -0.02 0.00 0.00 41.12 41.71 3dkj n ASP 94 CO 0.00 0.00 0.00 -0.37 -0.39 0.00 0.00 177.20 176.44 3dkj h VAL 95 N 0.91 0.00 -2.71 2.53 -1.51 -1.96 -3.45 116.25 110.06 3dkj h VAL 95 Ca 0.00 0.00 -0.53 0.00 -1.23 0.00 0.00 66.70 64.94 3dkj h VAL 95 Cb 0.21 0.09 0.06 0.00 -2.13 0.00 0.00 31.29 29.52 3dkj h VAL 95 CO 0.00 0.00 0.98 0.33 -1.23 0.00 0.00 177.57 177.65 3dkj n PHE 96 N -2.11 2.74 -1.41 5.19 7.35 -1.26 -4.76 117.46 123.20 3dkj n PHE 96 Ca -0.00 0.08 -0.40 0.00 -0.76 0.00 0.00 57.45 56.37 3dkj n PHE 96 Cb 0.74 -2.66 -0.02 0.00 0.35 0.00 0.00 39.48 37.89 3dkj n PHE 96 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 3dkj n ASN 97 N 3.69 4.31 -0.19 -2.13 5.15 -1.26 -4.75 115.26 120.08 3dkj n ASN 97 Ca 0.15 -2.70 -0.04 0.00 -0.60 0.00 0.00 54.58 51.39 3dkj n ASN 97 Cb 0.35 -1.43 0.06 0.00 -0.53 0.00 0.00 39.78 38.22 3dkj n ASN 97 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 3dkj h GLU 98 N 6.42 0.61 -0.03 1.20 4.81 -1.93 -2.63 114.58 123.03 3dkj h GLU 98 Ca 0.57 -0.04 0.02 0.00 -0.13 0.00 0.00 59.36 59.78 3dkj h GLU 98 Cb 0.55 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 3dkj h GLU 98 CO 1.85 0.41 -0.07 0.87 -0.73 0.00 0.00 179.01 181.34 3dkj h LYS 99 N 0.63 -0.10 -0.38 1.92 1.57 -1.99 0.18 116.57 118.39 3dkj h LYS 99 Ca 0.24 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.11 3dkj h LYS 99 Cb 0.09 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.35 3dkj h LYS 99 CO -0.13 -0.07 -0.10 0.78 -0.57 0.00 0.00 179.45 179.36 3dkj h GLY 100 N -0.11 0.26 1.00 3.86 0.00 -1.93 0.14 103.07 106.29 3dkj h GLY 100 Ca 0.04 0.14 -0.06 0.00 0.00 0.00 0.00 47.33 47.44 3dkj h GLY 100 CO -0.10 -0.15 0.09 1.49 0.00 0.00 0.00 176.54 177.87 3dkj h TRP 101 N -0.01 0.93 -0.66 5.60 4.06 -1.30 -2.88 115.95 121.70 3dkj h TRP 101 Ca 0.19 -0.13 -0.01 0.00 2.06 0.00 0.00 58.89 61.00 3dkj h TRP 101 Cb 0.29 -0.25 -0.03 0.00 -1.00 0.00 0.00 29.16 28.17 3dkj h TRP 101 CO -0.35 0.83 0.39 -0.91 -3.56 0.00 0.00 178.44 174.84 3dkj h ASN 102 N 0.76 0.79 -0.80 -3.49 2.35 -0.55 -1.20 115.58 113.42 3dkj h ASN 102 Ca 0.16 -0.04 0.06 0.00 -0.55 0.00 0.00 56.30 55.93 3dkj h ASN 102 Cb 0.40 -0.20 -0.06 0.00 0.05 0.00 0.00 38.32 38.51 3dkj h ASN 102 CO 0.01 0.61 0.48 0.22 -1.65 0.00 0.00 177.43 177.10 3dkj h TYR 103 N 0.90 0.89 -0.42 1.19 3.20 -0.82 -0.10 116.97 121.82 3dkj h TYR 103 Ca 0.24 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 62.06 3dkj h TYR 103 Cb -0.03 -0.28 -0.01 0.00 1.54 0.00 0.00 36.73 37.95 3dkj h TYR 103 CO 0.00 0.44 -0.01 0.82 -1.64 0.00 0.00 178.16 177.78 3dkj h ILE 104 N 0.88 1.26 0.25 1.81 2.04 -1.04 -1.94 117.51 120.77 3dkj h ILE 104 Ca 0.35 -1.05 0.00 0.00 1.00 0.00 0.00 64.86 65.17 3dkj h ILE 104 Cb 0.18 1.11 -0.02 0.00 -0.74 0.00 0.00 36.82 37.35 3dkj h ILE 104 CO -0.18 0.36 -0.25 0.25 0.00 0.00 0.00 178.15 178.33 3dkj h LEU 105 N 0.58 -0.66 -0.57 1.44 5.85 -0.89 -1.93 115.31 119.13 3dkj h LEU 105 Ca 0.12 0.06 -0.15 0.00 0.84 0.00 0.00 57.88 58.75 3dkj h LEU 105 Cb 0.50 0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 3dkj h LEU 105 CO 0.02 -0.36 -0.46 -0.33 -0.34 0.00 0.00 178.44 176.98 3dkj h GLU 106 N -0.53 0.62 0.04 1.25 5.08 -1.03 -2.32 114.58 117.70 3dkj h GLU 106 Ca -0.01 -0.34 -0.31 0.00 -1.00 0.00 0.00 59.36 57.70 3dkj h GLU 106 Cb 0.49 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.72 3dkj h GLU 106 CO -0.06 0.95 -1.76 -0.22 -1.00 0.00 0.00 179.01 176.92 3dkj h LYS 107 N 0.50 0.09 0.00 2.33 3.64 -1.41 -3.39 116.57 118.33 3dkj h LYS 107 Ca 0.03 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.26 3dkj h LYS 107 Cb 0.99 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 3dkj h LYS 107 CO 0.09 0.74 -0.02 0.66 -2.27 0.00 0.00 179.45 178.65 3dkj n TYR 108 N -3.20 0.00 -4.05 1.91 4.02 -0.76 -4.97 117.16 110.11 3dkj n TYR 108 Ca -0.20 -0.95 -0.31 0.00 -0.01 0.00 0.00 57.90 56.43 3dkj n TYR 108 Cb 1.05 -0.14 -0.01 0.00 -0.02 0.00 0.00 39.34 40.21 3dkj n TYR 108 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 3dkj n ASP 109 N -1.36 -2.47 0.00 7.72 2.03 -0.89 -1.28 116.55 120.30 3dkj n ASP 109 Ca 0.15 -0.96 0.00 0.00 0.52 0.00 0.00 54.79 54.50 3dkj n ASP 109 Cb 0.64 -3.13 0.00 0.00 -0.72 0.00 0.00 41.12 37.91 3dkj n ASP 109 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3dkj n GLY 110 N -1.67 0.36 3.77 0.27 0.00 -0.98 -4.62 105.19 102.32 3dkj n GLY 110 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 3dkj n GLY 110 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dkj s HIS 111 N -1.75 3.65 -0.09 1.61 3.76 -0.40 -0.92 115.29 121.15 3dkj s HIS 111 Ca 0.00 1.08 -0.30 0.00 -0.15 0.00 0.00 55.06 55.70 3dkj s HIS 111 Cb 0.00 -2.53 -0.04 0.00 1.11 0.00 0.00 32.58 31.12 3dkj s HIS 111 CO 0.00 0.36 1.47 -0.51 -0.85 0.00 0.00 174.74 175.21 3dkj s LEU 112 N -0.15 4.27 -1.21 0.89 1.43 -1.26 -4.76 118.68 117.88 3dkj s LEU 112 Ca 0.28 2.00 -0.16 0.00 -1.03 0.00 0.00 54.13 55.23 3dkj s LEU 112 Cb -0.17 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 42.47 3dkj s LEU 112 CO 0.15 -0.84 2.16 -0.81 0.23 0.00 0.00 176.35 177.24 3dkj n PRO 113 N 6.72 2.40 -4.38 1.29 -0.05 -1.26 -2.30 135.00 137.43 3dkj n PRO 113 Ca 0.15 -2.27 -0.19 0.00 -0.05 0.00 0.00 63.50 61.14 3dkj n PRO 113 Cb 0.44 -3.10 -0.15 0.00 -0.05 0.00 0.00 33.50 30.64 3dkj n PRO 113 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 175.50 175.87 3dkj s ILE 114 N 3.77 0.74 -0.13 0.52 -1.09 -1.26 -0.40 121.20 123.36 3dkj s ILE 114 Ca 0.52 -0.37 -0.01 0.00 -2.23 0.00 0.00 60.65 58.55 3dkj s ILE 114 Cb 0.14 -0.64 -0.02 0.00 -1.58 0.00 0.00 42.46 40.36 3dkj s ILE 114 CO -0.01 0.22 -0.09 -0.70 -1.23 0.00 0.00 174.94 173.13 3dkj s GLU 115 N -0.01 3.40 -0.13 2.79 2.12 0.03 -1.21 118.70 125.69 3dkj s GLU 115 Ca 0.00 -0.62 0.03 0.00 0.36 0.00 0.00 54.97 54.75 3dkj s GLU 115 Cb -0.06 -2.72 0.01 0.00 0.26 0.00 0.00 34.13 31.62 3dkj s GLU 115 CO -0.00 0.28 -0.22 0.42 -0.54 0.00 0.00 175.26 175.20 3dkj s ILE 116 N 0.20 2.03 -0.09 -3.70 1.01 0.27 -1.64 121.20 119.28 3dkj s ILE 116 Ca -0.06 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 59.63 3dkj s ILE 116 Cb -0.15 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.52 3dkj s ILE 116 CO 0.04 0.55 -0.15 -0.54 0.00 0.00 0.00 174.94 174.84 3dkj s LYS 117 N 0.67 3.00 0.01 2.79 1.02 -0.90 -0.38 119.74 125.95 3dkj s LYS 117 Ca -0.11 -0.72 -0.03 0.00 0.02 0.00 0.00 55.97 55.13 3dkj s LYS 117 Cb -0.16 -2.49 -0.01 0.00 -0.52 0.00 0.00 37.83 34.65 3dkj s LYS 117 CO 0.02 0.36 0.04 0.00 -0.92 0.00 0.00 175.35 174.85 3dkj s ALA 118 N -0.05 -0.07 0.51 5.17 0.00 0.50 -0.90 121.76 126.92 3dkj s ALA 118 Ca -0.03 -0.39 -0.22 0.00 0.00 0.00 0.00 51.96 51.32 3dkj s ALA 118 Cb -0.14 0.13 -0.06 0.00 0.00 0.00 0.00 23.12 23.05 3dkj s ALA 118 CO 0.04 -0.18 1.25 0.54 0.00 0.00 0.00 175.76 177.41 3dkj s VAL 119 N -1.41 2.62 0.41 0.00 0.11 -0.27 -1.13 120.40 120.72 3dkj s VAL 119 Ca -0.15 0.46 -0.27 0.00 -2.93 0.00 0.00 61.98 59.09 3dkj s VAL 119 Cb -0.09 -3.23 -0.09 0.00 -1.53 0.00 0.00 36.38 31.44 3dkj s VAL 119 CO 0.00 -0.02 1.44 -2.84 -3.33 0.00 0.00 175.10 170.35 3dkj s PRO 120 N -2.86 3.91 0.35 1.54 0.02 -1.26 -4.92 135.00 131.78 3dkj s PRO 120 Ca 0.69 2.45 -0.28 0.00 0.02 0.00 0.00 61.00 63.87 3dkj s PRO 120 Cb -0.34 -2.81 -0.11 0.00 0.02 0.00 0.00 34.50 31.27 3dkj s PRO 120 CO 0.40 -0.65 1.37 -1.21 -0.33 0.00 0.00 177.00 176.58 3dkj s GLU 121 N -2.26 4.27 0.00 5.54 2.02 -1.26 -1.75 118.70 125.27 3dkj s GLU 121 Ca 0.57 2.33 0.00 0.00 0.02 0.00 0.00 54.97 57.89 3dkj s GLU 121 Cb -0.44 -3.04 0.00 0.00 0.10 0.00 0.00 34.13 30.75 3dkj s GLU 121 CO 0.58 -0.30 0.00 0.41 0.02 0.00 0.00 175.26 175.97 3dkj n GLY 122 N 0.69 3.37 3.72 -1.39 0.00 0.11 -4.41 105.19 107.28 3dkj n GLY 122 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3dkj n GLY 122 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3dkj n PHE 123 N -1.76 2.35 -3.77 1.61 3.01 -0.72 -2.62 117.46 115.57 3dkj n PHE 123 Ca 0.00 0.50 -0.37 0.00 1.01 0.00 0.00 57.45 58.58 3dkj n PHE 123 Cb 0.00 -2.42 -0.13 0.00 -0.01 0.00 0.00 39.48 36.93 3dkj n PHE 123 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3dkj s VAL 124 N -1.16 3.86 -0.07 -4.37 1.01 -1.26 -1.56 120.40 116.85 3dkj s VAL 124 Ca 0.59 -0.80 0.03 0.00 0.00 0.00 0.00 61.98 61.79 3dkj s VAL 124 Cb -0.51 -3.03 0.01 0.00 0.00 0.00 0.00 36.38 32.84 3dkj s VAL 124 CO 0.60 0.03 -0.17 -0.63 0.00 0.00 0.00 175.10 174.93 3dkj s ILE 125 N 1.47 1.46 0.60 2.22 -1.09 -0.48 -4.89 121.20 120.49 3dkj s ILE 125 Ca 0.02 -0.69 -0.19 0.00 -2.23 0.00 0.00 60.65 57.56 3dkj s ILE 125 Cb -0.18 -1.29 -0.05 0.00 -1.58 0.00 0.00 42.46 39.37 3dkj s ILE 125 CO 0.02 0.43 1.00 -2.65 -1.23 0.00 0.00 174.94 172.51 3dkj n PRO 126 N 3.58 0.94 -1.64 2.79 -0.02 -1.26 -0.32 135.00 139.07 3dkj n PRO 126 Ca -0.21 0.36 -0.38 0.00 -2.02 0.00 0.00 63.50 61.26 3dkj n PRO 126 Cb 0.52 -2.20 0.05 0.00 -0.02 0.00 0.00 33.50 31.85 3dkj n PRO 126 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3dkj n ARG 127 N -1.06 1.01 -0.87 -0.52 1.74 -0.28 -3.73 116.66 112.95 3dkj n ARG 127 Ca 0.14 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.61 3dkj n ARG 127 Cb 0.47 -2.22 0.00 0.00 -1.02 0.00 0.00 32.46 29.69 3dkj n ARG 127 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dkj n GLY 128 N 1.20 0.58 3.47 -0.13 0.00 -0.06 -4.66 105.19 105.59 3dkj n GLY 128 Ca 0.13 -0.80 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 3dkj n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dkj s ASN 129 N -2.75 3.76 0.24 1.61 0.01 -1.24 -4.87 114.94 111.70 3dkj s ASN 129 Ca 0.00 -0.60 -0.30 0.00 -0.71 0.00 0.00 52.86 51.25 3dkj s ASN 129 Cb 0.00 -0.48 -0.10 0.00 0.41 0.00 0.00 41.25 41.09 3dkj s ASN 129 CO 0.00 0.18 1.42 0.54 -1.51 0.00 0.00 177.10 177.73 3dkj s VAL 130 N -1.12 2.76 -0.12 1.60 0.11 -1.26 -4.33 120.40 118.03 3dkj s VAL 130 Ca 0.17 0.63 0.04 0.00 -2.93 0.00 0.00 61.98 59.90 3dkj s VAL 130 Cb -0.10 -3.40 -0.11 0.00 -1.53 0.00 0.00 36.38 31.24 3dkj s VAL 130 CO 0.09 0.10 -0.06 0.18 -3.33 0.00 0.00 175.10 172.08 3dkj n LEU 131 N 2.43 1.86 -3.61 2.54 4.77 -0.40 -4.88 117.00 119.70 3dkj n LEU 131 Ca 0.07 -0.05 -0.12 0.00 -0.03 0.00 0.00 56.01 55.88 3dkj n LEU 131 Cb 0.41 -0.20 -0.05 0.00 -2.33 0.00 0.00 43.42 41.25 3dkj n LEU 131 CO 0.60 0.55 0.20 0.72 -1.33 0.00 0.00 177.39 178.14 3dkj s PHE 132 N -2.27 -0.29 0.13 -1.77 -0.12 -1.24 -1.12 117.98 111.31 3dkj s PHE 132 Ca -0.13 0.13 0.08 0.00 -0.05 0.00 0.00 56.93 56.95 3dkj s PHE 132 Cb 0.04 0.29 -0.04 0.00 -0.63 0.00 0.00 43.02 42.68 3dkj s PHE 132 CO 0.36 -0.67 -0.18 0.95 -0.05 0.00 0.00 175.22 175.64 3dkj s THR 133 N -3.18 1.63 -0.04 -4.49 -4.23 -0.07 -0.66 115.64 104.60 3dkj s THR 133 Ca -0.01 -1.73 0.01 0.00 -1.18 0.00 0.00 61.69 58.79 3dkj s THR 133 Cb 0.00 -1.64 0.02 0.00 1.34 0.00 0.00 72.50 72.22 3dkj s THR 133 CO -0.07 -0.26 -0.06 -0.69 -0.54 0.00 0.00 174.62 173.00 3dkj s VAL 134 N -1.77 0.58 0.04 2.29 1.01 0.13 -2.12 120.40 120.57 3dkj s VAL 134 Ca 0.10 -0.19 -0.07 0.00 0.00 0.00 0.00 61.98 61.83 3dkj s VAL 134 Cb -0.07 -0.57 -0.01 0.00 0.00 0.00 0.00 36.38 35.73 3dkj s VAL 134 CO 0.05 0.22 0.13 -1.83 0.00 0.00 0.00 175.10 173.66 3dkj s GLU 135 N 0.64 0.63 0.31 2.72 -1.05 -0.65 -0.76 118.70 120.55 3dkj s GLU 135 Ca -0.09 -0.74 -0.20 0.00 -0.15 0.00 0.00 54.97 53.79 3dkj s GLU 135 Cb -0.12 0.25 -0.09 0.00 -0.44 0.00 0.00 34.13 33.73 3dkj s GLU 135 CO 0.00 -0.17 0.82 0.54 0.95 0.00 0.00 175.26 177.41 3dkj s ASN 136 N -2.18 7.02 0.00 0.83 4.22 -1.24 -0.79 114.94 122.81 3dkj s ASN 136 Ca -0.04 1.53 0.15 0.00 -2.14 0.00 0.00 52.86 52.36 3dkj s ASN 136 Cb -0.01 -2.47 0.01 0.00 1.28 0.00 0.00 41.25 40.06 3dkj s ASN 136 CO -0.05 -0.13 0.84 0.35 -2.04 0.00 0.00 177.10 176.07 3dkj n THR 137 N 0.13 0.00 -4.30 0.54 -2.24 0.47 -4.83 114.28 104.04 3dkj n THR 137 Ca 0.02 -0.35 -0.27 0.00 -2.27 0.00 0.00 64.05 61.18 3dkj n THR 137 Cb 0.52 1.19 -0.17 0.00 -2.10 0.00 0.00 70.33 69.77 3dkj n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dkj s ASP 138 N -1.79 2.16 0.51 3.42 3.68 -1.26 -5.04 116.67 118.35 3dkj s ASP 138 Ca 0.13 -0.35 0.27 0.00 2.13 0.00 0.00 52.55 54.73 3dkj s ASP 138 Cb 0.12 -0.93 1.38 0.00 -1.45 0.00 0.00 42.92 42.04 3dkj s ASP 138 CO 0.37 -0.02 1.91 1.55 0.13 0.00 0.00 175.17 179.11 3dkj h PRO 139 N 7.54 0.08 0.00 4.34 0.13 -1.89 0.16 132.00 142.36 3dkj h PRO 139 Ca -0.31 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 64.81 3dkj h PRO 139 Cb 1.16 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 32.27 3dkj h PRO 139 CO 0.46 0.06 -0.02 0.93 -0.23 0.00 0.00 178.00 179.20 3dkj h GLU 140 N 0.09 0.00 -0.65 0.86 4.39 -1.91 -3.20 114.58 114.15 3dkj h GLU 140 Ca 0.39 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.76 3dkj h GLU 140 Cb 1.42 0.00 -0.20 0.00 -0.10 0.00 0.00 28.75 29.87 3dkj h GLU 140 CO -0.04 0.02 0.25 0.00 -1.16 0.00 0.00 179.01 178.08 3dkj h TYR 142 N 1.05 0.56 0.00 0.00 -0.00 -1.69 -1.10 116.97 115.79 3dkj h TYR 142 Ca 0.41 0.02 0.00 0.00 0.00 0.00 0.00 58.73 59.15 3dkj h TYR 142 Cb 2.21 -0.17 0.00 0.00 0.00 0.00 0.00 36.73 38.77 3dkj h TYR 142 CO 1.29 0.18 0.00 0.11 -0.00 0.00 0.00 178.16 179.74 3dkj h TRP 143 N 0.45 0.00 0.00 0.10 5.08 -1.91 -3.28 115.95 116.40 3dkj h TRP 143 Ca 0.43 0.00 -0.16 0.00 1.08 0.00 0.00 58.89 60.24 3dkj h TRP 143 Cb 0.98 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 27.12 3dkj h TRP 143 CO -0.00 0.00 -0.75 1.25 -1.28 