#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dkl s ASN 10 N 0.00 3.95 0.64 -2.13 3.84 -1.26 -5.02 114.94 114.96 3dkl s ASN 10 Ca 0.00 -1.43 0.35 0.00 0.21 0.00 0.00 52.86 51.99 3dkl s ASN 10 Cb 0.00 -1.10 1.96 0.00 -0.55 0.00 0.00 41.25 41.56 3dkl s ASN 10 CO 0.00 -0.32 2.18 -0.29 -2.79 0.00 0.00 177.10 175.89 3dkl h ILE 11 N 6.59 0.21 0.00 -5.21 2.10 -1.90 0.17 117.51 119.46 3dkl h ILE 11 Ca -0.14 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.80 3dkl h ILE 11 Cb 1.05 0.88 0.00 0.00 -1.09 0.00 0.00 36.82 37.66 3dkl h ILE 11 CO 0.44 0.00 0.00 -0.07 -1.08 0.00 0.00 178.15 177.44 3dkl h LEU 12 N 0.00 0.00 -3.13 2.19 4.07 -1.92 -2.74 115.31 113.79 3dkl h LEU 12 Ca 0.03 0.00 0.00 0.00 0.08 0.00 0.00 57.88 57.99 3dkl h LEU 12 Cb 0.29 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.03 3dkl h LEU 12 CO -0.00 0.00 0.00 0.18 -1.08 0.00 0.00 178.44 177.54 3dkl n LEU 13 N -2.64 3.41 -2.42 1.67 4.77 0.57 -4.71 117.00 117.65 3dkl n LEU 13 Ca 0.02 -2.71 -0.28 0.00 -0.03 0.00 0.00 56.01 53.01 3dkl n LEU 13 Cb 0.28 -0.43 0.01 0.00 -2.33 0.00 0.00 43.42 40.96 3dkl n LEU 13 CO 0.24 0.68 0.34 0.00 -1.33 0.00 0.00 177.39 177.32 3dkl n ALA 14 N -0.33 5.22 -2.11 -1.18 0.00 -1.03 -4.99 120.51 116.09 3dkl n ALA 14 Ca 0.17 -4.18 -0.08 0.00 0.00 0.00 0.00 53.44 49.35 3dkl n ALA 14 Cb 0.72 -0.65 -0.10 0.00 0.00 0.00 0.00 19.45 19.41 3dkl n ALA 14 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 3dkl s THR 15 N -5.29 0.29 0.21 0.00 -1.32 -1.26 -4.41 115.64 103.85 3dkl s THR 15 Ca 0.49 -1.84 -0.32 0.00 -1.21 0.00 0.00 61.69 58.81 3dkl s THR 15 Cb 0.41 -1.59 -0.13 0.00 -1.51 0.00 0.00 72.50 69.67 3dkl s THR 15 CO -0.16 -0.93 1.53 0.47 -2.21 0.00 0.00 174.62 173.32 3dkl n ASP 16 N 0.07 3.14 -0.30 8.08 8.00 -1.26 -4.92 116.55 129.36 3dkl n ASP 16 Ca -0.13 1.11 0.12 0.00 0.71 0.00 0.00 54.79 56.60 3dkl n ASP 16 Cb 0.61 -1.46 0.28 0.00 -0.02 0.00 0.00 41.12 40.53 3dkl n ASP 16 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 3dkl h SER 17 N 5.26 -0.06 0.03 -2.24 0.02 -1.99 -0.30 113.55 114.25 3dkl h SER 17 Ca -0.45 0.20 -0.01 0.00 -0.84 0.00 0.00 61.79 60.70 3dkl h SER 17 Cb 1.25 0.29 -0.00 0.00 0.14 0.00 0.00 62.40 64.08 3dkl h SER 17 CO 0.84 -0.17 -0.02 0.10 -1.14 0.00 0.00 176.83 176.43 3dkl h TYR 18 N 0.18 0.00 0.00 