0.00 0.00 178.44 177.66 3dkj h LEU 144 N 0.00 0.00 -0.42 0.11 5.85 -1.56 -3.10 115.31 116.19 3dkj h LEU 144 Ca 0.00 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.81 3dkj h LEU 144 Cb 0.63 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 41.57 3dkj h LEU 144 CO 0.00 0.75 -0.13 0.74 -0.34 0.00 0.00 178.44 179.45 3dkj h THR 145 N 0.00 0.52 0.00 1.05 2.02 -1.70 -2.63 112.91 112.18 3dkj h THR 145 Ca -0.01 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.17 3dkj h THR 145 Cb 1.35 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 68.29 3dkj h THR 145 CO 0.10 0.00 -0.82 0.59 0.37 0.00 0.00 175.52 175.75 3dkj n ASN 146 N -5.34 0.67 -0.22 4.18 4.13 -1.25 -3.64 115.26 113.79 3dkj n ASN 146 Ca 0.03 -0.43 0.03 0.00 1.68 0.00 0.00 54.58 55.88 3dkj n ASN 146 Cb 0.25 0.64 0.13 0.00 -1.54 0.00 0.00 39.78 39.27 3dkj n ASN 146 CO 0.00 0.00 0.00 -0.25 0.28 0.00 0.00 177.26 177.29 3dkj h TRP 147 N 0.00 0.17 -0.22 3.10 2.91 -1.38 -2.33 115.95 118.19 3dkj h TRP 147 Ca 0.00 0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.06 3dkj h TRP 147 Cb 0.58 0.03 0.00 0.00 -0.51 0.00 0.00 29.16 29.26 3dkj h TRP 147 CO 0.00 -0.09 0.00 0.44 -1.03 0.00 0.00 178.44 177.76 3dkj n ILE 148 N -5.18 0.29 -0.23 2.65 -5.35 -1.18 -4.08 119.36 106.27 3dkj n ILE 148 Ca 0.11 -0.39 0.03 0.00 -0.27 0.00 0.00 62.75 62.23 3dkj n ILE 148 Cb 0.38 0.35 0.13 0.00 -1.74 0.00 0.00 39.64 38.76 3dkj n ILE 148 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3dkj h GLU 149 N 2.23 0.11 -0.10 6.28 4.81 -1.52 -2.22 114.58 124.16 3dkj h GLU 149 Ca 0.00 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3dkj h GLU 149 Cb 0.49 -0.02 -0.00 0.00 0.63 0.00 0.00 28.75 29.84 3dkj h GLU 149 CO 0.00 0.07 0.05 1.15 -0.73 0.00 0.00 179.01 179.56 3dkj h THR 150 N 0.11 1.08 -0.32 0.32 2.02 -1.79 0.95 112.91 115.30 3dkj h THR 150 Ca 0.37 -0.23 -0.11 0.00 0.77 0.00 0.00 66.41 67.21 3dkj h THR 150 Cb 0.63 1.06 -0.01 0.00 -1.74 0.00 0.00 68.15 68.09 3dkj h THR 150 CO -0.60 0.07 -0.25 -0.29 0.37 0.00 0.00 175.52 174.83 3dkj h ILE 151 N 0.07 1.27 0.00 3.11 2.10 -1.74 -3.13 117.51 119.19 3dkj h ILE 151 Ca 0.03 -1.32 -0.25 0.00 1.08 0.00 0.00 64.86 64.41 3dkj h ILE 151 Cb 0.07 1.30 0.01 0.00 -1.09 0.00 0.00 36.82 37.11 3dkj h ILE 151 CO -0.01 0.43 -1.00 -0.07 -1.08 0.00 0.00 178.15 176.42 3dkj h LEU 152 N 0.55 0.76 -2.20 2.19 3.38 -0.92 -3.16 115.31 115.91 3dkj h LEU 152 Ca 0.08 -0.61 -0.01 0.00 0.09 0.00 0.00 57.88 57.43 3dkj h LEU 152 Cb 0.71 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 3dkj h LEU 152 CO 0.05 1.41 -0.05 0.58 0.09 0.00 0.00 178.44 180.52 3dkj h VAL 153 N 0.33 0.61 0.00 1.22 2.07 -0.79 -0.14 116.25 119.55 3dkj h VAL 153 Ca -0.11 -0.23 0.00 0.00 0.82 0.00 0.00 66.70 67.18 3dkj h VAL 153 Cb 1.65 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 32.56 3dkj h VAL 153 CO 0.19 0.05 0.01 0.00 0.02 0.00 0.00 177.57 177.85 3dkj n GLN 154 N -3.85 0.09 0.26 1.57 6.02 -1.19 -0.19 117.38 120.10 3dkj n GLN 154 Ca -0.03 0.59 0.16 0.00 -0.01 0.00 0.00 57.00 57.71 3dkj n GLN 154 Cb 0.15 -1.83 0.84 0.00 1.02 0.00 0.00 30.24 30.42 3dkj n GLN 154 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3dkj h SER 155 N 0.00 0.00 -0.78 1.08 4.64 -1.20 -1.93 113.55 115.36 3dkj h SER 155 Ca 0.00 0.00 0.17 0.00 -0.47 0.00 0.00 61.79 61.49 3dkj h SER 155 Cb 0.03 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.07 3dkj h SER 155 CO 0.00 0.00 0.53 4.11 -0.87 0.00 0.00 176.83 180.60 3dkj h TRP 156 N 0.00 0.41 0.23 4.77 5.08 -0.81 -2.26 115.95 123.37 3dkj h TRP 156 Ca 0.00 0.01 -0.01 0.00 1.08 0.00 0.00 58.89 59.97 3dkj h TRP 156 Cb 0.20 -0.13 0.00 0.00 -3.00 0.00 0.00 29.16 26.23 3dkj h TRP 156 CO 0.00 0.14 -0.11 -0.92 -1.28 0.00 0.00 178.44 176.27 3dkj h TYR 157 N 0.34 -0.29 -0.47 0.12 3.20 -1.59 0.37 116.97 118.65 3dkj h TYR 157 Ca 0.39 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.23 3dkj h TYR 157 Cb 1.02 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 39.36 3dkj h TYR 157 CO -0.00 0.05 0.19 -1.00 -1.64 0.00 0.00 178.16 175.76 3dkj h PRO 158 N -0.95 0.66 -0.30 1.82 0.13 -1.74 -1.05 132.00 130.57 3dkj h PRO 158 Ca -0.03 -0.09 0.05 0.00 -0.87 0.00 0.00 66.00 65.06 3dkj h PRO 158 Cb 0.47 -0.12 -0.05 0.00 0.13 0.00 0.00 31.00 31.43 3dkj h PRO 158 CO 0.05 0.55 0.01 0.82 -0.23 0.00 0.00 178.00 179.20 3dkj h ILE 159 N 0.66 0.79 -0.30 -3.56 2.04 -1.34 -1.40 117.51 114.41 3dkj h ILE 159 Ca 0.16 -0.04 -0.15 0.00 1.00 0.00 0.00 64.86 65.83 3dkj h ILE 159 Cb 0.13 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 3dkj h ILE 159 CO -0.02 0.02 -0.41 0.74 0.00 0.00 0.00 178.15 178.48 3dkj h THR 160 N 0.10 1.29 -0.09 -0.27 2.02 -0.42 0.22 112.91 115.76 3dkj h THR 160 Ca 0.14 -1.60 -0.00 0.00 0.77 0.00 0.00 66.41 65.72 3dkj h THR 160 Cb 0.19 1.60 -0.00 0.00 -1.74 0.00 0.00 68.15 68.19 3dkj h THR 160 CO -0.23 0.52 0.04 0.58 0.37 0.00 0.00 175.52 176.79 3dkj h VAL 161 N 0.57 1.12 -0.82 3.16 2.07 -1.19 0.22 116.25 121.38 3dkj h VAL 161 Ca 0.03 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.21 3dkj h VAL 161 Cb 1.01 1.20 -0.04 0.00 -1.52 0.00 0.00 31.29 31.93 3dkj h VAL 161 CO 0.10 0.10 0.54 0.00 0.02 0.00 0.00 177.57 178.33 3dkj h ALA 162 N 0.91 1.03 0.23 1.67 0.00 -1.11 -0.42 119.26 121.56 3dkj h ALA 162 Ca 0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 3dkj h ALA 162 Cb 0.13 -0.33 0.00 0.00 0.00 0.00 0.00 17.79 17.59 3dkj h ALA 162 CO -0.00 0.45 -0.11 1.15 0.00 0.00 0.00 179.25 180.74 3dkj h THR 163 N 1.11 0.84 -0.66 0.00 2.02 -0.79 -1.42 112.91 114.01 3dkj h THR 163 Ca 0.30 -0.55 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 3dkj h THR 163 Cb -0.12 1.15 -0.03 0.00 -1.74 0.00 0.00 68.15 67.41 3dkj h THR 163 CO -0.06 0.12 0.36 -1.13 0.37 0.00 0.00 175.52 175.17 3dkj h ASN 164 N -0.59 0.82 -0.34 4.18 -1.24 -0.44 -0.92 115.58 117.05 3dkj h ASN 164 Ca -0.03 -0.06 -0.03 0.00 0.71 0.00 0.00 56.30 56.88 3dkj h ASN 164 Cb 0.43 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.26 3dkj h ASN 164 CO 0.05 0.66 0.09 -1.28 -1.29 0.00 0.00 177.43 175.66 3dkj h SER 165 N 0.92 0.51 -0.58 1.15 0.87 -1.06 -2.29 113.55 113.08 3dkj h SER 165 Ca 0.24 -0.23 -0.04 0.00 -1.23 0.00 0.00 61.79 60.53 3dkj h SER 165 Cb 0.03 -0.13 -0.03 0.00 -0.44 0.00 0.00 62.40 61.83 3dkj h SER 165 CO -0.04 0.60 0.21 -0.09 -0.53 0.00 0.00 176.83 176.98 3dkj h ARG 166 N 0.39 0.92 -0.93 2.24 2.43 -0.94 -1.03 114.38 117.44 3dkj h ARG 166 Ca 0.11 -0.16 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 3dkj h ARG 166 Cb 0.29 -0.15 -0.04 0.00 -0.42 0.00 0.00 29.97 29.64 3dkj h ARG 166 CO 0.00 0.78 0.55 0.93 -1.51 0.00 0.00 179.97 180.72 3dkj h GLU 167 N 0.89 1.27 -0.54 0.20 4.39 -0.95 -1.07 114.58 118.77 3dkj h GLU 167 Ca 0.20 -0.12 -0.10 0.00 0.34 0.00 0.00 59.36 59.69 3dkj h GLU 167 Cb 0.23 -0.26 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 3dkj h GLU 167 CO -0.01 0.89 -0.04 1.96 -1.16 0.00 0.00 179.01 180.65 3dkj h GLN 168 N 1.29 0.97 -0.91 2.33 4.20 -0.92 -2.55 115.11 119.51 3dkj h GLN 168 Ca 0.33 -0.31 0.05 0.00 0.06 0.00 0.00 58.65 58.78 3dkj h GLN 168 Cb -0.04 -0.09 -0.06 0.00 0.30 0.00 0.00 27.48 27.60 3dkj h GLN 168 CO -0.06 0.98 0.60 -0.22 -0.67 0.00 0.00 178.83 179.46 3dkj h LYS 169 N 0.88 1.07 -0.52 1.46 3.64 -0.40 -0.55 116.57 122.14 3dkj h LYS 169 Ca 0.15 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3dkj h LYS 169 Cb 0.57 -0.24 -0.02 0.00 -0.41 0.00 0.00 32.23 32.13 3dkj h LYS 169 CO 0.03 0.71 0.25 0.87 -2.27 0.00 0.00 179.45 179.04 3dkj h LYS 170 N 1.10 0.76 0.03 1.90 1.57 -0.82 0.16 116.57 121.28 3dkj h LYS 170 Ca 0.38 -0.11 -0.00 0.00 -1.87 0.00 0.00 60.65 59.04 3dkj h LYS 170 Cb 0.09 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.27 3dkj h LYS 170 CO -0.13 0.63 -0.02 0.82 -0.57 0.00 0.00 179.45 180.19 3dkj h ILE 171 N 0.70 1.06 -0.34 1.86 2.04 -1.21 -1.11 117.51 120.51 3dkj h ILE 171 Ca 0.18 -0.31 0.03 0.00 1.00 0.00 0.00 64.86 65.76 3dkj h ILE 171 Cb 0.12 1.27 -0.03 0.00 -0.74 0.00 0.00 36.82 37.44 3dkj h ILE 171 CO -0.02 0.08 0.14 -0.07 0.00 0.00 0.00 178.15 178.28 3dkj h LEU 172 N -0.18 0.18 -0.64 1.44 3.38 -0.97 -2.25 115.31 116.27 3dkj h LEU 172 Ca -0.00 0.03 0.04 0.00 0.09 0.00 0.00 57.88 58.03 3dkj h LEU 172 Cb 0.16 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 3dkj h LEU 172 CO 0.01 0.14 0.38 0.00 0.09 0.00 0.00 178.44 179.06 3dkj h ALA 173 N 1.20 0.83 0.44 1.53 0.00 -0.59 0.14 119.26 122.81 3dkj h ALA 173 Ca 0.15 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 3dkj h ALA 173 Cb 0.10 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.72 3dkj h ALA 173 CO -0.13 0.11 -0.21 -0.22 0.00 0.00 0.00 179.25 178.80 3dkj h LYS 174 N 0.74 -0.57 -0.14 0.00 3.64 -0.91 -0.09 116.57 119.24 3dkj h LYS 174 Ca 0.26 0.04 -0.14 0.00 -1.27 0.00 0.00 60.65 59.54 3dkj h LYS 174 Cb 0.06 0.13 -0.01 0.00 -0.41 0.00 0.00 32.23 32.00 3dkj h LYS 174 CO -0.12 -0.37 -0.51 1.88 -2.27 0.00 0.00 179.45 178.06 3dkj h TYR 175 N -0.60 0.48 -0.29 1.91 -1.99 -1.32 -1.71 116.97 113.45 3dkj h TYR 175 Ca -0.06 -0.16 -0.05 0.00 2.00 0.00 0.00 58.73 60.46 3dkj h TYR 175 Cb 0.46 -0.10 -0.01 0.00 2.00 0.00 0.00 36.73 39.08 3dkj h TYR 175 CO -0.04 0.82 -0.00 1.25 -0.00 0.00 0.00 178.16 180.19 3dkj h LEU 176 N 0.31 0.50 -0.28 3.88 5.85 -0.64 -1.24 115.31 123.68 3dkj h LEU 176 Ca 0.01 -0.31 0.04 0.00 0.84 0.00 0.00 57.88 58.47 3dkj h LEU 176 Cb 1.01 -0.13 -0.04 0.00 0.37 0.00 0.00 40.66 41.86 3dkj h LEU 176 CO 0.09 0.69 0.03 0.25 -0.34 0.00 0.00 178.44 179.15 3dkj h LEU 177 N 0.30 -0.05 -0.52 2.25 5.85 -0.97 0.42 115.31 122.59 3dkj h LEU 177 Ca 0.08 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.78 3dkj h LEU 177 Cb 0.43 0.09 -0.02 0.00 0.37 0.00 0.00 40.66 41.53 3dkj h LEU 177 CO 0.02 0.01 0.03 -0.33 -0.34 0.00 0.00 178.44 177.83 3dkj h GLU 178 N 0.12 0.90 0.00 1.25 5.08 -1.25 0.34 114.58 121.03 3dkj h GLU 178 Ca 0.13 -0.27 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3dkj h GLU 178 Cb 0.16 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.32 3dkj h GLU 178 CO -0.20 0.91 -0.64 0.25 -1.00 0.00 0.00 179.01 178.33 3dkj n THR 179 N -4.32 0.33 0.00 1.13 -2.24 -0.48 -4.48 114.28 104.22 3dkj n THR 179 Ca 0.01 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.53 3dkj n THR 179 Cb 0.30 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 3dkj n THR 179 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3dkj n SER 180 N -2.09 1.07 0.00 3.42 3.41 0.13 -4.59 113.62 114.97 3dkj n SER 180 Ca 0.03 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.58 3dkj n SER 180 Cb 0.44 0.34 0.00 0.00 -0.26 0.00 0.00 64.21 64.73 3dkj n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dkj n GLY 181 N 0.67 0.77 3.29 5.00 0.00 0.12 -4.86 105.19 110.17 3dkj n GLY 181 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 3dkj n GLY 181 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dkj n ASN 182 N 0.00 -1.81 -0.25 1.61 0.23 -1.26 -4.98 115.26 108.80 3dkj n ASN 182 Ca 0.00 -2.54 0.05 0.00 -0.53 0.00 0.00 54.58 51.57 3dkj n ASN 182 Cb 0.00 3.09 0.11 0.00 -2.08 0.00 0.00 39.78 40.90 3dkj n ASN 182 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3dkj n LEU 183 N 0.00 2.54 -4.68 -4.53 4.32 -1.26 -3.51 117.00 109.88 3dkj n LEU 183 Ca -0.05 -2.51 -0.45 0.00 -0.02 0.00 0.00 56.01 52.97 3dkj n LEU 183 Cb 0.54 -0.26 -0.03 0.00 -1.62 0.00 0.00 43.42 42.04 3dkj n LEU 183 CO 0.26 0.63 1.13 0.47 -1.22 0.00 0.00 177.39 178.66 3dkj n ASP 184 N -0.66 3.04 0.00 -1.43 8.00 -1.26 -1.50 116.55 122.73 3dkj n ASP 184 Ca 0.10 1.11 0.00 0.00 0.71 0.00 0.00 54.79 56.71 3dkj n ASP 184 Cb 0.50 -1.44 0.00 0.00 -0.02 0.00 0.00 41.12 40.16 3dkj n ASP 184 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dkj n GLY 185 N 2.82 1.31 0.35 0.44 0.00 -1.26 -4.91 105.19 103.94 3dkj n GLY 185 Ca 0.14 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.31 3dkj n GLY 185 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dkj h LEU 186 N 0.00 0.73 0.00 0.99 5.85 -1.68 -0.28 115.31 120.92 3dkj h LEU 186 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3dkj h LEU 186 Cb 0.00 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.02 3dkj h LEU 186 CO 0.00 0.21 0.00 -0.62 -0.34 0.00 0.00 178.44 177.69 3dkj n GLU 187 N -4.82 0.87 -0.05 1.25 1.02 -1.26 -2.13 120.64 115.52 3dkj n GLU 187 Ca 0.25 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.40 3dkj n GLU 187 Cb 0.63 -1.24 0.05 0.00 -0.02 0.00 0.00 31.44 30.86 3dkj n GLU 187 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3dkj n TYR 188 N -0.74 0.13 0.60 -0.32 4.02 -0.12 -0.53 117.16 120.21 3dkj n TYR 188 Ca 0.10 -0.42 0.12 0.00 -0.01 0.00 0.00 57.90 57.70 3dkj n TYR 188 Cb 0.05 -0.04 0.26 0.00 -0.02 0.00 0.00 39.34 39.59 3dkj n TYR 188 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 3dkj n LYS 189 N -0.10 0.27 -3.75 -0.72 4.76 -0.90 -4.62 118.16 113.10 3dkj n LYS 189 Ca 0.04 0.13 -0.29 0.00 -2.87 0.00 0.00 58.31 55.31 3dkj n LYS 189 Cb 0.27 -1.72 -0.15 0.00 -1.84 0.00 0.00 35.03 31.59 3dkj n LYS 189 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3dkj s LEU 190 N -4.29 2.08 -0.10 -0.35 2.96 -1.26 -0.84 118.68 116.89 3dkj s LEU 190 Ca 0.08 -1.46 -0.15 0.00 -0.22 0.00 0.00 54.13 52.38 3dkj s LEU 190 Cb 0.13 -0.84 -0.05 0.00 0.50 0.00 0.00 46.19 45.93 3dkj s LEU 190 CO 0.68 -0.38 0.37 -2.28 -1.32 0.00 0.00 176.35 173.41 3dkj s HIS 191 N 1.64 3.56 -0.34 5.38 5.65 0.33 -4.60 115.29 126.92 3dkj s HIS 191 Ca 0.07 0.79 -0.29 0.00 0.25 0.00 0.00 55.06 55.88 3dkj s HIS 191 Cb -0.17 -2.36 0.00 0.00 -1.18 0.00 0.00 32.58 28.87 3dkj s HIS 191 CO -0.21 0.37 1.38 0.34 -0.65 0.00 0.00 174.74 175.98 3dkj s ASP 192 N -0.04 6.50 -0.04 9.88 -1.08 -1.03 -0.80 116.67 130.04 3dkj s ASP 192 Ca 0.21 1.10 0.13 0.00 -0.52 0.00 0.00 52.55 53.46 3dkj s ASP 192 Cb -0.15 -2.54 0.38 0.00 -1.46 0.00 0.00 42.92 39.16 3dkj s ASP 192 CO 0.08 -1.25 1.32 0.49 0.52 0.00 0.00 175.17 176.33 3dkj n PHE 193 N 8.23 0.63 1.68 -5.34 0.99 -0.11 -0.95 117.46 122.59 3dkj n PHE 193 Ca 0.16 -0.59 0.13 0.00 -0.00 0.00 0.00 57.45 57.16 3dkj n PHE 193 Cb 0.47 -0.10 0.63 0.00 -1.00 0.00 0.00 39.48 39.49 3dkj n PHE 193 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3dkj n GLY 194 N 0.36 -0.42 0.18 1.37 0.00 -1.23 -4.47 105.19 100.99 3dkj n GLY 194 Ca 0.15 -0.31 -0.03 0.00 0.00 0.00 0.00 46.02 45.82 3dkj n GLY 194 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3dkj h TYR 195 N 1.23 0.02 0.00 1.61 5.03 -1.90 -1.98 116.97 120.98 3dkj h TYR 195 Ca 0.00 0.03 -0.05 0.00 2.58 0.00 0.00 58.73 61.29 3dkj h TYR 195 Cb 0.26 0.06 -0.01 0.00 1.55 0.00 0.00 36.73 38.59 3dkj h TYR 195 CO 0.02 -0.07 -0.25 0.07 -1.32 0.00 0.00 178.16 176.61 3dkj h ARG 196 N 0.14 0.00 -0.13 1.82 0.11 -1.99 -3.30 114.38 111.02 3dkj h ARG 196 Ca 0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.30 3dkj h ARG 196 Cb 0.32 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.40 3dkj h ARG 196 CO -0.35 0.25 0.00 0.41 0.10 0.00 0.00 179.97 180.38 3dkj n GLY 197 N 0.52 0.76 3.99 0.08 0.00 -0.76 -4.90 105.19 104.86 3dkj n GLY 197 Ca 0.01 -0.58 -0.22 0.00 0.00 0.00 0.00 46.02 45.23 3dkj n GLY 197 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dkj s VAL 198 N -1.85 2.45 -0.67 1.61 -7.23 -1.08 -4.72 120.40 108.91 3dkj s VAL 198 Ca 0.34 -0.68 0.24 0.00 -1.81 0.00 0.00 61.98 60.07 3dkj s VAL 198 Cb 0.20 -2.77 0.06 0.00 0.56 0.00 0.00 36.38 34.44 3dkj s VAL 198 CO 0.31 0.00 1.36 -1.54 -0.31 0.00 0.00 175.10 174.92 3dkj n SER 199 N -2.49 0.69 -3.72 4.85 3.41 -1.26 -4.95 113.62 110.15 3dkj n SER 199 Ca 0.11 0.13 -0.06 0.00 -0.26 0.00 0.00 58.87 58.79 3dkj n SER 199 Cb 0.60 0.10 -0.02 0.00 -0.26 0.00 0.00 64.21 64.63 3dkj n SER 199 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3dkj s SER 200 N -4.16 -0.26 0.19 4.04 1.04 -1.26 -5.01 113.70 108.28 3dkj s SER 200 Ca 0.07 -0.37 -0.11 0.00 0.48 0.00 0.00 55.95 56.02 3dkj s SER 200 Cb 0.14 0.55 0.21 0.00 0.10 0.00 0.00 66.02 67.02 3dkj s SER 200 CO 0.71 -1.00 1.77 1.56 0.98 0.00 0.00 173.24 177.26 3dkj h GLN 201 N 2.00 0.45 -0.54 4.02 1.08 -1.94 -1.42 115.11 118.77 3dkj h GLN 201 Ca -0.23 -0.03 -0.03 0.00 -1.45 0.00 0.00 58.65 56.91 3dkj h GLN 201 Cb 1.25 -0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 28.55 3dkj h GLN 201 CO 0.27 0.30 0.24 1.49 -0.95 0.00 0.00 178.83 180.17 3dkj h GLU 202 N 0.47 0.80 -0.96 1.46 4.81 -2.01 -2.50 114.58 116.65 3dkj h GLU 202 Ca 0.27 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.36 3dkj h GLU 202 Cb 0.25 -0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.45 3dkj h GLU 202 CO -0.23 0.68 0.61 1.15 -0.73 0.00 0.00 179.01 180.49 3dkj h THR 203 N 0.74 1.26 -0.22 0.32 2.02 -1.92 -2.31 112.91 112.79 3dkj h THR 203 Ca 0.18 -0.51 0.05 0.00 0.77 0.00 0.00 66.41 66.91 3dkj h THR 203 Cb 0.16 -0.13 -0.05 0.00 -1.74 0.00 0.00 68.15 66.39 3dkj h THR 203 CO -0.02 0.26 -0.12 0.00 0.37 0.00 0.00 175.52 176.00 3dkj h ALA 204 N 1.34 0.05 -0.07 6.16 0.00 -0.82 0.15 119.26 126.07 3dkj h ALA 204 Ca 0.35 0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.34 3dkj h ALA 204 Cb -0.10 0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 3dkj h ALA 204 CO -0.07 -0.54 0.04 0.78 0.00 0.00 0.00 179.25 179.45 3dkj h GLY 205 N -0.11 0.11 0.88 0.00 0.00 -1.28 0.12 103.07 102.80 3dkj h GLY 205 Ca 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.40 3dkj h GLY 205 CO -0.29 0.05 -0.10 -2.22 0.00 0.00 0.00 176.54 173.99 3dkj h ILE 206 N -0.00 0.78 -0.51 2.60 2.04 -1.09 -1.11 117.51 120.22 3dkj h ILE 206 Ca 0.02 0.00 -0.08 0.00 1.00 0.00 0.00 64.86 65.81 3dkj h ILE 206 Cb 0.12 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 36.96 3dkj h ILE 206 CO -0.00 0.00 0.02 1.23 0.00 0.00 0.00 178.15 179.39 3dkj h GLY 207 N -0.22 0.96 1.03 5.37 0.00 -0.66 -1.61 103.07 107.94 3dkj h GLY 207 Ca 0.00 -0.69 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 3dkj h GLY 207 CO -0.02 0.64 0.38 0.00 0.00 0.00 0.00 176.54 177.53 3dkj h ALA 208 N 0.94 1.05 -0.54 3.60 0.00 -0.93 -2.14 119.26 121.24 3dkj h ALA 208 Ca 0.15 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3dkj h ALA 208 Cb 0.50 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3dkj h ALA 208 CO 0.02 0.62 0.11 0.66 0.00 0.00 0.00 179.25 180.67 3dkj h SER 209 N 1.16 0.79 -0.57 0.00 4.64 -0.82 -2.61 113.55 116.13 3dkj h SER 209 Ca 0.28 -0.15 -0.09 0.00 -0.47 0.00 0.00 61.79 61.36 3dkj h SER 209 Cb 0.13 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.00 3dkj h SER 209 CO -0.03 0.78 0.00 0.00 -0.87 0.00 0.00 176.83 176.71 3dkj h ALA 210 N 1.32 0.77 -0.66 5.18 0.00 -0.83 -2.72 119.26 122.31 3dkj h ALA 210 Ca 0.17 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3dkj h ALA 210 Cb 0.32 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3dkj h ALA 210 CO 0.00 0.60 0.34 1.25 0.00 0.00 0.00 179.25 181.43 3dkj h HIS 211 N 0.89 0.92 0.00 0.00 6.17 -1.29 -2.66 115.15 119.18 3dkj h HIS 211 Ca 0.16 -0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.22 3dkj h HIS 211 Cb 0.54 -0.29 0.00 0.00 2.52 0.00 0.00 27.41 30.18 3dkj h HIS 211 CO 0.04 0.66 0.00 1.28 0.71 0.00 0.00 177.93 180.62 3dkj n LEU 212 N -4.36 0.13 0.13 0.26 4.77 -1.00 -1.36 117.00 115.58 3dkj n LEU 212 Ca 0.06 0.54 0.08 0.00 -0.03 0.00 0.00 56.01 56.66 3dkj n LEU 212 Cb 0.12 -0.52 0.57 0.00 -2.33 0.00 0.00 43.42 41.25 3dkj n LEU 212 CO 0.38 -0.37 1.12 0.58 -1.33 0.00 0.00 177.39 177.77 3dkj h VAL 213 N 0.00 1.00 0.00 4.08 2.07 -1.39 -3.31 116.25 118.69 3dkj h VAL 213 Ca 0.00 -0.07 -0.14 0.00 0.82 0.00 0.00 66.70 67.32 3dkj h VAL 213 Cb 0.22 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 3dkj h VAL 213 CO 0.00 0.04 -1.56 0.59 0.02 0.00 0.00 177.57 176.66 3dkj n ASN 214 N -4.50 2.92 -4.20 0.57 3.02 -0.47 -4.63 115.26 107.97 3dkj n ASN 214 Ca 0.01 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.33 3dkj n ASN 214 Cb 0.15 0.79 -0.09 0.00 -0.61 0.00 0.00 39.78 40.02 3dkj n ASN 214 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3dkj s PHE 215 N -2.25 1.79 -0.03 3.10 0.40 -0.89 -4.82 117.98 115.28 3dkj s PHE 215 Ca -0.04 -1.21 0.00 0.00 -0.60 0.00 0.00 56.93 55.09 3dkj s PHE 215 Cb 0.03 -1.14 -0.00 0.00 0.51 0.00 0.00 43.02 42.41 3dkj s PHE 215 CO 0.35 -0.25 0.18 1.63 0.70 0.00 0.00 175.22 177.83 3dkj n LYS 216 N -0.80 4.37 -3.68 0.44 5.02 0.31 -4.33 118.16 119.50 3dkj n LYS 216 Ca -0.04 -0.17 -0.37 0.00 -2.02 0.00 0.00 58.31 55.71 3dkj n LYS 216 Cb 0.65 -0.67 -0.10 0.00 -0.02 0.00 0.00 35.03 34.89 3dkj n LYS 216 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3dkj s GLY 217 N -0.71 1.95 -0.09 0.72 0.00 -1.25 -0.48 107.32 107.46 3dkj s GLY 217 Ca 0.00 -0.95 -0.11 0.00 0.00 0.00 0.00 44.72 43.67 3dkj s GLY 217 CO 0.01 0.44 0.29 -1.08 0.00 0.00 0.00 173.10 172.76 3dkj s THR 218 N 1.22 0.01 -1.78 0.90 -1.32 -0.73 -2.48 115.64 111.45 3dkj s THR 218 Ca 0.07 -0.10 0.17 0.00 -1.21 0.00 0.00 61.69 60.62 3dkj s THR 218 Cb -0.14 -0.44 0.04 0.00 -1.51 0.00 0.00 72.50 70.45 3dkj s THR 218 CO 0.06 -0.05 0.95 0.47 -2.21 0.00 0.00 174.62 173.83 3dkj n ASP 219 N 2.63 1.96 -4.44 8.08 9.92 -0.13 -4.20 116.55 130.37 3dkj n ASP 219 Ca -0.14 -1.48 -0.44 0.00 -0.53 0.00 0.00 54.79 52.20 3dkj n ASP 219 Cb 0.58 0.31 -0.01 0.00 -0.64 0.00 0.00 41.12 41.35 3dkj n ASP 219 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 3dkj s THR 220 N -1.81 4.96 0.41 -3.53 2.01 -1.25 -4.85 115.64 111.58 3dkj s THR 220 Ca 0.16 -2.12 0.13 0.00 0.31 0.00 0.00 61.69 60.17 3dkj s THR 220 Cb 0.14 -4.80 0.33 0.00 0.01 0.00 0.00 72.50 68.18 3dkj s THR 220 CO 0.36 -1.51 1.95 0.58 -0.69 0.00 0.00 174.62 175.31 3dkj h VAL 221 N 5.23 0.87 -0.78 3.82 2.07 -1.96 -2.27 116.25 123.23 3dkj h VAL 221 Ca 0.22 -0.17 0.20 0.00 0.82 0.00 0.00 66.70 67.77 3dkj h VAL 221 Cb 0.96 0.35 -0.04 0.00 -1.52 0.00 0.00 31.29 31.04 3dkj h VAL 221 CO 1.13 0.09 0.55 0.00 0.02 0.00 0.00 177.57 179.35 3dkj h ALA 222 N 1.66 2.50 -0.52 1.67 0.00 -1.90 -0.87 119.26 121.81 3dkj h ALA 222 Ca 0.33 -0.01 0.07 0.00 0.00 0.00 0.00 54.91 55.29 3dkj h ALA 222 Cb 0.62 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.40 3dkj h ALA 222 CO -0.11 -0.73 0.35 0.78 0.00 0.00 0.00 179.25 179.54 3dkj h GLY 223 N 0.15 0.54 0.85 0.00 0.00 -1.57 -3.20 103.07 99.86 3dkj h GLY 223 Ca 0.38 -0.17 -0.02 0.00 0.00 0.00 0.00 47.33 47.52 3dkj h GLY 223 CO -0.06 0.13 0.05 1.41 0.00 0.00 0.00 176.54 178.06 3dkj h LEU 224 N 0.43 0.28 -0.49 3.11 4.07 -1.36 -2.32 115.31 119.03 3dkj h LEU 224 Ca 0.23 -0.22 -0.16 0.00 0.08 0.00 0.00 57.88 57.80 3dkj h LEU 224 Cb 0.35 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.01 3dkj h LEU 224 CO -0.06 0.43 -0.55 0.00 -1.08 0.00 0.00 178.44 177.18 3dkj h ALA 225 N 0.86 0.67 -0.00 1.53 0.00 -1.71 -1.53 119.26 119.08 3dkj h ALA 225 Ca 0.06 -0.51 0.02 0.00 0.00 0.00 0.00 54.91 54.47 3dkj h ALA 225 Cb 0.26 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 3dkj h ALA 225 CO -0.00 0.69 -0.09 1.25 0.00 0.00 0.00 179.25 181.09 3dkj h LEU 226 N 0.46 -0.27 -0.17 0.00 6.46 -1.54 0.65 115.31 120.91 3dkj h LEU 226 Ca 0.01 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 3dkj h LEU 226 Cb 1.10 0.12 -0.01 0.00 -0.73 0.00 0.00 40.66 41.14 3dkj h LEU 226 CO 0.11 -0.14 0.11 0.40 -0.62 0.00 0.00 178.44 178.29 3dkj h ILE 227 N -0.16 1.06 -0.61 4.05 2.04 -1.22 0.60 117.51 123.26 3dkj h ILE 227 Ca 0.04 -0.12 0.08 0.00 1.00 0.00 0.00 64.86 65.85 3dkj h ILE 227 Cb 0.21 0.84 -0.06 0.00 -0.74 0.00 0.00 36.82 37.07 3dkj h ILE 227 CO -0.10 0.05 0.27 0.50 0.00 0.00 0.00 178.15 178.88 3dkj h LYS 228 N 0.21 0.47 0.07 2.37 3.64 -1.05 0.22 116.57 122.50 3dkj h LYS 228 Ca 0.06 -0.03 -0.25 0.00 -1.27 0.00 0.00 60.65 59.16 3dkj h LYS 228 Cb -0.00 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.71 3dkj h LYS 228 CO -0.01 0.31 -1.09 -0.22 -2.27 0.00 0.00 179.45 176.17 3dkj h LYS 229 N 0.49 0.34 0.00 1.90 3.64 -0.57 -3.36 116.57 119.00 3dkj h LYS 229 Ca 0.30 -0.45 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 3dkj h LYS 229 Cb 0.31 0.15 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 3dkj h LYS 229 CO -0.25 1.16 -1.64 0.66 -2.27 0.00 0.00 179.45 177.10 3dkj n TYR 230 N -3.65 0.00 0.07 1.91 4.02 0.18 -4.89 117.16 114.80 3dkj n TYR 230 Ca -0.08 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.81 3dkj n TYR 230 Cb 0.92 -0.33 0.00 0.00 -0.02 0.00 0.00 39.34 39.91 3dkj n TYR 230 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3dkj n TYR 231 N -1.99 -0.84 0.00 -0.72 4.02 -0.11 -4.82 117.16 112.70 3dkj n TYR 231 Ca -0.02 0.15 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 3dkj n TYR 231 Cb 0.40 0.25 0.00 0.00 -0.02 0.00 0.00 39.34 39.97 3dkj n TYR 231 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dkj n GLY 232 N 2.53 0.28 3.23 2.72 0.00 0.60 -3.58 105.19 110.96 3dkj n GLY 232 Ca 0.00 -1.40 -0.21 0.00 0.00 0.00 0.00 46.02 44.41 3dkj n GLY 232 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dkj s THR 233 N -1.16 1.41 0.19 2.61 -4.23 -1.26 -0.53 115.64 112.67 3dkj s THR 233 Ca 0.00 -1.39 -0.10 0.00 -1.18 0.00 0.00 61.69 59.02 3dkj s THR 233 Cb 0.00 -1.31 0.12 0.00 1.34 0.00 0.00 72.50 72.65 3dkj s THR 233 CO 0.00 -0.11 1.75 0.50 -0.54 0.00 0.00 174.62 176.22 3dkj h LYS 234 N 4.27 1.05 -7.05 3.99 3.64 -1.99 -3.43 116.57 117.04 3dkj h LYS 234 Ca -0.43 -0.19 -0.51 0.00 -1.27 0.00 0.00 60.65 58.25 3dkj h LYS 234 Cb 1.18 -0.17 0.08 0.00 -0.41 0.00 0.00 32.23 32.91 3dkj h LYS 234 CO 0.40 0.87 0.47 -0.51 -2.27 0.00 0.00 179.45 178.41 3dkj s ASP 235 N -6.23 5.83 0.29 4.20 1.01 -1.26 -4.95 116.67 115.56 3dkj s ASP 235 Ca -0.13 2.29 0.03 0.00 0.71 0.00 0.00 52.55 55.45 3dkj s ASP 235 Cb 0.14 -2.60 0.66 0.00 1.01 0.00 0.00 42.92 42.14 3dkj s ASP 235 CO 0.82 -1.15 1.76 -0.65 0.21 0.00 0.00 175.17 176.16 3dkj h PRO 236 N 1.55 0.66 -4.57 8.23 0.11 -2.04 -3.43 132.00 132.50 3dkj h PRO 236 Ca -0.50 -0.04 -0.30 0.00 0.11 0.00 0.00 66.00 65.27 3dkj h PRO 236 Cb 1.26 -0.15 -0.23 0.00 0.11 0.00 0.00 31.00 31.99 3dkj h PRO 236 CO 0.58 0.43 -0.74 0.14 -0.21 0.00 0.00 178.00 178.20 3dkj s VAL 237 N -5.90 0.56 -0.58 3.15 -7.23 -1.26 -4.98 120.40 104.16 3dkj s VAL 237 Ca -0.12 -0.85 0.25 0.00 -1.81 0.00 0.00 61.98 59.46 3dkj s VAL 237 Cb 0.24 -0.58 0.31 0.00 0.56 0.00 0.00 36.38 36.91 3dkj s VAL 237 CO 0.79 -0.21 1.72 1.55 -0.31 0.00 0.00 175.10 178.64 3dkj h PRO 238 N 4.94 0.00 -3.59 4.82 0.13 -1.91 -3.48 132.00 132.91 3dkj h PRO 238 Ca -0.34 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.68 3dkj h PRO 238 Cb 1.20 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.16 3dkj h PRO 238 CO 0.43 0.00 -0.40 0.20 -0.23 0.00 0.00 178.00 178.01 3dkj s GLY 239 N -3.82 0.04 0.07 1.56 0.00 -1.26 -4.74 107.32 99.17 3dkj s GLY 239 Ca 0.09 -0.32 0.02 0.00 0.00 0.00 0.00 44.72 44.51 3dkj s GLY 239 CO 0.61 -0.49 -0.07 -0.19 0.00 0.00 0.00 173.10 172.96 3dkj s TYR 240 