3.45 -0.00 -2.02 -2.04 116.97 116.54 3dkl h TYR 18 Ca 0.54 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 59.26 3dkl h TYR 18 Cb 1.09 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.82 3dkl h TYR 18 CO -0.29 0.02 -0.05 0.87 -0.00 0.00 0.00 178.16 178.71 3dkl h LYS 19 N 0.00 0.00 0.00 0.10 1.57 -1.42 0.14 116.57 116.96 3dkl h LYS 19 Ca -0.00 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 3dkl h LYS 19 Cb 0.04 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.35 3dkl h LYS 19 CO 0.00 0.05 -0.07 0.28 -0.57 0.00 0.00 179.45 179.14 3dkl h VAL 20 N 0.00 0.57 -0.02 0.50 2.07 -1.47 -2.67 116.25 115.24 3dkl h VAL 20 Ca -0.00 -0.31 0.00 0.00 0.82 0.00 0.00 66.70 67.21 3dkl h VAL 20 Cb 0.19 1.20 0.00 0.00 -1.52 0.00 0.00 31.29 31.16 3dkl h VAL 20 CO 0.01 0.07 -0.26 0.35 0.02 0.00 0.00 177.57 177.75 3dkl n THR 21 N -3.76 0.00 0.21 2.57 -2.24 0.50 -4.47 114.28 107.09 3dkl n THR 21 Ca -0.02 -0.31 0.10 0.00 -2.27 0.00 0.00 64.05 61.55 3dkl n THR 21 Cb 0.17 1.12 0.35 0.00 -2.10 0.00 0.00 70.33 69.87 3dkl n THR 21 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 3dkl h HIS 22 N 2.88 0.00 0.00 4.78 -0.00 -1.49 -3.01 115.15 118.31 3dkl h HIS 22 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 60.37 60.36 3dkl h HIS 22 Cb 0.76 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.17 3dkl h HIS 22 CO 0.00 0.20 -0.06 0.10 -0.00 0.00 0.00 177.93 178.17 3dkl h TYR 23 N 0.00 0.00 -0.01 2.45 -0.00 -1.79 -0.48 116.97 117.14 3dkl h TYR 23 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 3dkl h TYR 23 Cb 0.89 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.62 3dkl h TYR 23 CO 0.00 0.06 -0.02 1.63 -0.00 0.00 0.00 178.16 179.83 3dkl n LYS 24 N -4.03 1.13 -0.03 0.10 5.02 -1.14 -4.28 118.16 114.94 3dkl n LYS 24 Ca -0.03 -0.34 -0.01 0.00 -2.02 0.00 0.00 58.31 55.91 3dkl n LYS 24 Cb 0.15 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.61 3dkl n LYS 24 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 3dkl n GLN 25 N -0.63 2.00 -1.17 1.97 6.02 -0.20 -5.01 117.38 120.36 3dkl n GLN 25 Ca 0.20 -0.03 -0.34 0.00 -0.01 0.00 0.00 57.00 56.83 3dkl n GLN 25 Cb 0.22 -1.20 0.12 0.00 1.02 0.00 0.00 30.24 30.41 3dkl n GLN 25 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 3dkl s TYR 26 N -2.30 1.82 0.31 1.08 