N -2.66 0.77 0.29 1.90 1.51 0.37 -4.91 117.35 114.63 3dkj s TYR 240 Ca -0.04 -0.70 0.03 0.00 -1.01 0.00 0.00 57.07 55.34 3dkj s TYR 240 Cb -0.01 -0.46 -0.04 0.00 -0.11 0.00 0.00 41.96 41.35 3dkj s TYR 240 CO -0.04 -0.12 0.16 0.45 -1.11 0.00 0.00 175.55 174.89 3dkj s SER 241 N -2.29 1.36 0.11 2.29 0.15 -1.26 -1.78 113.70 112.28 3dkj s SER 241 Ca 0.01 -1.55 0.04 0.00 0.70 0.00 0.00 55.95 55.15 3dkj s SER 241 Cb -0.03 0.39 -0.04 0.00 -1.71 0.00 0.00 66.02 64.64 3dkj s SER 241 CO -0.02 -0.89 -0.11 0.68 1.20 0.00 0.00 173.24 174.10 3dkj s VAL 242 N -3.67 1.05 0.41 4.45 -7.23 -1.26 -5.09 120.40 109.06 3dkj s VAL 242 Ca 0.37 -1.71 -0.25 0.00 -1.81 0.00 0.00 61.98 58.57 3dkj s VAL 242 Cb 0.05 -1.46 -0.11 0.00 0.56 0.00 0.00 36.38 35.42 3dkj s VAL 242 CO 0.18 -0.55 1.08 -2.65 -0.31 0.00 0.00 175.10 172.84 3dkj n PRO 243 N 0.45 1.51 -3.60 4.82 -0.02 -1.26 -4.88 135.00 132.02 3dkj n PRO 243 Ca -0.15 0.54 -0.15 0.00 -2.02 0.00 0.00 63.50 61.72 3dkj n PRO 243 Cb 0.58 -2.12 -0.07 0.00 -0.02 0.00 0.00 33.50 31.87 3dkj n PRO 243 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dkj s ALA 244 N -1.23 -1.71 0.54 3.55 0.00 -1.26 -1.97 121.76 119.68 3dkj s ALA 244 Ca 0.62 1.69 -0.08 0.00 0.00 0.00 0.00 51.96 54.20 3dkj s ALA 244 Cb -0.56 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 21.81 3dkj s ALA 244 CO 0.57 -0.34 0.89 0.00 0.00 0.00 0.00 175.76 176.89 3dkj s ALA 245 N -0.21 3.27 0.51 0.00 0.00 -0.26 -4.96 121.76 120.10 3dkj s ALA 245 Ca -0.04 -0.33 0.01 0.00 0.00 0.00 0.00 51.96 51.60 3dkj s ALA 245 Cb -0.03 -2.80 -0.01 0.00 0.00 0.00 0.00 23.12 20.28 3dkj s ALA 245 CO 0.04 -0.50 0.03 -1.83 0.00 0.00 0.00 175.76 173.49 3dkj s GLU 246 N -4.93 2.20 0.35 0.00 -1.05 -1.26 -4.45 118.70 109.55 3dkj s GLU 246 Ca 0.51 -2.37 0.03 0.00 -0.15 0.00 0.00 54.97 52.99 3dkj s GLU 246 Cb -0.11 -1.57 0.64 0.00 -0.44 0.00 0.00 34.13 32.66 3dkj s GLU 246 CO 0.49 -0.37 1.96 0.45 0.95 0.00 0.00 175.26 178.73 3dkj h HIS 247 N 1.32 0.67 -0.82 4.83 3.86 -2.00 -2.82 115.15 120.20 3dkj h HIS 247 Ca -0.44 -0.02 -0.02 0.00 -1.16 0.00 0.00 60.37 58.74 3dkj h HIS 247 Cb 1.31 -0.22 -0.04 0.00 1.06 0.00 0.00 27.41 29.53 3dkj h HIS 247 CO 1.48 0.50 0.42 0.66 0.86 0.00 0.00 177.93 181.86 3dkj h SER 248 N 0.69 1.04 1.49 2.45 4.64 -1.98 0.12 113.55 122.01 3dkj h SER 248 Ca 0.17 -0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 3dkj h SER 248 Cb 0.08 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 61.91 3dkj h SER 248 CO -0.02 0.86 0.00 0.71 -0.87 0.00 0.00 176.83 177.50 3dkj h THR 249 N 1.15 0.00 0.00 2.95 1.35 -1.91 -2.36 112.91 114.10 3dkj h THR 249 Ca 0.29 -0.73 -0.09 0.00 -0.55 0.00 0.00 66.41 65.33 3dkj h THR 249 Cb 0.07 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 68.19 3dkj h THR 249 CO -0.04 0.00 -0.71 0.40 -0.25 0.00 0.00 175.52 174.91 3dkj h ILE 250 N 0.00 0.48 0.00 6.82 1.08 -1.32 -3.42 117.51 121.15 3dkj h ILE 250 Ca 0.00 -1.55 -0.06 0.00 -0.39 0.00 0.00 64.86 62.86 3dkj h ILE 250 Cb 0.75 1.09 -0.01 0.00 -3.07 0.00 0.00 36.82 35.58 3dkj h ILE 250 CO 0.00 0.16 -0.30 0.71 -0.69 0.00 0.00 178.15 178.03 3dkj h THR 251 N -1.00 1.16 -1.04 -0.27 1.35 -0.86 -2.50 112.91 109.76 3dkj h THR 251 Ca -0.13 -1.06 0.30 0.00 -0.55 0.00 0.00 66.41 64.96 3dkj h THR 251 Cb 0.80 1.58 -0.04 0.00 -1.73 0.00 0.00 68.15 68.76 3dkj h THR 251 CO -0.08 0.30 0.77 0.00 -0.25 0.00 0.00 175.52 176.25 3dkj h ALA 252 N 1.70 2.97 0.00 6.62 0.00 -1.61 -0.86 119.26 128.08 3dkj h ALA 252 Ca -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3dkj h ALA 252 Cb 0.56 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3dkj h ALA 252 CO 0.04 -1.30 0.00 -1.49 0.00 0.00 0.00 179.25 176.50 3dkj h TRP 253 N 0.00 0.00 0.00 0.00 4.06 -1.71 -3.49 115.95 114.81 3dkj h TRP 253 Ca 0.49 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.44 3dkj h TRP 253 Cb 2.02 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 30.18 3dkj h TRP 253 CO 0.00 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.29 3dkj n GLY 254 N 0.22 2.38 0.31 1.49 0.00 -0.33 -4.53 105.19 104.73 3dkj n GLY 254 Ca 0.02 -1.73 0.08 0.00 0.00 0.00 0.00 46.02 44.39 3dkj n GLY 254 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3dkj h LYS 255 N 0.00 0.29 -0.01 1.61 2.10 -1.93 -0.87 116.57 117.77 3dkj h LYS 255 Ca 0.00 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.63 3dkj h LYS 255 Cb 0.00 -0.07 0.00 0.00 -0.90 0.00 0.00 32.23 31.26 3dkj h LYS 255 CO 0.00 0.19 0.00 -0.25 -2.00 0.00 0.00 179.45 177.39 3dkj n ASP 256 N -4.49 0.37 -0.52 7.07 8.00 -1.26 -4.01 116.55 121.71 3dkj n ASP 256 Ca 0.03 -1.15 0.06 0.00 0.71 0.00 0.00 54.79 54.44 3dkj n ASP 256 Cb 0.18 -0.00 0.11 0.00 -0.02 0.00 0.00 41.12 41.38 3dkj n ASP 256 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3dkj n HIS 257 N -0.70 0.00 -0.26 1.24 8.25 -0.33 -4.76 115.22 118.65 3dkj n HIS 257 Ca 0.22 -0.84 0.07 0.00 -0.26 0.00 0.00 57.72 56.92 3dkj n HIS 257 Cb 0.17 -0.15 0.20 0.00 1.12 0.00 0.00 29.99 31.32 3dkj n HIS 257 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 3dkj h GLU 258 N 0.42 0.21 -0.58 -0.41 4.81 -1.69 -1.21 114.58 116.12 3dkj h GLU 258 Ca -0.04 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3dkj h GLU 258 Cb 1.23 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 30.52 3dkj h GLU 258 CO 0.02 0.14 0.36 -0.22 -0.73 0.00 0.00 179.01 178.57 3dkj h LYS 259 N 0.22 0.69 -0.81 1.92 3.64 -1.93 0.08 116.57 120.38 3dkj h LYS 259 Ca 0.45 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.79 3dkj h LYS 259 Cb 0.81 -0.15 -0.04 0.00 -0.41 0.00 0.00 32.23 32.44 3dkj h LYS 259 CO -0.58 0.45 0.53 -0.44 -2.27 0.00 0.00 179.45 177.14 3dkj h ASP 260 N 0.71 0.93 0.13 4.20 3.32 -1.70 0.74 116.42 124.75 3dkj h ASP 260 Ca 0.23 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.26 3dkj h ASP 260 Cb 0.02 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.32 3dkj h ASP 260 CO -0.10 0.68 -0.16 0.00 -1.72 0.00 0.00 179.24 177.95 3dkj h ALA 261 N 1.29 -0.29 -0.36 3.45 0.00 -0.81 -0.51 119.26 122.03 3dkj h ALA 261 Ca 0.29 -0.04 0.03 0.00 0.00 0.00 0.00 54.91 55.20 3dkj h ALA 261 Cb -0.12 0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3dkj h ALA 261 CO -0.06 -0.69 0.15 0.74 0.00 0.00 0.00 179.25 179.38 3dkj h PHE 262 N -0.33 0.27 0.03 0.00 -1.00 -0.69 -1.29 116.94 113.93 3dkj h PHE 262 Ca 0.01 0.02 -0.00 0.00 2.81 0.00 0.00 57.97 60.81 3dkj h PHE 262 Cb 0.33 -0.07 0.00 0.00 3.61 0.00 0.00 35.95 39.82 3dkj h PHE 262 CO -0.15 0.13 -0.02 1.49 -1.61 0.00 0.00 178.31 178.15 3dkj h GLU 263 N 0.31 -0.04 -0.45 1.51 4.81 -0.66 -1.46 114.58 118.60 3dkj h GLU 263 Ca 0.16 0.00 0.09 0.00 -0.13 0.00 0.00 59.36 59.48 3dkj h GLU 263 Cb 0.10 0.01 -0.09 0.00 0.63 0.00 0.00 28.75 29.40 3dkj h GLU 263 CO -0.14 0.11 -0.14 1.25 -0.73 0.00 0.00 179.01 179.36 3dkj h HIS 264 N -0.18 -0.31 -0.16 0.92 2.76 -0.98 -2.28 115.15 114.92 3dkj h HIS 264 Ca -0.00 0.04 -0.02 0.00 -2.20 0.00 0.00 60.37 58.19 3dkj h HIS 264 Cb 0.17 0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.33 3dkj h HIS 264 CO -0.03 -0.22 0.03 0.82 -1.30 0.00 0.00 177.93 177.23 3dkj h ILE 265 N -0.03 1.21 0.00 6.26 2.04 -0.85 -0.84 117.51 125.30 3dkj h ILE 265 Ca 0.22 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 65.35 3dkj h ILE 265 Cb 0.37 1.36 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 3dkj h ILE 265 CO -0.49 0.20 -0.25 -0.37 0.00 0.00 0.00 178.15 177.24 3dkj h VAL 266 N 0.05 0.84 0.00 1.67 -1.51 -1.21 -2.27 116.25 113.82 3dkj h VAL 266 Ca 0.05 -1.01 -0.26 0.00 -1.23 0.00 0.00 66.70 64.25 3dkj h VAL 266 Cb 0.28 1.60 0.02 0.00 -2.13 0.00 0.00 31.29 31.07 3dkj h VAL 266 CO 0.00 0.25 -1.03 0.74 -1.23 0.00 0.00 177.57 176.30 3dkj h THR 267 N 0.00 1.30 -0.66 7.19 2.02 -1.15 -2.37 112.91 119.24 3dkj h THR 267 Ca -0.00 -2.29 -0.00 0.00 0.77 0.00 0.00 66.41 64.89 3dkj h THR 267 Cb 0.58 2.39 -0.03 0.00 -1.74 0.00 0.00 68.15 69.35 3dkj h THR 267 CO 0.03 0.70 0.40 1.56 0.37 0.00 0.00 175.52 178.58 3dkj h GLN 268 N 0.37 0.89 -2.07 6.66 1.08 -0.87 -3.21 115.11 117.95 3dkj h GLN 268 Ca -0.12 -0.08 -0.63 0.00 -1.45 0.00 0.00 58.65 56.38 3dkj h GLN 268 Cb 1.68 -0.19 -0.39 0.00 -0.05 0.00 0.00 27.48 28.53 3dkj h GLN 268 CO 0.20 0.63 -0.36 1.19 -0.95 0.00 0.00 178.83 179.53 3dkj n PHE 269 N -4.40 3.69 0.24 2.96 3.01 -0.88 -4.88 117.46 117.19 3dkj n PHE 269 Ca 0.07 -3.51 0.13 0.00 1.01 0.00 0.00 57.45 55.15 3dkj n PHE 269 Cb 0.07 -0.51 0.42 0.00 -0.01 0.00 0.00 39.48 39.45 3dkj n PHE 269 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3dkj h SER 270 N 3.03 0.00 0.00 4.37 4.64 -1.43 -3.34 113.55 120.82 3dkj h SER 270 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3dkj h SER 270 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3dkj h SER 270 CO 0.91 0.09 -0.12 -1.54 -0.87 0.00 0.00 176.83 175.30 3dkj n SER 271 N -3.17 1.49 -4.32 4.97 3.41 -1.26 -4.77 113.62 109.97 3dkj n SER 271 Ca 0.02 -2.39 -0.17 0.00 -0.26 0.00 0.00 58.87 56.07 3dkj n SER 271 Cb 0.44 -0.24 -0.10 0.00 -0.26 0.00 0.00 64.21 64.04 3dkj n SER 271 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3dkj s VAL 272 N -1.52 1.04 0.52 -3.33 -7.23 -1.25 -4.77 120.40 103.85 3dkj s VAL 272 Ca 0.15 -2.04 -0.23 0.00 -1.81 0.00 0.00 61.98 58.05 3dkj s VAL 272 Cb 0.13 -2.27 -0.06 0.00 0.56 0.00 0.00 36.38 34.74 3dkj s VAL 272 CO 0.01 -0.39 1.39 -2.65 -0.31 0.00 0.00 175.10 173.15 3dkj n PRO 273 N -0.38 1.88 -3.79 4.82 -0.02 -1.25 -4.59 135.00 131.67 3dkj n PRO 273 Ca -0.06 0.68 -0.15 0.00 -2.02 0.00 0.00 63.50 61.95 3dkj n PRO 273 Cb 0.63 -2.60 -0.16 0.00 -0.02 0.00 0.00 33.50 31.36 3dkj n PRO 273 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3dkj s VAL 274 N -1.26 -0.02 -0.18 -1.45 0.11 -0.86 -4.01 120.40 112.74 3dkj s VAL 274 Ca 0.68 0.21 -0.14 0.00 -2.93 0.00 0.00 61.98 59.80 3dkj s VAL 274 Cb -0.43 -0.11 -0.05 0.00 -1.53 0.00 0.00 36.38 34.26 3dkj s VAL 274 CO 0.52 0.10 0.29 -0.55 -3.33 0.00 0.00 175.10 172.13 3dkj s SER 275 N 1.11 6.38 -0.25 3.54 0.15 -0.83 -0.26 113.70 123.54 3dkj s SER 275 Ca -0.09 0.44 0.00 0.00 0.70 0.00 0.00 55.95 57.01 3dkj s SER 275 Cb -0.13 -2.18 0.07 0.00 -1.71 0.00 0.00 66.02 62.07 3dkj s SER 275 CO -0.03 0.06 -0.02 -0.69 1.20 0.00 0.00 173.24 173.77 3dkj s VAL 276 N 0.71 1.39 -0.01 4.45 1.01 0.25 -1.11 120.40 127.10 3dkj s VAL 276 Ca 0.15 -1.25 -0.33 0.00 0.00 0.00 0.00 61.98 60.56 3dkj s VAL 276 Cb -0.13 -1.76 -0.11 0.00 0.00 0.00 0.00 36.38 34.38 3dkj s VAL 276 CO 0.04 -0.22 1.86 0.55 0.00 0.00 0.00 175.10 177.34 3dkj n VAL 277 N 4.70 0.54 -0.02 2.92 3.14 -1.26 -2.32 118.33 126.03 3dkj n VAL 277 Ca -0.09 -0.10 0.00 0.00 -2.96 0.00 0.00 64.34 61.19 3dkj n VAL 277 Cb 0.44 -1.97 0.00 0.00 -1.06 0.00 0.00 33.84 31.25 3dkj n VAL 277 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 3dkj n SER 278 N 6.37 1.77 -1.26 6.55 7.64 -0.54 -4.68 113.62 129.47 3dkj n SER 278 Ca 0.21 -1.79 0.08 0.00 1.01 0.00 0.00 58.87 58.38 3dkj n SER 278 Cb 0.33 0.00 0.30 0.00 -1.01 0.00 0.00 64.21 63.83 3dkj n SER 278 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3dkj n ASP 279 N -0.39 4.35 -0.30 6.43 3.85 -1.26 -3.88 116.55 125.34 3dkj n ASP 279 Ca 0.00 -2.64 0.12 0.00 -0.71 0.00 0.00 54.79 51.56 3dkj n ASP 279 Cb 0.21 -0.53 0.35 0.00 -1.35 0.00 0.00 41.12 39.80 3dkj n ASP 279 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 3dkj h SER 280 N 2.99 0.71 0.00 -1.12 0.02 -1.96 -3.37 113.55 110.83 3dkj h SER 280 Ca 0.00 0.05 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 3dkj h SER 280 Cb 1.42 -0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.88 3dkj h SER 280 CO 0.24 0.33 -0.70 -1.22 -1.14 0.00 0.00 176.83 174.34 3dkj n TYR 281 N -4.61 0.00 -3.15 3.45 4.02 -1.26 -5.05 117.16 110.56 3dkj n TYR 281 Ca 0.19 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 58.12 3dkj n TYR 281 Cb 0.49 0.11 -0.00 0.00 -0.02 0.00 0.00 39.34 39.93 3dkj n TYR 281 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 3dkj s ASP 282 N -4.71 -1.47 0.28 7.72 -1.08 -1.26 -5.05 116.67 111.11 3dkj s ASP 282 Ca 0.00 0.25 -0.03 0.00 -0.52 0.00 0.00 52.55 52.25 3dkj s ASP 282 Cb 0.00 1.96 0.39 0.00 -1.46 0.00 0.00 42.92 43.81 3dkj s ASP 282 CO 0.00 -0.27 1.94 -0.29 0.52 0.00 0.00 175.17 177.07 3dkj h ILE 283 N 5.83 1.20 -0.24 4.11 6.09 -1.81 -0.86 117.51 131.83 3dkj h ILE 283 Ca -0.04 -0.41 -0.19 0.00 -1.37 0.00 0.00 64.86 62.85 3dkj h ILE 283 Cb 1.19 -0.11 0.00 0.00 0.47 0.00 0.00 36.82 38.37 3dkj h ILE 283 CO 0.13 0.22 -0.59 1.88 -3.07 0.00 0.00 178.15 176.72 3dkj h TYR 284 N 1.20 1.05 -0.40 2.19 0.99 -1.97 -1.38 116.97 118.66 3dkj h TYR 284 Ca 0.35 -0.40 -0.01 0.00 2.00 0.00 0.00 58.73 60.67 3dkj h TYR 284 Cb -0.07 -0.19 -0.02 0.00 1.00 0.00 0.00 36.73 37.45 3dkj h TYR 284 CO -0.00 1.23 0.23 -0.97 -0.00 0.00 0.00 178.16 178.64 3dkj h ASN 285 N 0.58 0.50 -0.78 3.88 -1.24 -1.92 -1.07 115.58 115.54 3dkj h ASN 285 Ca -0.01 -0.08 0.05 0.00 0.71 0.00 0.00 56.30 56.97 3dkj h ASN 285 Cb 1.20 -0.13 -0.05 0.00 0.73 0.00 0.00 38.32 40.07 3dkj h ASN 285 CO 0.13 0.43 0.48 0.00 -1.29 0.00 0.00 177.43 177.18 3dkj h ALA 286 N 1.09 1.04 -0.04 1.57 0.00 -0.93 0.51 119.26 122.49 3dkj h ALA 286 Ca 0.14 -0.01 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 3dkj h ALA 286 Cb 0.04 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.61 3dkj h ALA 286 CO -0.02 0.24 -0.15 0.00 0.00 0.00 0.00 179.25 179.32 3dkj h GLU 288 N -0.37 0.47 0.00 0.00 4.81 -1.05 -1.17 114.58 117.26 3dkj h GLU 288 Ca -0.01 -0.57 -0.34 0.00 -0.13 0.00 0.00 59.36 58.31 3dkj h GLU 288 Cb 0.78 0.18 -0.06 0.00 0.63 0.00 0.00 28.75 30.28 3dkj h GLU 288 CO 0.03 1.22 -2.29 1.17 -0.73 0.00 0.00 179.01 178.41 3dkj n LYS 289 N -4.07 0.58 -0.06 1.92 4.81 0.15 -3.51 118.16 117.99 3dkj n LYS 289 Ca -0.12 0.13 -0.03 0.00 -0.87 0.00 0.00 58.31 57.42 3dkj n LYS 289 Cb 0.79 -1.45 -0.02 0.00 0.02 0.00 0.00 35.03 34.37 3dkj n LYS 289 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 3dkj h ILE 290 N 0.00 0.15 -0.16 3.15 2.04 -1.30 -0.64 117.51 120.75 3dkj h ILE 290 Ca -0.50 -1.12 -0.20 0.00 1.00 0.00 0.00 64.86 64.03 3dkj h ILE 290 Cb 1.79 0.29 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 3dkj h ILE 290 CO -0.08 0.05 -0.72 -0.50 0.00 0.00 0.00 178.15 176.91 3dkj h TRP 291 N -1.00 0.93 0.00 1.37 -0.00 -0.93 0.26 115.95 116.59 3dkj h TRP 291 Ca -0.01 -0.39 0.00 0.00 -0.00 0.00 0.00 58.89 58.49 3dkj h TRP 291 Cb 0.22 -0.15 0.00 0.00 -0.00 0.00 0.00 29.16 29.23 3dkj h TRP 291 CO -0.03 1.20 -0.12 0.41 -0.00 0.00 0.00 178.44 179.90 3dkj n GLY 292 N 0.59 -1.59 1.87 1.49 0.00 -0.44 -2.23 105.19 104.87 3dkj n GLY 292 Ca -0.06 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.87 3dkj n GLY 292 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dkj n GLU 293 N -2.03 0.00 -0.24 1.61 1.02 -1.14 -4.73 120.64 115.13 3dkj n GLU 293 Ca 0.06 0.00 0.02 0.00 -0.02 0.00 0.00 57.16 57.22 3dkj n GLU 293 Cb 0.41 -0.01 0.15 0.00 -0.02 0.00 0.00 31.44 31.96 3dkj n GLU 293 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 3dkj h ASP 294 N 0.00 0.39 -0.17 1.62 3.32 -0.99 -3.06 116.42 117.54 3dkj h ASP 294 Ca 0.00 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.12 3dkj h ASP 294 Cb 0.00 0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.57 3dkj h ASP 294 CO 0.00 0.21 0.00 0.18 -1.72 0.00 0.00 179.24 177.91 3dkj n LEU 295 N -4.91 2.32 -0.33 1.55 4.77 0.91 -4.68 117.00 116.62 3dkj n LEU 295 Ca 0.12 -1.60 0.21 0.00 -0.03 0.00 0.00 56.01 54.71 3dkj n LEU 295 Cb 0.31 -0.11 0.43 0.00 -2.33 0.00 0.00 43.42 41.72 3dkj n LEU 295 CO 0.23 0.54 1.11 -0.09 -1.33 0.00 0.00 177.39 177.85 3dkj h ARG 296 N 1.62 0.37 0.00 3.23 2.43 -1.34 0.78 114.38 121.48 3dkj h ARG 296 Ca 0.00 -0.02 -0.02 0.00 -0.81 0.00 0.00 59.98 59.13 3dkj h ARG 296 Cb 0.55 -0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 3dkj h ARG 296 CO 0.00 0.24 -0.08 1.12 -1.51 0.00 0.00 179.97 179.74 3dkj h HIS 297 N 0.38 0.00 -0.00 2.20 2.07 -1.83 -1.20 115.15 116.77 3dkj h HIS 297 Ca 0.69 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.21 3dkj h HIS 297 Cb 1.49 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.47 3dkj h HIS 297 CO -0.04 0.08 -0.45 1.28 -3.07 0.00 0.00 177.93 175.73 3dkj n LEU 298 N -3.78 0.49 -0.13 6.12 4.77 0.26 -4.05 117.00 120.69 3dkj n LEU 298 Ca -0.02 0.03 -0.25 0.00 -0.03 0.00 0.00 56.01 55.73 3dkj n LEU 298 Cb 0.18 -0.26 -0.09 0.00 -2.33 0.00 0.00 43.42 40.91 3dkj n LEU 298 CO 0.30 0.12 -1.18 -0.38 -1.33 0.00 0.00 177.39 174.92 3dkj n ILE 299 N -1.46 1.52 0.18 -0.08 5.41 -0.54 -4.47 119.36 119.92 3dkj n ILE 299 Ca 0.06 -0.25 0.09 0.00 1.00 0.00 0.00 62.75 63.65 3dkj n ILE 299 Cb 0.34 -1.98 0.48 0.00 -0.71 0.00 0.00 39.64 37.77 3dkj n ILE 299 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 3dkj n VAL 300 N -4.32 1.15 1.10 1.39 0.24 -0.67 -1.30 118.33 115.93 3dkj n VAL 300 Ca -0.45 0.62 0.13 0.00 -2.04 0.00 0.00 64.34 62.59 3dkj n VAL 300 Cb 0.79 -1.60 0.34 0.00 -1.47 0.00 0.00 33.84 31.91 3dkj n VAL 300 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3dkj n SER 301 N -2.12 0.59 -4.80 -1.34 3.41 -1.26 -4.96 113.62 103.15 3dkj n SER 301 Ca -0.01 -0.38 -0.34 0.00 -0.26 0.00 0.00 58.87 57.88 3dkj n SER 301 Cb 0.06 0.13 -0.03 0.00 -0.26 0.00 0.00 64.21 64.11 3dkj n SER 301 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dkj s ARG 302 N -2.82 3.76 0.65 4.33 0.52 -0.42 -5.04 118.95 119.93 3dkj s ARG 302 Ca 0.16 1.29 -0.15 0.00 -0.52 0.00 0.00 55.73 56.52 3dkj s ARG 302 Cb 0.18 -2.09 -0.01 0.00 0.52 0.00 0.00 34.95 33.55 3dkj s ARG 302 CO 0.62 -0.45 1.09 0.45 0.02 0.00 0.00 175.30 177.03 3dkj s SER 303 N -2.20 5.27 0.52 0.23 0.15 -1.26 -4.71 113.70 111.70 3dkj s SER 303 Ca 0.66 1.92 0.24 0.00 0.70 0.00 0.00 55.95 59.47 3dkj s SER 303 Cb -0.15 -2.54 1.41 0.00 -1.71 0.00 0.00 66.02 63.02 3dkj s SER 303 CO 0.23 -1.52 2.10 0.74 1.20 0.00 0.00 173.24 175.99 3dkj h THR 304 N 0.05 0.72 -0.00 6.45 2.02 -1.97 -2.20 112.91 117.98 3dkj h THR 304 Ca -0.46 -0.42 0.00 0.00 0.77 0.00 0.00 66.41 66.30 3dkj h THR 304 Cb 1.24 1.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.90 3dkj h THR 304 CO 0.55 0.10 -0.16 0.00 0.37 0.00 0.00 175.52 176.39 3dkj n GLN 305 N -3.90 0.59 -2.84 6.66 3.00 -1.26 -4.37 117.38 115.26 3dkj n GLN 305 Ca -0.02 -0.23 -0.12 0.00 -0.01 0.00 0.00 57.00 56.62 3dkj n GLN 305 Cb 0.20 -1.50 0.01 0.00 0.00 0.00 0.00 30.24 28.96 3dkj n GLN 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3dkj n ALA 306 N -1.00 2.81 -1.21 -1.58 0.00 -0.84 -3.87 120.51 114.82 3dkj n ALA 306 Ca 0.13 -3.14 -0.31 0.00 0.00 0.00 0.00 53.44 50.12 3dkj n ALA 306 Cb 0.30 -0.94 0.10 0.00 0.00 0.00 0.00 19.45 18.91 3dkj n ALA 306 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3dkj s PRO 307 N -2.74 2.08 -0.09 0.00 0.04 -1.17 -4.22 135.00 128.91 3dkj s PRO 307 Ca 0.31 1.17 -0.29 0.00 0.04 0.00 0.00 61.00 62.23 3dkj s PRO 307 Cb 0.42 -1.88 -0.02 0.00 0.04 0.00 0.00 34.50 33.07 3dkj s PRO 307 CO -0.01 -1.77 0.99 -1.17 0.04 0.00 0.00 177.00 175.08 3dkj s LEU 308 N -6.00 4.27 -0.43 -3.56 2.96 0.12 -2.02 118.68 114.03 3dkj s LEU 308 Ca 0.62 1.53 -0.09 0.00 -0.22 0.00 0.00 54.13 55.97 3dkj s LEU 308 Cb -0.18 -3.53 0.09 0.00 0.50 0.00 0.00 46.19 43.07 3dkj s LEU 308 CO 0.56 -0.40 0.27 -0.63 -1.32 0.00 0.00 176.35 174.84 3dkj s ILE 309 N 1.79 4.22 0.11 6.68 1.01 0.64 -0.98 121.20 134.67 3dkj s ILE 309 Ca 0.48 -1.47 -0.30 0.00 0.00 0.00 0.00 60.65 59.36 3dkj s ILE 309 Cb -0.19 -3.62 -0.06 0.00 0.01 0.00 0.00 42.46 38.60 3dkj s ILE 309 CO 0.20 -0.55 1.12 -0.63 0.00 0.00 0.00 174.94 175.07 3dkj s ILE 310 N 1.41 4.06 -0.34 2.92 1.01 0.14 -0.59 121.20 129.82 3dkj s ILE 310 Ca 0.04 1.61 0.03 0.00 0.00 0.00 0.00 60.65 62.33 3dkj s ILE 310 Cb -0.24 -4.03 0.10 0.00 0.01 0.00 0.00 42.46 38.30 3dkj s ILE 310 CO 0.02 0.20 0.06 -0.60 0.00 0.00 0.00 174.94 174.61 3dkj s ARG 311 N 0.36 1.64 0.84 2.79 3.52 -0.98 -1.28 118.95 125.84 3dkj s ARG 311 Ca 0.53 -1.81 -0.10 0.00 -0.13 0.00 0.00 55.73 54.22 3dkj s ARG 311 Cb -0.28 -3.23 0.10 0.00 -1.56 0.00 0.00 34.95 29.97 3dkj s ARG 311 CO 0.32 -0.92 1.12 -1.25 -0.81 0.00 0.00 175.30 173.76 3dkj s PRO 312 N 0.96 1.68 0.00 5.12 0.04 -1.24 -1.47 135.00 140.09 3dkj s PRO 312 Ca 0.08 1.36 0.02 0.00 0.04 0.00 0.00 61.00 62.50 3dkj s PRO 312 Cb -0.20 -1.82 0.03 0.00 0.04 0.00 0.00 34.50 32.55 3dkj s PRO 312 CO -0.07 -2.11 0.73 -3.47 0.04 0.00 0.00 177.00 172.12 3dkj n ASP 313 N -3.82 -0.09 -3.67 6.66 4.64 -1.26 -3.99 116.55 115.02 3dkj n ASP 313 Ca 0.10 -1.43 -0.04 0.00 -1.38 0.00 0.00 54.79 52.04 3dkj n ASP 313 Cb 0.52 -0.02 -0.01 0.00 -1.04 0.00 0.00 41.12 40.57 3dkj n ASP 313 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3dkj s SER 314 N -0.49 -0.21 0.00 1.67 1.04 -1.26 -4.82 113.70 109.63 3dkj s SER 314 Ca 0.02 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.20 3dkj s SER 314 Cb 0.02 0.41 0.00 0.00 0.10 0.00 0.00 66.02 66.55 3dkj s SER 314 CO -0.01 -0.73 0.00 0.61 0.98 0.00 0.00 173.24 174.09 3dkj n GLY 315 N -0.40 -0.29 3.67 7.32 0.00 -1.26 -4.82 105.19 109.41 3dkj n GLY 315 Ca -0.07 -1.80 -0.43 0.00 0.00 0.00 0.00 46.02 43.72 3dkj n GLY 315 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dkj n ASN 316 N -0.90 4.00 -0.28 1.61 5.15 -1.26 -4.90 115.26 118.67 3dkj n ASN 316 Ca 0.00 0.93 -0.00 0.00 -0.60 0.00 0.00 54.58 54.91 3dkj n ASN 316 Cb 0.00 -1.50 0.13 0.00 -0.53 0.00 0.00 39.78 37.88 3dkj n ASN 316 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 3dkj h PRO 317 N 9.91 0.85 -0.20 1.20 0.11 -1.87 0.85 132.00 142.85 3dkj h PRO 317 Ca -0.49 -0.05 -0.07 0.00 0.11 0.00 0.00 66.00 65.50 3dkj h PRO 317 Cb 1.24 -0.19 -0.00 0.00 0.11 0.00 0.00 31.00 32.16 3dkj h PRO 317 CO 0.94 0.56 -0.14 1.25 -0.21 0.00 0.00 178.00 180.41 3dkj h LEU 318 N 0.87 0.47 -0.91 2.35 5.85 -1.92 -1.93 115.31 120.10 3dkj h LEU 318 Ca 0.35 -0.44 -0.09 0.00 0.84 0.00 0.00 57.88 58.54 3dkj h LEU 318 Cb 0.18 -0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 3dkj h LEU 318 CO -0.18 0.81 -0.21 0.44 -0.34 0.00 0.00 178.44 178.96 3dkj h ASP 319 N 0.14 0.56 0.02 1.25 3.32 -1.85 -2.02 116.42 117.84 3dkj h ASP 319 Ca 0.04 -0.18 -0.00 0.00 0.02 0.00 0.00 57.03 56.91 3dkj h ASP 319 Cb 0.65 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.05 3dkj h ASP 319 CO 0.04 0.78 -0.01 0.74 -1.72 0.00 0.00 179.24 179.06 3dkj h THR 320 N 0.50 1.35 -0.49 0.35 2.02 -0.85 -1.66 112.91 114.13 3dkj h THR 320 Ca 0.08 -1.20 0.09 0.00 0.77 0.00 0.00 66.41 66.15 3dkj h THR 320 Cb 0.64 2.15 -0.07 0.00 -1.74 0.00 0.00 68.15 69.13 3dkj h THR 320 CO 0.05 0.30 0.06 0.58 0.37 0.00 0.00 175.52 176.88 3dkj h VAL 321 N -0.56 0.68 -0.46 3.16 2.07 -1.30 0.10 116.25 119.95 3dkj h VAL 321 Ca -0.00 -0.06 -0.12 0.00 0.82 0.00 0.00 66.70 67.34 3dkj h VAL 321 Cb 0.52 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.76 3dkj h VAL 321 CO 0.01 0.03 -0.18 -0.07 0.02 0.00 0.00 177.57 177.37 3dkj h LEU 322 N 0.18 0.93 -0.31 2.57 3.38 -1.32 -1.63 115.31 119.10 3dkj h LEU 322 Ca 0.24 -0.33 -0.14 0.00 0.09 0.00 0.00 57.88 57.75 3dkj h LEU 322 Cb 0.35 -0.25 -0.00 0.00 0.09 0.00 0.00 40.66 40.84 3dkj h LEU 322 CO -0.36 1.09 -0.34 0.50 0.09 0.00 0.00 178.44 179.42 3dkj h LYS 323 N 0.80 0.79 -0.20 1.13 3.64 -0.97 -1.32 116.57 120.44 3dkj h LYS 323 Ca 0.11 -0.43 0.03 0.00 -1.27 0.00 0.00 60.65 59.09 3dkj h LYS 323 Cb 0.73 0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 32.55 3dkj h LYS 323 CO 0.06 1.06 0.04 0.28 -2.27 0.00 0.00 179.45 178.61 3dkj h VAL 324 N 0.56 0.91 -0.86 2.00 2.07 -0.87 -1.27 116.25 118.78 3dkj h VAL 324 Ca 0.05 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 3dkj h VAL 324 Cb 0.93 0.78 -0.04 0.00 -1.52 0.00 0.00 31.29 31.44 3dkj h VAL 324 CO 0.08 0.02 0.54 -0.07 0.02 0.00 0.00 177.57 178.16 3dkj h LEU 325 N 0.12 1.03 -0.29 2.57 3.38 -1.17 -1.28 115.31 119.66 3dkj h LEU 325 Ca 0.09 -0.06 0.04 0.00 0.09 0.00 0.00 57.88 58.05 3dkj h LEU 325 Cb 0.09 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 3dkj h LEU 325 CO -0.12 0.78 0.05 -0.08 0.09 0.00 0.00 178.44 179.15 3dkj h GLU 326 N 1.18 0.14 0.27 1.13 4.57 -0.96 0.10 114.58 121.01 3dkj h GLU 326 Ca 0.31 -0.01 -0.01 0.00 -1.18 0.00 0.00 59.36 58.47 3dkj h GLU 326 Cb -0.07 -0.03 -0.00 0.00 -0.16 0.00 0.00 28.75 28.48 3dkj h GLU 326 CO -0.06 0.09 -0.16 0.82 -1.18 0.00 0.00 179.01 178.52 3dkj h ILE 327 N 0.15 0.65 -0.92 2.32 2.04 -0.92 -2.76 117.51 118.08 3dkj h ILE 327 Ca 0.13 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.00 3dkj h ILE 327 Cb 0.15 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 36.84 3dkj h ILE 327 CO -0.19 0.00 0.60 -0.07 0.00 0.00 0.00 178.15 178.50 3dkj h LEU 328 N -0.42 1.06 -1.76 1.44 3.38 -1.12 -1.99 115.31 115.90 3dkj h LEU 328 Ca -0.03 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 3dkj h LEU 328 Cb 0.35 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.83 3dkj h LEU 328 CO 0.03 0.77 -0.14 1.23 0.09 0.00 0.00 178.44 180.42 3dkj h GLY 329 N 1.25 0.00 1.35 0.83 0.00 -0.82 0.76 103.07 106.43 3dkj h GLY 329 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 3dkj h GLY 329 CO -0.07 0.00 -0.60 0.50 0.00 0.00 0.00 176.54 176.37 3dkj h LYS 330 N 0.00 0.00 0.00 4.80 1.79 -1.09 -3.37 116.57 118.70 3dkj h LYS 330 Ca -0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 3dkj h LYS 330 Cb 0.42 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.07 3dkj h LYS 330 CO 0.02 0.00 -1.57 1.63 -1.08 0.00 0.00 179.45 178.45 3dkj n LYS 331 N -2.61 0.66 -4.18 3.15 4.76 -0.60 -5.00 118.16 114.33 3dkj n LYS 331 Ca 0.02 -0.12 -0.16 0.00 -2.87 0.00 0.00 58.31 55.18 3dkj n LYS 331 Cb 0.51 -1.44 -0.11 0.00 -1.84 0.00 0.00 35.03 32.15 3dkj n LYS 331 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3dkj s PHE 332 N -3.16 1.17 -0.26 2.13 0.40 0.16 -5.00 117.98 113.42 3dkj s PHE 332 Ca -0.03 -0.56 -0.28 0.00 -0.60 0.00 0.00 56.93 55.46 3dkj s PHE 332 Cb 0.13 -0.64 -0.03 0.00 0.51 0.00 0.00 43.02 42.99 3dkj s PHE 332 CO 0.79 0.05 1.87 -1.25 0.70 0.00 0.00 175.22 177.38 3dkj s PRO 333 N -2.35 3.41 -0.01 0.24 0.04 -1.26 -4.63 135.00 130.44 3dkj s PRO 333 Ca 0.03 1.67 -0.17 0.00 0.04 0.00 0.00 61.00 62.58 3dkj s PRO 333 Cb -0.06 -4.21 -0.06 0.00 0.04 0.00 0.00 34.50 30.22 3dkj s PRO 333 CO 0.02 -1.76 0.46 0.08 0.04 0.00 0.00 177.00 175.83 3dkj s VAL 334 N 6.78 4.99 0.48 -0.36 1.01 -1.26 -3.70 120.40 128.33 3dkj s VAL 334 Ca 0.84 0.96 0.08 0.00 0.00 0.00 0.00 61.98 63.85 3dkj s VAL 334 Cb -0.26 -3.78 0.03 0.00 0.00 0.00 0.00 36.38 32.36 3dkj s VAL 334 CO 0.34 0.52 0.53 0.42 0.00 0.00 0.00 175.10 176.91 3dkj s THR 335 N -0.73 2.42 -0.16 3.92 -4.23 -0.16 -4.93 115.64 111.77 3dkj s THR 335 Ca 0.25 -1.20 0.01 0.00 -1.18 0.00 0.00 61.69 59.57 3dkj s THR 335 Cb -0.17 -2.62 0.02 0.00 1.34 0.00 0.00 72.50 71.07 3dkj s THR 335 CO 0.14 0.00 -0.18 -0.70 -0.54 0.00 0.00 174.62 173.34 3dkj s GLU 336 N -4.35 2.70 