1.51 -1.13 -4.91 117.35 113.72 3dkl s TYR 26 Ca -0.04 1.66 -0.29 0.00 -1.01 0.00 0.00 57.07 57.39 3dkl s TYR 26 Cb 0.03 -3.50 -0.12 0.00 -0.11 0.00 0.00 41.96 38.26 3dkl s TYR 26 CO 0.32 -2.86 1.46 -2.30 -1.11 0.00 0.00 175.55 171.06 3dkl n PRO 27 N -3.19 2.42 -1.52 -1.71 -0.02 -1.26 -4.93 135.00 124.79 3dkl n PRO 27 Ca 0.14 0.86 -0.38 0.00 -2.02 0.00 0.00 63.50 62.09 3dkl n PRO 27 Cb 0.50 -2.55 0.04 0.00 -0.02 0.00 0.00 33.50 31.47 3dkl n PRO 27 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 3dkl n PRO 28 N 1.37 0.63 -2.14 0.52 -0.02 -1.26 -3.20 135.00 130.91 3dkl n PRO 28 Ca 0.07 0.25 -0.09 0.00 -2.02 0.00 0.00 63.50 61.70 3dkl n PRO 28 Cb 0.36 -1.88 -0.01 0.00 -0.02 0.00 0.00 33.50 31.95 3dkl n PRO 28 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3dkl n ASN 29 N -0.03 -3.19 -4.64 2.55 4.13 -1.26 -4.73 115.26 108.08 3dkl n ASN 29 Ca 0.13 0.00 -0.39 0.00 1.68 0.00 0.00 54.58 56.00 3dkl n ASN 29 Cb 0.48 -2.43 -0.08 0.00 -1.54 0.00 0.00 39.78 36.21 3dkl n ASN 29 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 3dkl s THR 30 N -2.45 5.14 -0.49 3.41 2.01 -1.19 -0.59 115.64 121.48 3dkl s THR 30 Ca 0.00 0.79 0.15 0.00 0.31 0.00 0.00 61.69 62.94 3dkl s THR 30 Cb 0.00 -3.78 -0.19 0.00 0.01 0.00 0.00 72.50 68.54 3dkl s THR 30 CO 0.00 0.17 0.55 -1.54 -0.69 0.00 0.00 174.62 173.11 3dkl n SER 31 N 4.97 0.95 -3.72 3.53 3.41 0.36 -4.75 113.62 118.36 3dkl n SER 31 Ca -0.06 -0.57 -0.12 0.00 -0.26 0.00 0.00 58.87 57.85 3dkl n SER 31 Cb 0.50 1.24 -0.12 0.00 -0.26 0.00 0.00 64.21 65.58 3dkl n SER 31 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 3dkl s LYS 32 N -2.66 0.28 -0.11 4.33 2.47 -1.20 -3.90 119.74 118.95 3dkl s LYS 32 Ca 0.02 0.59 0.01 0.00 -1.56 0.00 0.00 55.97 55.03 3dkl s LYS 32 Cb 0.11 -0.05 0.02 0.00 -1.46 0.00 0.00 37.83 36.45 3dkl s LYS 32 CO 0.64 -0.14 -0.13 0.08 0.16 0.00 0.00 175.35 175.96 3dkl s VAL 33 N 1.13 1.36 -0.09 4.02 1.01 -1.26 -1.40 120.40 125.17 3dkl s VAL 33 Ca -0.08 -0.54 0.03 0.00 0.00 0.00 0.00 61.98 61.39 3dkl s VAL 33 Cb -0.09 -1.27 0.01 0.00 0.00 0.00 0.00 36.38 35.03 3dkl s VAL 33 CO -0.08 0.42 -0.20 -0.47 0.00 0.00 0.00 175.10 174.77 3dkl s TYR 34 N 1.21 2.20 0.06 5.22 5.04 0.01 -3.69 117.35 127.39 3dkl s TYR 34 Ca -0.03 -0.92 -0.00 0.00 -2.44 0.00 0.00 57.07 53.68 3dkl