1.02 3.99 2.12 -1.26 -0.89 118.70 122.03 3dkj s GLU 336 Ca 0.51 -0.72 -0.17 0.00 0.36 0.00 0.00 54.97 54.95 3dkj s GLU 336 Cb -0.05 -2.33 0.22 0.00 0.26 0.00 0.00 34.13 32.23 3dkj s GLU 336 CO 0.31 -0.17 1.29 0.54 -0.54 0.00 0.00 175.26 176.68 3dkj s ASN 337 N 1.25 2.59 0.18 -1.70 2.20 -0.25 -4.85 114.94 114.36 3dkj s ASN 337 Ca 0.02 0.31 0.19 0.00 -0.94 0.00 0.00 52.86 52.44 3dkj s ASN 337 Cb -0.14 -0.37 0.83 0.00 -2.00 0.00 0.00 41.25 39.58 3dkj s ASN 337 CO -0.09 -3.07 1.58 -1.54 -2.94 0.00 0.00 177.10 171.04 3dkj n SER 338 N -4.00 0.42 -0.36 3.54 3.41 -1.26 -0.67 113.62 114.70 3dkj n SER 338 Ca 0.15 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.51 3dkj n SER 338 Cb 0.59 -0.71 0.25 0.00 -0.26 0.00 0.00 64.21 64.09 3dkj n SER 338 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3dkj n LYS 339 N -1.99 1.05 -0.37 4.33 4.76 -1.26 -4.96 118.16 119.73 3dkj n LYS 339 Ca 0.02 -0.73 0.00 0.00 -2.87 0.00 0.00 58.31 54.73 3dkj n LYS 339 Cb 0.16 -1.48 0.00 0.00 -1.84 0.00 0.00 35.03 31.87 3dkj n LYS 339 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dkj n GLY 340 N 1.36 0.78 3.88 0.72 0.00 0.15 -5.05 105.19 107.04 3dkj n GLY 340 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 3dkj n GLY 340 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dkj s TYR 341 N -2.18 3.44 0.29 1.61 1.51 -1.26 -4.81 117.35 115.95 3dkj s TYR 341 Ca 0.00 0.22 -0.29 0.00 -1.01 0.00 0.00 57.07 55.99 3dkj s TYR 341 Cb 0.00 -1.74 -0.10 0.00 -0.11 0.00 0.00 41.96 40.02 3dkj s TYR 341 CO 0.00 0.58 1.10 0.15 -1.11 0.00 0.00 175.55 176.27 3dkj s LYS 342 N -2.38 4.61 -0.07 -0.62 1.02 0.13 -1.09 119.74 121.33 3dkj s LYS 342 Ca 0.32 1.80 -0.01 0.00 0.02 0.00 0.00 55.97 58.11 3dkj s LYS 342 Cb -0.13 -3.15 0.03 0.00 -0.52 0.00 0.00 37.83 34.06 3dkj s LYS 342 CO 0.25 0.18 -0.02 -1.17 -0.92 0.00 0.00 175.35 173.67 3dkj s LEU 343 N -1.52 0.88 0.84 3.17 2.96 -0.07 -1.55 118.68 123.39 3dkj s LEU 343 Ca 0.45 -0.12 -0.11 0.00 -0.22 0.00 0.00 54.13 54.13 3dkj s LEU 343 Cb -0.32 -0.49 0.10 0.00 0.50 0.00 0.00 46.19 45.99 3dkj s LEU 343 CO 0.41 -0.14 1.10 -0.76 -1.32 0.00 0.00 176.35 175.63 3dkj s LEU 344 N 1.62 2.70 0.69 -0.68 1.43 -1.26 -0.98 118.68 122.20 3dkj s LEU 344 Ca 0.00 1.77 -0.16 0.00 -1.03 0.00 0.00 54.13 54.70 3dkj s LEU 344 Cb -0.13 -4.31 0.02 0.00 0.03 0.00 0.00 46.19 41.80 3dkj s LEU 344 CO -0.04 -2.44 1.25 -2.84 0.23 0.00 0.00 176.35 172.51 3dkj s PRO 345 N -4.86 2.31 0.33 1.29 0.02 -1.24 -4.83 135.00 128.02 3dkj s PRO 345 Ca 0.63 1.92 0.24 0.00 0.02 0.00 0.00 61.00 63.81 3dkj s PRO 345 Cb -0.18 -1.83 1.19 0.00 0.02 0.00 0.00 34.50 33.69 3dkj s PRO 345 CO 0.57 -1.74 1.73 -1.00 -0.33 0.00 0.00 177.00 176.23 3dkj h PRO 346 N 0.10 0.00 -0.06 5.54 0.13 -1.95 -1.44 132.00 134.32 3dkj h PRO 346 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 3dkj h PRO 346 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 3dkj h PRO 346 CO 0.51 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.76 3dkj n TYR 347 N -2.33 0.07 -3.80 1.56 0.18 -1.26 -4.62 117.16 106.95 3dkj n TYR 347 Ca -0.00 -0.03 -0.22 0.00 1.88 0.00 0.00 57.90 59.52 3dkj n TYR 347 Cb 0.11 0.00 -0.17 0.00 -0.38 0.00 0.00 39.34 38.89 3dkj n TYR 347 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 3dkj s LEU 348 N -1.79 0.65 0.29 -3.48 2.96 -0.54 -0.70 118.68 116.07 3dkj s LEU 348 Ca 0.36 -0.08 0.03 0.00 -0.22 0.00 0.00 54.13 54.22 3dkj s LEU 348 Cb 0.19 -0.42 -0.04 0.00 0.50 0.00 0.00 46.19 46.42 3dkj s LEU 348 CO 0.30 -0.18 0.14 -0.13 -1.32 0.00 0.00 176.35 175.16 3dkj s ARG 349 N 1.86 1.55 -0.01 1.98 1.81 -0.16 -4.55 118.95 121.42 3dkj s ARG 349 Ca 0.03 -1.87 0.03 0.00 -1.72 0.00 0.00 55.73 52.20 3dkj s ARG 349 Cb -0.12 -0.15 -0.01 0.00 -0.45 0.00 0.00 34.95 34.22 3dkj s ARG 349 CO -0.05 -0.41 -0.11 0.08 -0.68 0.00 0.00 175.30 174.13 3dkj s VAL 350 N -3.64 0.87 -0.13 3.52 1.01 -0.87 -0.68 120.40 120.48 3dkj s VAL 350 Ca 0.36 -0.46 0.02 0.00 0.00 0.00 0.00 61.98 61.90 3dkj s VAL 350 Cb 0.06 -0.74 0.01 0.00 0.00 0.00 0.00 36.38 35.71 3dkj s VAL 350 CO 0.16 0.25 -0.18 -0.51 0.00 0.00 0.00 175.10 174.83 3dkj s ILE 351 N -0.17 1.74 -0.40 2.22 2.07 -0.40 -1.71 121.20 124.55 3dkj s ILE 351 Ca 0.03 -0.78 -0.17 0.00 -1.41 0.00 0.00 60.65 58.32 3dkj s ILE 351 Cb -0.05 -1.58 0.01 0.00 0.13 0.00 0.00 42.46 40.97 3dkj s ILE 351 CO -0.00 0.49 0.42 -1.58 -1.91 0.00 0.00 174.94 172.35 3dkj s GLN 352 N 1.02 3.24 -0.12 3.50 2.00 -0.23 -3.67 119.66 125.39 3dkj s GLN 352 Ca -0.04 -0.65 0.16 0.00 -2.00 0.00 0.00 55.36 52.83 3dkj s GLN 352 Cb -0.15 -3.92 0.27 0.00 0.80 0.00 0.00 33.01 30.02 3dkj s GLN 352 CO -0.04 -0.76 1.14 0.41 -0.50 0.00 0.00 175.29 175.55 3dkj n GLY 353 N 5.06 4.41 3.21 2.59 0.00 -1.26 -0.95 105.19 118.26 3dkj n GLY 353 Ca -0.08 -1.03 -0.32 0.00 0.00 0.00 0.00 46.02 44.59 3dkj n GLY 353 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dkj s ASP 354 N -2.71 3.15 -1.31 1.61 2.15 -1.26 -4.71 116.67 113.60 3dkj s ASP 354 Ca 0.29 -0.56 -0.00 0.00 0.43 0.00 0.00 52.55 52.71 3dkj s ASP 354 Cb 0.26 -1.43 0.00 0.00 -0.30 0.00 0.00 42.92 41.45 3dkj s ASP 354 CO 0.01 0.14 0.03 0.61 -0.17 0.00 0.00 175.17 175.79 3dkj n GLY 355 N 3.69 -0.26 3.60 2.66 0.00 -1.26 -4.81 105.19 108.80 3dkj n GLY 355 Ca -0.19 -0.23 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 3dkj n GLY 355 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dkj s VAL 356 N -2.78 5.03 0.25 1.61 1.01 -1.26 -4.76 120.40 119.50 3dkj s VAL 356 Ca 0.01 0.72 0.05 0.00 0.00 0.00 0.00 61.98 62.77 3dkj s VAL 356 Cb -0.01 -3.90 -0.02 0.00 0.00 0.00 0.00 36.38 32.45 3dkj s VAL 356 CO 0.02 -0.05 0.20 -0.90 0.00 0.00 0.00 175.10 174.36 3dkj n ASP 357 N 5.67 -0.33 -0.27 3.32 5.68 -1.26 -4.19 116.55 125.17 3dkj n ASP 357 Ca -0.04 -2.61 0.06 0.00 -0.50 0.00 0.00 54.79 51.70 3dkj n ASP 357 Cb 0.49 1.17 0.29 0.00 -1.14 0.00 0.00 41.12 41.93 3dkj n ASP 357 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3dkj h ILE 358 N 1.75 1.02 0.02 2.12 2.10 -1.94 0.21 117.51 122.79 3dkj h ILE 358 Ca -0.18 -0.31 -0.00 0.00 1.08 0.00 0.00 64.86 65.45 3dkj h ILE 358 Cb 0.88 0.03 0.00 0.00 -1.09 0.00 0.00 36.82 36.64 3dkj h ILE 358 CO 0.26 0.17 -0.01 0.78 -1.08 0.00 0.00 178.15 178.27 3dkj h ASN 359 N 0.92 -0.02 0.39 2.19 2.35 -1.97 -2.42 115.58 117.01 3dkj h ASN 359 Ca 0.38 -0.40 -0.12 0.00 -0.55 0.00 0.00 56.30 55.61 3dkj h ASN 359 Cb 0.28 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.65 3dkj h ASN 359 CO -0.15 0.40 -0.51 0.71 -1.65 0.00 0.00 177.43 176.23 3dkj h THR 360 N -0.45 1.36 -0.10 2.81 1.35 -1.79 -1.63 112.91 114.46 3dkj h THR 360 Ca -0.00 -1.75 0.01 0.00 -0.55 0.00 0.00 66.41 64.12 3dkj h THR 360 Cb 0.43 1.88 -0.01 0.00 -1.73 0.00 0.00 68.15 68.72 3dkj h THR 360 CO 0.00 0.51 0.02 0.25 -0.25 0.00 0.00 175.52 176.06 3dkj h LEU 361 N 0.11 0.02 -0.50 3.87 6.46 -0.97 0.21 115.31 124.50 3dkj h LEU 361 Ca 0.00 0.01 0.08 0.00 -0.12 0.00 0.00 57.88 57.86 3dkj h LEU 361 Cb 0.94 0.01 -0.07 0.00 -0.73 0.00 0.00 40.66 40.81 3dkj h LEU 361 CO 0.07 0.03 0.13 -0.61 -0.62 0.00 0.00 178.44 177.44 3dkj h GLN 362 N 0.07 0.28 -0.78 1.25 5.75 -1.21 -1.76 115.11 118.71 3dkj h GLN 362 Ca 0.04 -0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.55 3dkj h GLN 362 Cb 0.03 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.48 3dkj h GLN 362 CO -0.05 0.18 0.51 1.49 -2.65 0.00 0.00 178.83 178.31 3dkj h GLU 363 N 0.29 0.99 -0.02 1.69 4.81 -0.78 -2.03 114.58 119.52 3dkj h GLU 363 Ca 0.25 -0.06 -0.01 0.00 -0.13 0.00 0.00 59.36 59.42 3dkj h GLU 363 Cb 0.31 -0.22 -0.00 0.00 0.63 0.00 0.00 28.75 29.47 3dkj h GLU 363 CO -0.30 0.65 -0.01 0.82 -0.73 0.00 0.00 179.01 179.45 3dkj h ILE 364 N 1.02 1.34 -0.58 2.32 2.04 -0.67 -0.48 117.51 122.49 3dkj h ILE 364 Ca 0.30 -1.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.10 3dkj h ILE 364 Cb -0.06 1.98 -0.03 0.00 -0.74 0.00 0.00 36.82 37.97 3dkj h ILE 364 CO -0.08 0.27 0.17 -0.37 0.00 0.00 0.00 178.15 178.13 3dkj h VAL 365 N -0.37 1.23 -0.25 1.67 -1.51 -1.32 0.69 116.25 116.38 3dkj h VAL 365 Ca 0.00 -0.78 -0.04 0.00 -1.23 0.00 0.00 66.70 64.66 3dkj h VAL 365 Cb 0.44 0.60 -0.01 0.00 -2.13 0.00 0.00 31.29 30.19 3dkj h VAL 365 CO 0.00 0.30 0.01 -0.08 -1.23 0.00 0.00 177.57 176.57 3dkj h GLU 366 N 0.84 0.44 -0.85 5.19 4.57 -1.37 -0.40 114.58 123.00 3dkj h GLU 366 Ca 0.19 -0.14 -0.02 0.00 -1.18 0.00 0.00 59.36 58.22 3dkj h GLU 366 Cb 0.26 -0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 28.77 3dkj h GLU 366 CO -0.01 0.60 0.46 0.78 -1.18 0.00 0.00 179.01 179.67 3dkj h GLY 367 N 0.22 1.27 1.00 1.92 0.00 -0.78 -0.89 103.07 105.82 3dkj h GLY 367 Ca 0.07 -0.58 0.00 0.00 0.00 0.00 0.00 47.33 46.82 3dkj h GLY 367 CO 0.01 0.56 0.12 -0.33 0.00 0.00 0.00 176.54 176.89 3dkj h MET 368 N 1.19 0.24 -0.74 4.80 2.86 -0.70 -2.47 114.93 120.11 3dkj h MET 368 Ca 0.30 -0.02 0.04 0.00 -2.06 0.00 0.00 59.70 57.97 3dkj h MET 368 Cb 0.04 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 31.59 3dkj h MET 368 CO -0.05 0.16 0.46 -0.22 1.06 0.00 0.00 176.91 178.33 3dkj h LYS 369 N 0.24 0.85 -0.99 1.72 3.64 -0.55 -1.36 116.57 120.11 3dkj h LYS 369 Ca 0.07 -0.05 0.07 0.00 -1.27 0.00 0.00 60.65 59.46 3dkj h LYS 369 Cb -0.02 -0.19 -0.07 0.00 -0.41 0.00 0.00 32.23 31.54 3dkj h LYS 369 CO -0.01 0.56 0.63 0.37 -2.27 0.00 0.00 179.45 178.73 3dkj h GLN 370 N 0.88 1.11 -0.58 1.90 5.75 -0.99 -1.56 115.11 121.62 3dkj h GLN 370 Ca 0.31 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.74 3dkj h GLN 370 Cb 0.08 -0.25 0.00 0.00 1.07 0.00 0.00 27.48 28.37 3dkj h GLN 370 CO -0.13 0.74 0.00 1.63 -2.65 0.00 0.00 178.83 178.41 3dkj n LYS 371 N -4.52 2.63 -2.24 1.69 4.76 -0.61 -4.93 118.16 114.94 3dkj n LYS 371 Ca 0.15 -1.78 -0.15 0.00 -2.87 0.00 0.00 58.31 53.67 3dkj n LYS 371 Cb 0.19 -1.62 -0.01 0.00 -1.84 0.00 0.00 35.03 31.75 3dkj n LYS 371 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 3dkj n MET 372 N 0.65 -1.16 -3.65 1.97 2.81 -0.59 -4.95 117.12 112.20 3dkj n MET 372 Ca 0.16 0.72 -0.36 0.00 -1.81 0.00 0.00 57.70 56.41 3dkj n MET 372 Cb 0.58 -5.02 -0.09 0.00 -0.71 0.00 0.00 33.22 27.98 3dkj n MET 372 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 3dkj s TRP 373 N -2.72 3.36 0.56 2.03 0.52 -0.63 0.18 118.94 122.23 3dkj s TRP 373 Ca 0.00 0.31 -0.21 0.00 0.02 0.00 0.00 56.10 56.22 3dkj s TRP 373 Cb 0.00 -2.26 -0.04 0.00 -1.15 0.00 0.00 33.47 30.01 3dkj s TRP 373 CO 0.00 0.14 1.30 0.45 0.02 0.00 0.00 176.95 178.85 3dkj s SER 374 N 0.81 5.29 0.09 2.95 0.15 -0.60 -4.04 113.70 118.35 3dkj s SER 374 Ca 0.09 2.61 0.22 0.00 0.70 0.00 0.00 55.95 59.58 3dkj s SER 374 Cb -0.13 -2.62 0.90 0.00 -1.71 0.00 0.00 66.02 62.46 3dkj s SER 374 CO 0.03 -1.54 1.70 -0.38 1.20 0.00 0.00 173.24 174.25 3dkj n ILE 375 N -1.16 0.62 -0.10 6.45 2.08 -1.26 -2.61 119.36 123.38 3dkj n ILE 375 Ca 0.11 0.09 0.19 0.00 0.56 0.00 0.00 62.75 63.69 3dkj n ILE 375 Cb 0.47 -0.82 0.60 0.00 -0.75 0.00 0.00 39.64 39.14 3dkj n ILE 375 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 3dkj h GLU 376 N 0.00 0.19 0.00 0.38 5.08 -1.91 -2.71 114.58 115.62 3dkj h GLU 376 Ca 0.00 -0.01 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 3dkj h GLU 376 Cb 0.43 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 3dkj h GLU 376 CO 0.00 0.13 -0.26 -0.91 -1.00 0.00 0.00 179.01 176.96 3dkj h ASN 377 N 0.20 0.00 -3.83 1.42 2.35 -1.84 -3.46 115.58 110.42 3dkj h ASN 377 Ca 0.33 0.00 -0.68 0.00 -0.55 0.00 0.00 56.30 55.39 3dkj h ASN 377 Cb 1.00 0.00 -0.20 0.00 0.05 0.00 0.00 38.32 39.17 3dkj h ASN 377 CO -0.06 0.26 -0.82 -0.51 -1.65 0.00 0.00 177.43 174.65 3dkj s ILE 378 N -3.80 2.66 0.15 2.81 1.10 -1.02 -2.05 121.20 121.04 3dkj s ILE 378 Ca -0.01 -1.52 -0.00 0.00 -0.51 0.00 0.00 60.65 58.61 3dkj s ILE 378 Cb 0.11 -2.19 -0.04 0.00 0.15 0.00 0.00 42.46 40.49 3dkj s ILE 378 CO 0.65 0.14 0.04 0.00 -2.11 0.00 0.00 174.94 173.66 3dkj s ALA 379 N -1.08 1.05 0.08 1.50 0.00 -0.70 -4.97 121.76 117.64 3dkj s ALA 379 Ca 0.16 -1.52 0.08 0.00 0.00 0.00 0.00 51.96 50.68 3dkj s ALA 379 Cb -0.10 0.76 -0.03 0.00 0.00 0.00 0.00 23.12 23.75 3dkj s ALA 379 CO 0.08 -0.43 -0.22 -0.06 0.00 0.00 0.00 175.76 175.13 3dkj s PHE 380 N -3.91 1.87 -0.06 0.00 0.40 -0.02 -1.07 117.98 115.19 3dkj s PHE 380 Ca 0.24 -0.40 0.06 0.00 -0.60 0.00 0.00 56.93 56.23 3dkj s PHE 380 Cb 0.07 -1.06 -0.01 0.00 0.51 0.00 0.00 43.02 42.53 3dkj s PHE 380 CO 0.03 0.18 -0.24 0.20 0.70 0.00 0.00 175.22 176.08 3dkj s GLY 381 N -1.65 1.32 -0.02 4.36 0.00 -0.13 -0.51 107.32 110.68 3dkj s GLY 381 Ca 0.08 -1.05 0.00 0.00 0.00 0.00 0.00 44.72 43.75 3dkj s GLY 381 CO 0.03 -0.67 0.02 -0.45 0.00 0.00 0.00 173.10 172.04 3dkj s SER 382 N -0.22 0.17 0.00 1.64 0.15 0.02 -4.21 113.70 111.26 3dkj s SER 382 Ca -0.02 0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.65 3dkj s SER 382 Cb -0.13 -0.12 0.00 0.00 -1.71 0.00 0.00 66.02 64.06 3dkj s SER 382 CO 0.03 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.96 3dkj n GLY 383 N 4.15 -0.03 0.35 9.45 0.00 -1.26 -0.93 105.19 116.92 3dkj n GLY 383 Ca -0.28 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.77 3dkj n GLY 383 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dkj h GLY 384 N 0.00 1.07 1.47 -0.02 0.00 -1.86 -1.30 103.07 102.42 3dkj h GLY 384 Ca 0.00 -0.37 0.04 0.00 0.00 0.00 0.00 47.33 47.00 3dkj h GLY 384 CO 0.00 0.33 0.28 -1.33 0.00 0.00 0.00 176.54 175.81 3dkj h GLY 385 N 0.95 0.48 0.60 4.60 0.00 -1.89 0.60 