s TYR 34 Cb -0.14 -1.51 -0.04 0.00 0.35 0.00 0.00 41.96 40.62 3dkl s TYR 34 CO -0.04 -0.40 -0.04 -1.12 -1.34 0.00 0.00 175.55 172.61 3dkl s SER 35 N 0.54 0.61 0.08 4.32 0.01 -0.13 -0.95 113.70 118.17 3dkl s SER 35 Ca -0.16 -0.97 -0.05 0.00 1.31 0.00 0.00 55.95 56.08 3dkl s SER 35 Cb -0.17 0.17 -0.02 0.00 0.21 0.00 0.00 66.02 66.21 3dkl s SER 35 CO 0.06 -0.56 0.10 -0.72 0.41 0.00 0.00 173.24 172.53 3dkl s TYR 36 N -3.72 0.33 -0.08 2.43 -0.85 -0.01 0.72 117.35 116.17 3dkl s TYR 36 Ca 0.07 -0.81 0.03 0.00 -0.52 0.00 0.00 57.07 55.83 3dkl s TYR 36 Cb 0.06 -0.21 -0.02 0.00 0.38 0.00 0.00 41.96 42.17 3dkl s TYR 36 CO -0.08 -0.48 -0.16 0.12 -1.52 0.00 0.00 175.55 173.43 3dkl s PHE 37 N -3.89 2.69 0.10 -3.49 5.36 -0.15 -1.49 117.98 117.11 3dkl s PHE 37 Ca 0.07 -0.45 0.01 0.00 -0.96 0.00 0.00 56.93 55.59 3dkl s PHE 37 Cb 0.06 -1.70 -0.04 0.00 -0.34 0.00 0.00 43.02 41.00 3dkl s PHE 37 CO -0.10 -0.04 -0.03 -1.83 -1.46 0.00 0.00 175.22 171.75 3dkl s GLU 38 N -0.21 0.84 -0.87 10.12 -1.05 -0.65 -1.41 118.70 125.47 3dkl s GLU 38 Ca -0.00 -1.36 -0.16 0.00 -0.15 0.00 0.00 54.97 53.30 3dkl s GLU 38 Cb -0.13 -0.08 0.18 0.00 -0.44 0.00 0.00 34.13 33.65 3dkl s GLU 38 CO 0.03 -0.08 0.92 0.00 0.95 0.00 0.00 175.26 177.09 3dkl s ARG 40 N 1.27 3.86 0.04 0.00 3.52 -0.61 -0.66 118.95 126.38 3dkl s ARG 40 Ca 0.24 2.33 -0.30 0.00 -0.13 0.00 0.00 55.73 57.87 3dkl s ARG 40 Cb -0.08 -2.74 -0.08 0.00 -1.56 0.00 0.00 34.95 30.49 3dkl s ARG 40 CO -0.09 -0.64 1.67 -1.21 -0.81 0.00 0.00 175.30 174.22 3dkl s GLU 41 N -2.31 4.19 -0.94 5.12 2.02 -1.26 -4.51 118.70 121.01 3dkl s GLU 41 Ca 0.58 2.32 -0.10 0.00 0.02 0.00 0.00 54.97 57.79 3dkl s GLU 41 Cb -0.42 -3.70 0.00 0.00 0.10 0.00 0.00 34.13 30.11 3dkl s GLU 41 CO 0.54 -0.77 0.70 0.66 0.02 0.00 0.00 175.26 176.41 3dkl n TYR 54 N 5.99 -2.17 1.10 1.61 4.02 -1.26 -5.04 117.16 121.42 3dkl n TYR 54 Ca 0.16 0.72 0.13 0.00 -0.01 0.00 0.00 57.90 58.90 3dkl n TYR 54 Cb 0.41 -3.30 0.36 0.00 -0.02 0.00 0.00 39.34 36.78 3dkl n TYR 54 CO 0.00 0.00 0.00 -0.85 -1.01 0.00 0.00 176.86 175.00 3dkl n GLU 55 N -3.14 0.27 -4.08 -0.72 0.28 -1.26 -4.78 120.64 107.21 3dkl n GLU 55 Ca -0.15 -0.14 -0.14 0.00 -0.16 0.00 0.00 57.16 56.57 3dkl n GLU 55 Cb 0.60 -1.50 -0.13 0.00 1.43 0.00 0.00 31.44 31.85 3dkl n GLU 55 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 177.13 175.14 3dkl s GLU 56 N -2.83 0.41 -0.03 3.44 -1.05 -1.26 -0.95 118.70 116.43 3dkl s GLU 56 Ca 0.16 -0.41 0.07 0.00 -0.15 0.00 0.00 54.97 54.64 3dkl s GLU 56 Cb 0.18 -0.28 -0.02 0.00 -0.44 0.00 0.00 34.13 33.58 3dkl s GLU 56 CO 0.62 0.06 -0.24 0.95 0.95 0.00 0.00 175.26 177.60 3dkl s THR 57 N -0.69 1.93 -0.29 1.83 -4.23 0.11 -4.86 115.64 109.46 3dkl s THR 57 Ca -0.04 -1.03 -0.28 0.00 -1.18 0.00 0.00 61.69 59.16 3dkl s THR 57 Cb -0.05 -1.62 0.01 0.00 1.34 0.00 0.00 72.50 72.18 3dkl s THR 57 CO -0.00 0.54 1.00 -0.69 -0.54 0.00 0.00 174.62 174.93 3dkl s VAL 58 N -0.40 4.62 -0.35 2.29 1.01 -1.26 -1.24 120.40 125.08 3dkl s VAL 58 Ca 0.04 1.70 -0.26 0.00 0.00 0.00 0.00 61.98 63.47 3dkl s VAL 58 Cb -0.11 -4.32 0.01 0.00 0.00 0.00 0.00 36.38 31.96 3dkl s VAL 58 CO 0.01 -0.34 0.91 0.12 0.00 0.00 0.00 175.10 175.80 3dkl s PHE 59 N 3.36 3.12 -0.17 5.22 5.36 -0.62 -4.54 117.98 129.71 3dkl s PHE 59 Ca 0.42 0.85 -0.19 0.00 -0.96 0.00 0.00 56.93 57.05 3dkl s PHE 59 Cb -0.13 -3.55 0.05 0.00 -0.34 0.00 0.00 43.02 39.05 3dkl s PHE 59 CO 0.12 -0.75 0.52 -0.47 -1.46 0.00 0.00 175.22 173.18 3dkl s TYR 60 N 3.37 -0.56 0.00 10.12 5.04 -1.26 0.20 117.35 134.27 3dkl s TYR 60 Ca 0.38 1.30 0.00 0.00 -2.44 0.00 0.00 57.07 56.31 3dkl s TYR 60 Cb -0.13 0.21 0.00 0.00 0.35 0.00 0.00 41.96 42.39 3dkl s TYR 60 CO 0.17 -0.32 0.00 0.41 -1.34 0.00 0.00 175.55 174.47 3dkl n GLY 61 N 2.52 1.96 0.17 8.97 0.00 -1.26 -3.11 105.19 114.43 3dkl n GLY 61 Ca -0.15 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.81 3dkl n GLY 61 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dkl h LEU 62 N 0.00 0.30 -1.41 0.99 6.46 -1.94 -2.66 115.31 117.04 3dkl h LEU 62 Ca 0.00 0.02 0.11 0.00 -0.12 0.00 0.00 57.88 57.88 3dkl h LEU 62 Cb 0.00 -0.04 -0.05 0.00 -0.73 0.00 0.00 40.66 39.84 3dkl h LEU 62 CO 0.00 0.22 0.50 -0.61 -0.62 0.00 0.00 178.44 177.93 3dkl h GLN 63 N 0.41 0.63 0.09 1.25 4.15 -1.96 0.30 115.11 119.97 3dkl h GLN 63 Ca 0.16 -0.04 0.02 0.00 0.77 0.00 0.00 58.65 59.56 3dkl h GLN 63 Cb 0.06 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.58 3dkl h GLN 63 CO -0.11 0.41 -0.21 -0.92 -1.93 0.00 0.00 178.83 176.08 3dkl h TYR 64 N 0.64 -0.54 -0.51 3.99 3.20 -1.80 -2.61 116.97 119.35 3dkl h TYR 64 Ca 0.36 