103.07 108.40 3dkj h GLY 385 Ca 0.30 -0.16 -0.24 0.00 0.00 0.00 0.00 47.33 47.23 3dkj h GLY 385 CO -0.08 0.14 -1.15 -2.00 0.00 0.00 0.00 176.54 173.45 3dkj h LEU 386 N 0.42 0.41 0.00 3.11 5.85 -1.61 -3.42 115.31 120.07 3dkj h LEU 386 Ca 0.17 -0.89 0.00 0.00 0.84 0.00 0.00 57.88 58.00 3dkj h LEU 386 Cb 0.16 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.06 3dkj h LEU 386 CO -0.04 1.52 -0.31 0.18 -0.34 0.00 0.00 178.44 179.45 3dkj n LEU 387 N -4.02 0.11 0.00 2.25 4.77 -0.56 -4.83 117.00 114.71 3dkj n LEU 387 Ca -0.20 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.36 3dkj n LEU 387 Cb 0.86 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.95 3dkj n LEU 387 CO 0.44 0.03 -0.31 1.67 -1.33 0.00 0.00 177.39 177.89 3dkj n GLN 388 N -1.16 0.53 -1.26 3.23 -0.06 0.13 -4.84 117.38 113.94 3dkj n GLN 388 Ca 0.00 0.00 -0.32 0.00 -2.00 0.00 0.00 57.00 54.68 3dkj n GLN 388 Cb 0.05 -0.81 -0.06 0.00 -4.06 0.00 0.00 30.24 25.36 3dkj n GLN 388 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 3dkj n LYS 389 N -1.97 3.31 -3.83 3.69 4.81 0.19 -4.77 118.16 119.59 3dkj n LYS 389 Ca 0.00 -1.96 -0.12 0.00 -0.87 0.00 0.00 58.31 55.36 3dkj n LYS 389 Cb 0.31 -2.59 -0.10 0.00 0.02 0.00 0.00 35.03 32.67 3dkj n LYS 389 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3dkj s LEU 390 N 0.01 1.31 0.04 3.14 1.43 -1.26 -4.93 118.68 118.42 3dkj s LEU 390 Ca 0.69 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.75 3dkj s LEU 390 Cb 0.22 0.84 -0.03 0.00 0.03 0.00 0.00 46.19 47.25 3dkj s LEU 390 CO -0.05 -0.35 -0.04 -0.89 0.23 0.00 0.00 176.35 175.25 3dkj s THR 391 N -1.15 0.30 0.60 5.49 2.01 -1.26 -5.03 115.64 116.60 3dkj s THR 391 Ca -0.12 -1.35 0.30 0.00 0.31 0.00 0.00 61.69 60.83 3dkj s THR 391 Cb -0.06 -0.90 0.36 0.00 0.01 0.00 0.00 72.50 71.92 3dkj s THR 391 CO 0.02 -0.68 2.10 -0.09 -0.69 0.00 0.00 174.62 175.28 3dkj h ARG 392 N 3.94 0.00 0.00 4.92 2.43 -1.95 -1.96 114.38 121.76 3dkj h ARG 392 Ca -0.34 0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 58.81 3dkj h ARG 392 Cb 1.18 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.73 3dkj h ARG 392 CO 0.52 0.00 -0.09 0.22 -1.51 0.00 0.00 179.97 179.11 3dkj h ASP 393 N 0.00 0.00 -0.50 -3.80 1.82 -1.95 -2.69 116.42 109.30 3dkj h ASP 393 Ca 0.08 0.00 -0.09 0.00 -0.39 0.00 0.00 57.03 56.63 3dkj h ASP 393 Cb 0.49 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.48 3dkj h ASP 393 CO -0.00 0.09 -0.03 0.25 -1.61 0.00 0.00 179.24 177.93 3dkj h LEU 394 N 0.00 0.89 -2.76 2.28 5.85 -1.77 -3.13 115.31 116.67 3dkj h LEU 394 Ca -0.00 -0.32 0.00 0.00 0.84 0.00 0.00 57.88 58.40 3dkj h LEU 394 Cb 0.18 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 40.97 3dkj h LEU 394 CO 0.01 1.00 0.00 0.18 -0.34 0.00 0.00 178.44 179.29 3dkj n LEU 395 N -4.29 2.79 -3.97 2.25 4.77 -1.24 -4.99 117.00 112.32 3dkj n LEU 395 Ca 0.01 -1.91 -0.27 0.00 -0.03 0.00 0.00 56.01 53.81 3dkj n LEU 395 Cb 0.34 -0.20 -0.02 0.00 -2.33 0.00 0.00 43.42 41.21 3dkj n LEU 395 CO 0.43 0.69 -0.19 0.59 -1.33 0.00 0.00 177.39 177.58 3dkj n ASN 396 N 0.48 -0.83 -4.70 -1.43 4.13 -1.03 -2.78 115.26 109.09 3dkj n ASN 396 Ca 0.11 -0.99 -0.42 0.00 1.68 0.00 0.00 54.58 54.95 3dkj n ASN 396 Cb 0.40 -3.08 -0.03 0.00 -1.54 0.00 0.00 39.78 35.53 3dkj n ASN 396 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3dkj s SER 398 N 1.94 -0.51 -0.11 0.00 0.15 -0.70 -4.94 113.70 109.53 3dkj s SER 398 Ca 0.72 0.95 0.01 0.00 0.70 0.00 0.00 55.95 58.34 3dkj s SER 398 Cb -0.41 0.97 0.02 0.00 -1.71 0.00 0.00 66.02 64.89 3dkj s SER 398 CO 0.32 -0.21 -0.14 0.12 1.20 0.00 0.00 173.24 174.53 3dkj s PHE 399 N 0.11 1.88 -0.01 3.44 5.36 -1.26 -1.62 117.98 125.88 3dkj s PHE 399 Ca -0.01 -0.89 -0.03 0.00 -0.96 0.00 0.00 56.93 55.03 3dkj s PHE 399 Cb -0.03 -1.38 0.00 0.00 -0.34 0.00 0.00 43.02 41.26 3dkj s PHE 399 CO 0.01 -0.48 0.07 0.15 -1.46 0.00 0.00 175.22 173.51 3dkj s LYS 400 N 1.08 0.23 0.08 10.12 -0.14 -0.49 -4.95 119.74 125.67 3dkj s LYS 400 Ca -0.05 -0.15 -0.31 0.00 -1.36 0.00 0.00 55.97 54.10 3dkj s LYS 400 Cb -0.14 0.09 -0.07 0.00 -1.68 0.00 0.00 37.83 36.03 3dkj s LYS 400 CO -0.03 -0.04 1.34 0.00 -0.76 0.00 0.00 175.35 175.87 3dkj n SER 402 N 4.24 0.25 -3.64 0.00 3.41 -0.08 -4.26 113.62 113.55 3dkj n SER 402 Ca 0.11 -0.62 -0.08 0.00 -0.26 0.00 0.00 58.87 58.02 3dkj n SER 402 Cb 0.44 0.72 -0.07 0.00 -0.26 0.00 0.00 64.21 65.04 3dkj n SER 402 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3dkj s TYR 403 N -0.72 -1.03 0.11 7.33 5.04 -1.09 0.10 117.35 127.09 3dkj s TYR 403 Ca 0.00 2.10 0.05 0.00 -2.44 0.00 0.00 57.07 56.78 3dkj s TYR 403 Cb 0.00 0.59 -0.04 0.00 0.35 0.00 0.00 41.96 42.86 3dkj s TYR 403 CO 0.00 -0.51 -0.11 0.14 -1.34 0.00 0.00 175.55 173.73 3dkj s VAL 404 N 1.48 1.10 -0.21 3.14 -7.23 -0.76 -0.47 120.40 117.45 3dkj s VAL 404 Ca -0.09 -1.73 -0.02 0.00 -1.81 0.00 0.00 61.98 58.34 3dkj s VAL 404 Cb -0.05 -1.49 0.01 0.00 0.56 0.00 0.00 36.38 35.41 3dkj s VAL 404 CO -0.17 -0.54 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.28 3dkj s VAL 405 N -2.48 2.82 -0.07 1.32 1.01 -0.49 -0.47 120.40 122.04 3dkj s VAL 405 Ca 0.08 -0.71 0.00 0.00 0.00 0.00 0.00 61.98 61.36 3dkj s VAL 405 Cb -0.03 -2.26 0.02 0.00 0.00 0.00 0.00 36.38 34.11 3dkj s VAL 405 CO 0.01 0.45 -0.05 -0.89 0.00 0.00 0.00 175.10 174.62 3dkj s THR 406 N 1.39 0.73 -1.45 3.92 2.01 -0.74 0.13 115.64 121.63 3dkj s THR 406 Ca 0.05 -0.17 -0.07 0.00 0.31 0.00 0.00 61.69 61.81 3dkj s THR 406 Cb -0.14 -0.77 0.05 0.00 0.01 0.00 0.00 72.50 71.65 3dkj s THR 406 CO -0.07 0.30 0.77 0.59 -0.69 0.00 0.00 174.62 175.51 3dkj n ASN 407 N 4.53 -2.62 0.00 3.53 3.02 0.30 -2.26 115.26 121.77 3dkj n ASN 407 Ca -0.17 -0.86 0.00 0.00 -0.03 0.00 0.00 54.58 53.53 3dkj n ASN 407 Cb 0.51 -3.69 0.00 0.00 -0.61 0.00 0.00 39.78 35.99 3dkj n ASN 407 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dkj n GLY 408 N -1.68 0.26 3.51 7.41 0.00 -1.26 -4.98 105.19 108.45 3dkj n GLY 408 Ca -0.13 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.54 3dkj n GLY 408 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dkj s LEU 409 N 0.00 3.46 0.11 0.99 1.43 -0.96 -5.09 118.68 118.61 3dkj s LEU 409 Ca 0.00 -0.11 -0.30 0.00 -1.03 0.00 0.00 54.13 52.69 3dkj s LEU 409 Cb 0.00 -1.88 -0.06 0.00 0.03 0.00 0.00 46.19 44.28 3dkj s LEU 409 CO 0.00 0.09 1.06 -0.83 0.23 0.00 0.00 176.35 176.90 3dkj s GLY 410 N 0.86 2.81 0.05 -3.19 0.00 -1.26 -1.80 107.32 104.80 3dkj s GLY 410 Ca 0.02 0.71 0.06 0.00 0.00 0.00 0.00 44.72 45.51 3dkj s GLY 410 CO 0.02 1.68 -0.16 -0.26 0.00 0.00 0.00 173.10 174.38 3dkj s ILE 411 N 0.28 1.32 -0.12 0.90 -4.36 0.38 -4.99 121.20 114.60 3dkj s ILE 411 Ca 0.51 -1.14 -0.24 0.00 -0.26 0.00 0.00 60.65 59.52 3dkj s ILE 411 Cb -0.26 -1.19 -0.02 0.00 1.25 0.00 0.00 42.46 42.24 3dkj s ILE 411 CO 0.31 0.02 0.77 0.20 0.24 0.00 0.00 174.94 176.48 3dkj s ASN 412 N -1.29 6.96 0.17 4.36 0.01 -1.26 -1.83 114.94 122.05 3dkj s ASN 412 Ca 0.03 1.16 0.08 0.00 -0.71 0.00 0.00 52.86 53.42 3dkj s ASN 412 Cb -0.09 -2.43 -0.04 0.00 0.41 0.00 0.00 41.25 39.10 3dkj s ASN 412 CO 0.02 -0.27 -0.15 0.68 -1.51 0.00 0.00 177.10 175.86 3dkj s VAL 413 N 1.55 1.66 -0.13 1.60 -7.23 -0.06 -4.82 120.40 112.97 3dkj s VAL 413 Ca 0.38 -2.01 -0.33 0.00 -1.81 0.00 0.00 61.98 58.20 3dkj s VAL 413 Cb -0.17 -1.87 0.13 0.00 0.56 0.00 0.00 36.38 35.03 3dkj s VAL 413 CO 0.15 -0.47 1.16 0.72 -0.31 0.00 0.00 175.10 176.35 3dkj s PHE 414 N -2.51 -0.16 0.17 2.82 -0.12 -1.26 -4.15 117.98 112.78 3dkj s PHE 414 Ca 0.17 0.08 0.05 0.00 -0.05 0.00 0.00 56.93 57.19 3dkj s PHE 414 Cb -0.03 0.53 -0.04 0.00 -0.63 0.00 0.00 43.02 42.85 3dkj s PHE 414 CO 0.06 -0.29 0.13 -1.59 -0.05 0.00 0.00 175.22 173.48 3dkj s LYS 415 N -2.56 2.87 -0.46 1.99 -2.85 -1.26 -4.97 119.74 112.50 3dkj s LYS 415 Ca 0.09 -0.90 0.07 0.00 -1.00 0.00 0.00 55.97 54.23 3dkj s LYS 415 Cb -0.00 -2.62 0.24 0.00 -2.06 0.00 0.00 37.83 33.39 3dkj s LYS 415 CO -0.05 0.48 0.78 -3.47 0.10 0.00 0.00 175.35 173.19 3dkj n ASP 416 N -0.39 -2.01 -4.73 0.03 2.03 -1.26 -1.27 116.55 108.95 3dkj n ASP 416 Ca -0.08 -3.13 -0.42 0.00 0.52 0.00 0.00 54.79 51.68 3dkj n ASP 416 Cb 0.55 1.12 -0.02 0.00 -0.72 0.00 0.00 41.12 42.05 3dkj n ASP 416 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 3dkj s PRO 417 N 0.15 4.15 0.20 -0.67 0.02 -1.26 -4.89 135.00 132.70 3dkj s PRO 417 Ca 0.33 2.52 -0.12 0.00 0.02 0.00 0.00 61.00 63.76 3dkj s PRO 417 Cb 0.21 -3.07 0.24 0.00 0.02 0.00 0.00 34.50 31.90 3dkj s PRO 417 CO -0.21 -0.64 1.71 -0.24 -0.33 0.00 0.00 177.00 177.29 3dkj h VAL 418 N 3.64 0.69 -0.00 3.83 3.04 -2.02 -2.18 116.25 123.25 3dkj h VAL 418 Ca -0.45 -0.09 0.00 0.00 -1.01 0.00 0.00 66.70 65.15 3dkj h VAL 418 Cb 1.21 0.41 0.00 0.00 -2.01 0.00 0.00 31.29 30.91 3dkj h VAL 418 CO 0.86 0.05 -0.02 0.00 -1.01 0.00 0.00 177.57 177.45 3dkj n ALA 419 N -2.56 2.60 -3.24 3.17 0.00 -1.26 -4.56 120.51 114.66 3dkj n ALA 419 Ca 0.07 -0.19 -0.16 0.00 0.00 0.00 0.00 53.44 53.16 3dkj n ALA 419 Cb 0.28 -1.47 -0.06 0.00 0.00 0.00 0.00 19.45 18.20 3dkj n ALA 419 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3dkj s ASP 420 N -2.36 0.61 0.52 0.00 -1.08 -0.82 -5.00 116.67 108.55 3dkj s ASP 420 Ca 0.35 -2.00 0.30 0.00 -0.52 0.00 0.00 52.55 50.67 3dkj s ASP 420 Cb 0.21 0.61 1.43 0.00 -1.46 0.00 0.00 42.92 43.71 3dkj s ASP 420 CO 0.43 -0.19 1.89 -0.65 0.52 0.00 0.00 175.17 177.17 3dkj h PRO 421 N 6.24 0.05 0.00 4.34 0.11 -1.80 -1.08 132.00 139.86 3dkj h PRO 421 Ca 0.11 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.22 3dkj h PRO 421 Cb 1.03 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.13 3dkj h PRO 421 CO 0.20 0.03 -0.01 -0.91 -0.21 0.00 0.00 178.00 177.10 3dkj h ASN 422 N 0.05 0.00 0.04 -2.05 2.35 -1.94 -2.50 115.58 111.53 3dkj h ASN 422 Ca 0.43 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.18 3dkj h ASN 422 Cb 1.63 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.00 3dkj h ASN 422 CO -0.03 0.01 -0.09 0.29 -1.65 0.00 0.00 177.43 175.97 3dkj n LYS 423 N -3.27 1.57 -1.65 0.81 5.02 -0.41 -4.87 118.16 115.36 3dkj n LYS 423 Ca -0.02 -1.03 -0.47 0.00 -2.02 0.00 0.00 58.31 54.77 3dkj n LYS 423 Cb 0.12 -1.48 -0.04 0.00 -0.02 0.00 0.00 35.03 33.61 3dkj n LYS 423 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3dkj n ARG 424 N 0.18 1.95 -3.46 1.97 0.63 -0.95 -4.66 116.66 112.33 3dkj n ARG 424 Ca 0.16 0.70 -0.20 0.00 -0.92 0.00 0.00 57.85 57.60 3dkj n ARG 424 Cb 0.40 -2.44 -0.02 0.00 0.45 0.00 0.00 32.46 30.86 3dkj n ARG 424 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 3dkj s SER 425 N 0.78 5.39 0.55 6.15 1.04 -0.39 -4.99 113.70 122.22 3dkj s SER 425 Ca 0.79 -0.53 -0.14 0.00 0.48 0.00 0.00 55.95 56.55 3dkj s SER 425 Cb -0.73 -0.77 -0.06 0.00 0.10 0.00 0.00 66.02 64.56 3dkj s SER 425 CO 0.40 -0.58 0.99 -0.54 0.98 0.00 0.00 173.24 174.49 3dkj s LYS 426 N -4.16 3.82 -0.11 4.02 1.02 -1.26 -4.64 119.74 118.42 3dkj s LYS 426 Ca 0.48 0.86 -0.01 0.00 0.02 0.00 0.00 55.97 57.32 3dkj s LYS 426 Cb -0.06 -2.13 -0.03 0.00 -0.52 0.00 0.00 37.83 35.09 3dkj s LYS 426 CO 0.29 -0.37 -0.06 0.15 -0.92 0.00 0.00 175.35 174.45 3dkj s LYS 427 N -4.45 3.22 1.26 1.68 1.02 -1.26 -4.58 119.74 116.61 3dkj s LYS 427 Ca 0.57 -0.54 0.00 0.00 0.02 0.00 0.00 55.97 56.02 3dkj s LYS 427 Cb -0.10 -2.74 0.00 0.00 -0.52 0.00 0.00 37.83 34.47 3dkj s LYS 427 CO 0.39 0.44 0.00 0.41 -0.92 0.00 0.00 175.35 175.67 3dkj n GLY 428 N 2.90 -1.87 3.75 -3.33 0.00 0.28 -1.22 105.19 105.70 3dkj n GLY 428 Ca -0.18 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.00 3dkj n GLY 428 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dkj s ARG 429 N 0.00 4.68 0.16 1.61 0.52 -1.26 -4.43 118.95 120.23 3dkj s ARG 429 Ca 0.00 1.67 0.11 0.00 -0.52 0.00 0.00 55.73 56.99 3dkj s ARG 429 Cb 0.00 -3.26 -0.04 0.00 0.52 0.00 0.00 34.95 32.17 3dkj s ARG 429 CO 0.00 0.23 -0.23 -0.51 0.02 0.00 0.00 175.30 174.81 3dkj s LEU 430 N -0.87 2.47 0.01 2.53 1.43 -1.26 -0.77 118.68 122.22 3dkj s LEU 430 Ca 0.46 -0.76 -0.15 0.00 -1.03 0.00 0.00 54.13 52.64 3dkj s LEU 430 Cb -0.29 -1.27 0.02 0.00 0.03 0.00 0.00 46.19 44.68 3dkj s LEU 430 CO 0.36 0.15 0.32 -0.94 0.23 0.00 0.00 176.35 176.47 3dkj s SER 431 N -2.40 -0.18 -0.12 2.29 1.04 -0.88 -5.00 113.70 108.45 3dkj s SER 431 Ca 0.18 0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.62 3dkj s SER 431 Cb -0.09 0.34 -0.02 0.00 0.10 0.00 0.00 66.02 66.35 3dkj s SER 431 CO 0.09 -0.51 -0.13 -0.22 0.98 0.00 0.00 173.24 173.45 3dkj s LEU 432 N -1.59 2.75 0.05 2.42 2.96 -1.26 -0.79 118.68 123.21 3dkj s LEU 432 Ca -0.10 -0.30 0.01 0.00 -0.22 0.00 0.00 54.13 53.52 3dkj s LEU 432 Cb -0.03 -1.61 -0.03 0.00 0.50 0.00 0.00 46.19 45.01 3dkj s LEU 432 CO 0.02 0.19 -0.06 -1.00 -1.32 0.00 0.00 176.35 174.18 3dkj s HIS 433 N 0.21 0.58 0.14 5.38 3.76 0.00 0.68 115.29 126.04 3dkj s HIS 433 Ca -0.08 -0.64 -0.30 0.00 -0.15 0.00 0.00 55.06 53.89 3dkj s HIS 433 Cb -0.15 -0.36 -0.07 0.00 1.11 0.00 0.00 32.58 33.11 3dkj s HIS 433 CO 0.05 -0.16 1.08 0.50 -0.85 0.00 0.00 174.74 175.36 3dkj s ARG 434 N -2.20 4.59 0.49 1.40 6.06 -1.26 -0.63 118.95 127.40 3dkj s ARG 434 Ca -0.06 1.66 -0.05 0.00 -2.50 0.00 0.00 55.73 54.78 3dkj s ARG 434 Cb -0.05 -3.31 -0.03 0.00 0.06 0.00 0.00 34.95 31.61 3dkj s ARG 434 CO -0.02 0.05 0.79 0.95 -2.50 0.00 0.00 175.30 174.57 3dkj s THR 435 N 0.04 4.80 0.31 4.11 -4.23 -0.41 -4.82 115.64 115.45 3dkj s THR 435 Ca 0.50 0.15 0.08 0.00 -1.18 