0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.21 3dkl h TYR 64 Cb 0.53 0.23 -0.02 0.00 1.54 0.00 0.00 36.73 39.01 3dkl h TYR 64 CO -0.00 -0.30 0.20 0.82 -1.64 0.00 0.00 178.16 177.24 3dkl h ILE 65 N -0.38 1.21 -0.36 1.81 2.04 -0.94 0.09 117.51 120.99 3dkl h ILE 65 Ca 0.03 -0.66 0.07 0.00 1.00 0.00 0.00 64.86 65.30 3dkl h ILE 65 Cb 0.41 0.70 -0.06 0.00 -0.74 0.00 0.00 36.82 37.13 3dkl h ILE 65 CO -0.13 0.25 -0.04 -0.07 0.00 0.00 0.00 178.15 178.16 3dkl h LEU 66 N 0.68 -0.24 -0.02 1.44 3.38 -1.05 -1.65 115.31 117.86 3dkl h LEU 66 Ca 0.17 0.09 -0.10 0.00 0.09 0.00 0.00 57.88 58.14 3dkl h LEU 66 Cb 0.19 0.18 0.01 0.00 0.09 0.00 0.00 40.66 41.14 3dkl h LEU 66 CO -0.01 -0.08 -0.37 0.78 0.09 0.00 0.00 178.44 178.85 3dkl h ASN 67 N 0.05 0.35 -0.52 -0.43 2.35 -1.33 -0.98 115.58 115.08 3dkl h ASN 67 Ca 0.17 -0.74 -0.07 0.00 -0.55 0.00 0.00 56.30 55.11 3dkl h ASN 67 Cb 0.25 -0.11 -0.02 0.00 0.05 0.00 0.00 38.32 38.49 3dkl h ASN 67 CO -0.33 1.05 0.06 0.50 -1.65 0.00 0.00 177.43 177.05 3dkl h LYS 68 N -0.30 0.93 0.00 0.81 3.64 -0.92 -3.40 116.57 117.32 3dkl h LYS 68 Ca -0.04 -0.24 0.00 0.00 -1.27 0.00 0.00 60.65 59.09 3dkl h LYS 68 Cb 1.09 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.80 3dkl h LYS 68 CO 0.07 0.88 -0.64 0.66 -2.27 0.00 0.00 179.45 178.16 3dkl n TYR 69 N -4.22 0.00 -0.02 1.91 0.53 -0.63 -4.89 117.16 109.84 3dkl n TYR 69 Ca 0.03 0.00 0.03 0.00 -1.02 0.00 0.00 57.90 56.94 3dkl n TYR 69 Cb 0.29 0.00 -0.08 0.00 -1.03 0.00 0.00 39.34 38.52 3dkl n TYR 69 CO 0.00 0.00 0.00 1.28 -1.02 0.00 0.00 176.86 177.12 3dkl n LEU 70 N -1.26 0.00 -4.88 7.72 4.77 -0.95 -4.89 117.00 117.50 3dkl n LEU 70 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.67 3dkl n LEU 70 Cb 0.20 0.06 -0.05 0.00 -2.33 0.00 0.00 43.42 41.30 3dkl n LEU 70 CO 0.00 0.06 0.25 -1.59 -1.33 0.00 0.00 177.39 174.79 3dkl s LYS 71 N -2.63 3.77 1.75 3.23 -2.85 -0.41 -4.66 119.74 117.93 3dkl s LYS 71 Ca -0.04 0.25 0.00 0.00 -1.00 0.00 0.00 55.97 55.18 3dkl s LYS 71 Cb 0.06 -2.60 0.00 0.00 -2.06 0.00 0.00 37.83 33.23 3dkl s LYS 71 CO 0.45 0.24 0.00 0.41 0.10 0.00 0.00 175.35 176.54 3dkl n GLY 72 N -0.51 -1.36 3.56 0.59 0.00 0.24 -4.65 105.19 103.06 3dkl n GLY 72 Ca 0.00 -1.41 -0.41 0.00 0.00 0.00 0.00 46.02 44.20 3dkl n GLY 72 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dkl