0.00 0.00 61.69 61.25 3dkj s THR 435 Cb -0.28 -3.83 0.31 0.00 1.34 0.00 0.00 72.50 70.04 3dkj s THR 435 CO 0.33 -0.80 1.74 -0.65 -0.54 0.00 0.00 174.62 174.70 3dkj h PRO 436 N 0.21 0.61 -0.01 3.99 0.11 -1.97 0.12 132.00 135.06 3dkj h PRO 436 Ca -0.47 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3dkj h PRO 436 Cb 1.21 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3dkj h PRO 436 CO 0.61 0.40 0.00 0.00 -0.21 0.00 0.00 178.00 178.81 3dkj n ALA 437 N -2.32 2.64 -0.43 -0.75 0.00 -1.26 -4.89 120.51 113.50 3dkj n ALA 437 Ca 0.26 -0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.53 3dkj n ALA 437 Cb 0.69 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.77 3dkj n ALA 437 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dkj n GLY 438 N 0.89 0.76 0.00 0.00 0.00 0.43 -5.08 105.19 102.19 3dkj n GLY 438 Ca 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3dkj n GLY 438 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dkj n ASN 439 N 0.40 0.00 -4.28 1.61 5.03 -1.25 -4.78 115.26 111.99 3dkj n ASN 439 Ca 0.00 0.00 -0.26 0.00 0.87 0.00 0.00 54.58 55.19 3dkj n ASN 439 Cb 0.00 0.00 -0.14 0.00 -1.02 0.00 0.00 39.78 38.62 3dkj n ASN 439 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 3dkj s PHE 440 N 1.68 1.87 -0.05 3.10 0.40 -1.26 -1.28 117.98 122.44 3dkj s PHE 440 Ca 0.00 -0.39 -0.04 0.00 -0.60 0.00 0.00 56.93 55.90 3dkj s PHE 440 Cb 0.00 -1.08 0.02 0.00 0.51 0.00 0.00 43.02 42.46 3dkj s PHE 440 CO 0.00 0.14 0.12 0.54 0.70 0.00 0.00 175.22 176.73 3dkj s VAL 441 N -0.93 -0.01 -0.36 -0.44 0.11 0.20 -4.83 120.40 114.15 3dkj s VAL 441 Ca 0.08 0.03 -0.14 0.00 -2.93 0.00 0.00 61.98 59.01 3dkj s VAL 441 Cb -0.09 -0.18 -0.01 0.00 -1.53 0.00 0.00 36.38 34.56 3dkj s VAL 441 CO 0.03 0.01 0.30 -0.89 -3.33 0.00 0.00 175.10 171.21 3dkj s THR 442 N 0.22 5.24 0.01 5.04 2.01 -1.26 -0.82 115.64 126.08 3dkj s THR 442 Ca -0.01 -0.21 -0.23 0.00 0.31 0.00 0.00 61.69 61.55 3dkj s THR 442 Cb -0.02 -3.80 -0.05 0.00 0.01 0.00 0.00 72.50 68.64 3dkj s THR 442 CO -0.01 -0.10 0.67 -0.76 -0.69 0.00 0.00 174.62 173.74 3dkj s LEU 443 N 1.83 4.42 0.45 4.42 1.43 0.03 -4.93 118.68 126.33 3dkj s LEU 443 Ca 0.08 1.28 0.08 0.00 -1.03 0.00 0.00 54.13 54.54 3dkj s LEU 443 Cb -0.17 -3.06 0.00 0.00 0.03 0.00 0.00 46.19 42.98 3dkj s LEU 443 CO 0.11 0.05 0.43 -1.61 0.23 0.00 0.00 176.35 175.56 3dkj s GLU 444 N -0.05 2.49 -1.45 1.70 2.02 -1.26 -2.08 118.70 120.07 3dkj s GLU 444 Ca 0.35 -1.60 -0.04 0.00 0.02 0.00 0.00 54.97 53.69 3dkj s GLU 444 Cb -0.19 -2.38 0.02 0.00 0.10 0.00 0.00 34.13 31.67 3dkj s GLU 444 CO 0.20 -0.33 0.37 0.39 0.02 0.00 0.00 175.26 175.91 3dkj n GLU 445 N -1.67 -3.54 -1.04 1.61 1.02 -0.36 -1.12 120.64 115.54 3dkj n GLU 445 Ca 0.04 0.78 -0.01 0.00 -0.02 0.00 0.00 57.16 57.94 3dkj n GLU 445 Cb 0.62 -5.53 -0.01 0.00 -0.02 0.00 0.00 31.44 26.51 3dkj n GLU 445 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dkj n GLY 446 N -1.23 0.33 0.27 0.62 0.00 0.05 -4.77 105.19 100.45 3dkj n GLY 446 Ca -0.12 -0.05 0.18 0.00 0.00 0.00 0.00 46.02 46.03 3dkj n GLY 446 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dkj h LYS 447 N 0.36 0.00 -0.01 1.61 1.57 -1.35 -2.02 116.57 116.73 3dkj h LYS 447 Ca -0.03 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.76 3dkj h LYS 447 Cb 0.62 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.92 3dkj h LYS 447 CO 0.04 0.00 0.01 0.78 -0.57 0.00 0.00 179.45 179.72 3dkj h GLY 448 N 0.33 0.00 2.00 3.86 0.00 -1.84 -2.24 103.07 105.18 3dkj h GLY 448 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3dkj h GLY 448 CO 0.00 0.00 -0.13 -0.55 0.00 0.00 0.00 176.54 175.86 3dkj h ASP 449 N 0.00 0.00 0.48 0.19 3.32 -1.77 -2.61 116.42 116.02 3dkj h ASP 449 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3dkj h ASP 449 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.58 3dkj h ASP 449 CO -0.00 0.13 0.00 0.18 -1.72 0.00 0.00 179.24 177.83 3dkj n LEU 450 N -3.47 0.59 -3.89 1.55 4.77 -0.84 -4.92 117.00 110.78 3dkj n LEU 450 Ca -0.01 0.68 -0.29 0.00 -0.03 0.00 0.00 56.01 56.36 3dkj n LEU 450 Cb 0.29 -0.65 0.03 0.00 -2.33 0.00 0.00 43.42 40.76 3dkj n LEU 450 CO 0.30 -0.66 0.09 -0.62 -1.33 0.00 0.00 177.39 175.17 3dkj n GLU 451 N -2.19 -5.51 0.00 3.23 1.02 -0.99 -4.88 120.64 111.32 3dkj n GLU 451 Ca 0.01 0.60 0.13 0.00 -0.02 0.00 0.00 57.16 57.88 3dkj n GLU 451 Cb 0.16 -5.46 0.33 0.00 -0.02 0.00 0.00 31.44 26.46 3dkj n GLU 451 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3dkj n GLU 452 N -4.66 1.28 -1.19 3.49 1.02 -1.26 -4.48 120.64 114.84 3dkj n GLU 452 Ca 0.01 -0.84 0.03 0.00 -0.02 0.00 0.00 57.16 56.34 3dkj n GLU 452 Cb 0.54 -1.48 0.03 0.00 -0.02 0.00 0.00 31.44 30.51 3dkj n GLU 452 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3dkj n TYR 453 N -0.12 0.00 -1.23 -0.32 4.01 -1.26 -5.09 117.16 113.14 3dkj n TYR 453 Ca 0.14 -0.47 0.11 0.00 -0.16 0.00 0.00 57.90 57.51 3dkj n TYR 453 Cb 0.39 -0.14 -0.03 0.00 -0.31 0.00 0.00 39.34 39.26 3dkj n TYR 453 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dkj n GLY 454 N 0.23 -1.99 3.82 2.72 0.00 -1.26 -4.39 105.19 104.33 3dkj n GLY 454 Ca 0.06 -1.29 -0.33 0.00 0.00 0.00 0.00 46.02 44.46 3dkj n GLY 454 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3dkj s GLN 455 N -1.57 3.80 0.13 1.61 -2.07 -1.26 -4.95 119.66 115.35 3dkj s GLN 455 Ca 0.00 1.11 -0.34 0.00 -1.82 0.00 0.00 55.36 54.32 3dkj s GLN 455 Cb 0.00 -2.11 -0.13 0.00 -1.09 0.00 0.00 33.01 29.68 3dkj s GLN 455 CO 0.00 -0.40 1.64 -3.47 -1.32 0.00 0.00 175.29 171.74 3dkj n ASP 456 N -1.45 3.28 0.00 12.60 4.64 -1.26 -4.64 116.55 129.71 3dkj n ASP 456 Ca 0.08 1.06 0.13 0.00 -1.38 0.00 0.00 54.79 54.68 3dkj n ASP 456 Cb 0.53 -1.44 0.61 0.00 -1.04 0.00 0.00 41.12 39.78 3dkj n ASP 456 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 3dkj n LEU 457 N 4.01 0.00 -4.77 -2.67 4.77 0.21 -4.81 117.00 113.74 3dkj n LEU 457 Ca 0.18 0.41 -0.39 0.00 -0.03 0.00 0.00 56.01 56.17 3dkj n LEU 457 Cb 0.30 -0.41 -0.06 0.00 -2.33 0.00 0.00 43.42 40.92 3dkj n LEU 457 CO 0.65 -0.04 0.51 -0.76 -1.33 0.00 0.00 177.39 176.41 3dkj s LEU 458 N -2.82 4.60 0.09 2.23 1.43 -1.26 -4.34 118.68 118.61 3dkj s LEU 458 Ca 0.18 1.69 0.08 0.00 -1.03 0.00 0.00 54.13 55.05 3dkj s LEU 458 Cb 0.17 -3.34 -0.03 0.00 0.03 0.00 0.00 46.19 43.02 3dkj s LEU 458 CO 0.45 0.20 -0.21 -1.00 0.23 0.00 0.00 176.35 176.02 3dkj s HIS 459 N -1.14 1.82 -0.08 0.29 3.76 -0.29 -4.79 115.29 114.86 3dkj s HIS 459 Ca 0.37 -0.41 -0.30 0.00 -0.15 0.00 0.00 55.06 54.57 3dkj s HIS 459 Cb -0.24 -1.02 -0.05 0.00 1.11 0.00 0.00 32.58 32.39 3dkj s HIS 459 CO 0.27 0.18 1.58 0.99 -0.85 0.00 0.00 174.74 176.91 3dkj s THR 460 N -1.06 3.72 -0.11 1.30 2.01 -1.26 -0.37 115.64 119.86 3dkj s THR 460 Ca 0.07 0.86 0.11 0.00 0.31 0.00 0.00 61.69 63.04 3dkj s THR 460 Cb -0.10 -3.57 -0.16 0.00 0.01 0.00 0.00 72.50 68.69 3dkj s THR 460 CO 0.04 -0.09 0.28 1.33 -0.69 0.00 0.00 174.62 175.49 3dkj n VAL 461 N 5.50 0.00 -3.76 3.82 0.24 0.49 -4.09 118.33 120.53 3dkj n VAL 461 Ca 0.17 -0.25 -0.13 0.00 -2.04 0.00 0.00 64.34 62.09 3dkj n VAL 461 Cb 0.43 0.41 -0.12 0.00 -1.47 0.00 0.00 33.84 33.09 3dkj n VAL 461 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3dkj s PHE 462 N -2.59 -0.29 -0.23 6.34 5.36 -1.02 -0.79 117.98 124.77 3dkj s PHE 462 Ca -0.02 0.69 -0.07 0.00 -0.96 0.00 0.00 56.93 56.57 3dkj s PHE 462 Cb 0.07 0.06 0.10 0.00 -0.34 0.00 0.00 43.02 42.92 3dkj s PHE 462 CO 0.44 -0.18 0.48 0.21 -1.46 0.00 0.00 175.22 174.71 3dkj s LYS 463 N 0.70 0.39 -1.32 10.12 2.20 -0.40 -0.57 119.74 130.86 3dkj s LYS 463 Ca -0.05 1.11 -0.01 0.00 -0.36 0.00 0.00 55.97 56.67 3dkj s LYS 463 Cb -0.06 0.43 0.00 0.00 -1.51 0.00 0.00 37.83 36.70 3dkj s LYS 463 CO -0.04 -0.26 0.69 0.09 -0.36 0.00 0.00 175.35 175.46 3dkj n ASN 464 N 5.40 -1.22 0.00 1.43 5.03 -0.35 -1.92 115.26 123.64 3dkj n ASN 464 Ca -0.09 -0.83 0.00 0.00 0.87 0.00 0.00 54.58 54.53 3dkj n ASN 464 Cb 0.49 -3.98 0.00 0.00 -1.02 0.00 0.00 39.78 35.27 3dkj n ASN 464 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3dkj n GLY 465 N -1.61 0.83 3.25 7.41 0.00 -0.97 -4.69 105.19 109.40 3dkj n GLY 465 Ca -0.29 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.43 3dkj n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dkj s LYS 466 N -0.30 2.39 -0.20 1.61 -0.14 -0.81 -0.61 119.74 121.68 3dkj s LYS 466 Ca 0.00 -0.86 -0.29 0.00 -1.36 0.00 0.00 55.97 53.46 3dkj s LYS 466 Cb 0.00 -2.04 -0.00 0.00 -1.68 0.00 0.00 37.83 34.10 3dkj s LYS 466 CO 0.00 0.37 1.20 0.08 -0.76 0.00 0.00 175.35 176.24 3dkj s VAL 467 N -0.16 4.38 -0.31 3.17 1.01 -1.26 -1.27 120.40 125.96 3dkj s VAL 467 Ca -0.03 1.65 0.16 0.00 0.00 0.00 0.00 61.98 63.76 3dkj s VAL 467 Cb -0.13 -4.11 -0.21 0.00 0.00 0.00 0.00 36.38 31.92 3dkj s VAL 467 CO 0.03 -0.20 0.47 0.35 0.00 0.00 0.00 175.10 175.75 3dkj n THR 468 N 5.47 0.00 -3.67 3.92 -2.24 0.03 -4.92 114.28 112.87 3dkj n THR 468 Ca 0.13 -0.27 -0.09 0.00 -2.27 0.00 0.00 64.05 61.56 3dkj n THR 468 Cb 0.45 0.49 -0.10 0.00 -2.10 0.00 0.00 70.33 69.08 3dkj n THR 468 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3dkj s LYS 469 N -2.83 0.41 0.16 -0.78 2.47 -1.24 -4.94 119.74 112.99 3dkj s LYS 469 Ca -0.01 0.97 0.11 0.00 -1.56 0.00 0.00 55.97 55.48 3dkj s LYS 469 Cb 0.11 0.18 -0.04 0.00 -1.46 0.00 0.00 37.83 36.62 3dkj s LYS 469 CO 0.64 -0.20 -0.25 -1.12 0.16 0.00 0.00 175.35 174.59 3dkj s SER 470 N 1.99 3.43 -0.02 1.43 0.01 -1.26 -4.79 113.70 114.49 3dkj s SER 470 Ca -0.06 -0.80 0.07 0.00 1.31 0.00 0.00 55.95 56.46 3dkj s SER 470 Cb -0.10 -0.26 -0.02 0.00 0.21 0.00 0.00 66.02 65.85 3dkj s SER 470 CO -0.14 0.15 -0.22 -0.31 0.41 0.00 0.00 173.24 173.13 3dkj s TYR 471 N -1.40 2.45 0.67 2.43 1.51 -1.26 -5.13 117.35 116.62 3dkj s TYR 471 Ca 0.18 -0.35 -0.11 0.00 -1.01 0.00 0.00 57.07 55.78 3dkj s TYR 471 Cb -0.09 -1.53 -0.01 0.00 -0.11 0.00 0.00 41.96 40.23 3dkj s TYR 471 CO 0.08 0.05 1.07 -1.54 -1.11 0.00 0.00 175.55 174.10 3dkj s SER 472 N -0.72 5.75 0.38 2.29 1.04 -1.26 -4.75 113.70 116.43 3dkj s SER 472 Ca 0.11 1.25 0.09 0.00 0.48 0.00 0.00 55.95 57.88 3dkj s SER 472 Cb -0.10 -2.15 0.74 0.00 0.10 0.00 0.00 66.02 64.61 3dkj s SER 472 CO -0.00 -1.16 1.90 0.15 0.98 0.00 0.00 173.24 175.11 3dkj h PHE 473 N -0.53 0.29 -0.77 5.02 3.57 -0.86 -2.56 116.94 121.10 3dkj h PHE 473 Ca -0.45 -0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.03 3dkj h PHE 473 Cb 1.23 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.85 3dkj h PHE 473 CO 0.57 0.40 0.51 -0.44 -2.23 0.00 0.00 178.31 177.12 3dkj h ASP 474 N 0.27 0.89 -0.51 0.41 3.32 -1.92 -1.48 116.42 117.39 3dkj h ASP 474 Ca 0.05 -0.02 -0.05 0.00 0.02 0.00 0.00 57.03 57.03 3dkj h ASP 474 Cb 0.39 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.69 3dkj h ASP 474 CO 0.02 0.64 0.14 -0.33 -1.72 0.00 0.00 179.24 177.99 3dkj h GLU 475 N 1.05 0.81 -0.49 3.56 5.08 -1.85 -2.38 114.58 120.36 3dkj h GLU 475 Ca 0.28 -0.19 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3dkj h GLU 475 Cb -0.12 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 28.99 3dkj h GLU 475 CO -0.06 0.77 0.31 0.82 -1.00 0.00 0.00 179.01 179.85 3dkj h ILE 476 N 0.71 1.14 -0.83 3.13 2.04 -1.23 -0.02 117.51 122.44 3dkj h ILE 476 Ca 0.16 -0.30 0.01 0.00 1.00 0.00 0.00 64.86 65.73 3dkj h ILE 476 Cb 0.31 0.46 -0.04 0.00 -0.74 0.00 0.00 36.82 36.81 3dkj h ILE 476 CO -0.00 0.14 0.54 0.03 0.00 0.00 0.00 178.15 178.87 3dkj h ARG 477 N 0.66 1.10 -0.30 2.37 3.08 -1.22 -1.78 114.38 118.30 3dkj h ARG 477 Ca 0.18 -0.07 -0.02 0.00 0.07 0.00 0.00 59.98 60.14 3dkj h ARG 477 Cb -0.03 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.76 3dkj h ARG 477 CO -0.04 0.74 0.11 -0.22 -1.07 0.00 0.00 179.97 179.49 3dkj h LYS 478 N 1.13 0.46 -0.19 0.04 3.64 -0.97 -2.37 116.57 118.30 3dkj h LYS 478 Ca 0.30 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.59 3dkj h LYS 478 Cb -0.12 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 31.62 3dkj h LYS 478 CO -0.06 0.48 0.11 -0.91 -2.27 0.00 0.00 179.45 176.80 3dkj h ASN 479 N 0.34 0.23 -0.33 4.20 -0.26 -0.63 -2.79 115.58 116.34 3dkj h ASN 479 Ca 0.10 -0.01 0.00 0.00 -0.56 0.00 0.00 56.30 55.83 3dkj h ASN 479 Cb 0.20 -0.06 0.00 0.00 -1.06 0.00 0.00 38.32 37.41 3dkj h ASN 479 CO -0.01 0.18 0.00 0.00 -1.06 0.00 0.00 177.43 176.55 3dkj n ALA 480 N -2.51 2.45 -1.47 -0.83 0.00 -0.70 -4.42 120.51 113.02 3dkj n ALA 480 Ca -0.00 -0.86 -0.39 0.00 0.00 0.00 0.00 53.44 52.20 3dkj n ALA 480 Cb 0.09 -0.94 0.03 0.00 0.00 0.00 0.00 19.45 18.64 3dkj n ALA 480 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3dkj n GLN 481 N 1.16 0.55 -1.82 0.00 6.02 -0.92 -4.97 117.38 117.41 3dkj n GLN 481 Ca 0.18 0.21 -0.34 0.00 -0.01 0.00 0.00 57.00 57.05 3dkj n GLN 481 Cb 0.53 -1.70 0.04 0.00 1.02 0.00 0.00 30.24 30.13 3dkj n GLN 481 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3dkj s LEU 482 N 0.75 3.46 0.00 1.08 1.43 -1.26 -5.01 118.68 119.14 3dkj s LEU 482 Ca 0.68 2.10 0.00 0.00 -1.03 0.00 0.00 54.13 55.88 3dkj s LEU 482 Cb -0.46 -4.56 0.00 0.00 0.03 0.00 0.00 46.19 41.19 3dkj s LEU 482 CO 0.55 -1.64 0.89 0.59 0.23 0.00 0.00 176.35 176.97 3dkj n ASN 483 N -2.20 0.00 0.00 2.29 3.02 -1.26 -5.20 115.26 111.90 3dkj n ASN 483 Ca 0.11 0.89 0.00 0.00 -0.03 0.00 0.00 54.58 55.55 3dkj n ASN 483 Cb 0.51 -0.39 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 3dkj n ASN 483 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26