s LYS 73 N 0.00 3.23 0.00 1.61 2.20 -1.26 -4.08 119.74 121.43 3dkl s LYS 73 Ca 0.00 -0.12 0.15 0.00 -0.36 0.00 0.00 55.97 55.65 3dkl s LYS 73 Cb 0.00 -4.16 0.05 0.00 -1.51 0.00 0.00 37.83 32.21 3dkl s LYS 73 CO 0.00 -2.09 0.89 1.33 -0.36 0.00 0.00 175.35 175.13 3dkl n VAL 74 N 6.46 0.00 -5.19 4.02 0.24 0.79 -4.89 118.33 119.77 3dkl n VAL 74 Ca 0.05 -0.40 -0.31 0.00 -2.04 0.00 0.00 64.34 61.63 3dkl n VAL 74 Cb 0.49 1.24 -0.17 0.00 -1.47 0.00 0.00 33.84 33.93 3dkl n VAL 74 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3dkl s VAL 75 N -1.62 2.00 0.10 3.34 1.01 -1.00 -4.50 120.40 119.72 3dkl s VAL 75 Ca 0.15 -0.99 0.03 0.00 0.00 0.00 0.00 61.98 61.16 3dkl s VAL 75 Cb 0.13 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.74 3dkl s VAL 75 CO 0.31 0.55 -0.08 0.42 0.00 0.00 0.00 175.10 176.30 3dkl s THR 76 N 0.26 0.83 0.29 3.92 -4.23 -1.26 -4.41 115.64 111.04 3dkl s THR 76 Ca -0.16 -1.85 0.03 0.00 -1.18 0.00 0.00 61.69 58.53 3dkl s THR 76 Cb -0.17 -1.58 0.30 0.00 1.34 0.00 0.00 72.50 72.38 3dkl s THR 76 CO 0.08 -0.76 1.67 0.50 -0.54 0.00 0.00 174.62 175.57 3dkl h LYS 77 N 3.14 0.28 -0.44 3.99 1.63 -2.00 -0.96 116.57 122.21 3dkl h LYS 77 Ca -0.36 -0.02 -0.14 0.00 -0.85 0.00 0.00 60.65 59.28 3dkl h LYS 77 Cb 1.18 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 32.73 3dkl h LYS 77 CO 0.61 0.18 -0.27 0.93 -3.45 0.00 0.00 179.45 177.45 3dkl h GLU 78 N 0.29 0.97 -0.41 1.90 3.07 -1.99 -1.56 114.58 116.84 3dkl h GLU 78 Ca 0.55 -0.45 -0.11 0.00 -0.50 0.00 0.00 59.36 58.86 3dkl h GLU 78 Cb 1.08 -0.01 -0.02 0.00 -0.84 0.00 0.00 28.75 28.96 3dkl h GLU 78 CO -0.59 1.11 -0.18 0.87 -1.40 0.00 0.00 179.01 178.83 3dkl h LYS 79 N 0.81 0.77 0.08 2.33 1.57 -1.77 -0.57 116.57 119.79 3dkl h LYS 79 Ca 0.09 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 3dkl h LYS 79 Cb 0.86 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.12 3dkl h LYS 79 CO 0.08 0.89 -0.04 0.82 -0.57 0.00 0.00 179.45 180.63 3dkl h ILE 80 N 0.68 0.99 -0.25 1.86 2.04 -1.13 -1.12 117.51 120.59 3dkl h ILE 80 Ca 0.10 -0.24 0.05 0.00 1.00 0.00 0.00 64.86 65.77 3dkl h ILE 80 Cb 0.67 1.15 -0.05 0.00 -0.74 0.00 0.00 36.82 37.86 3dkl h ILE 80 CO 0.05 0.06 -0.05 -0.61 0.00 0.00 0.00 178.15 177.60 3dkl h GLN 81 N -0.21 0.02 -0.64 2.37 5.75 -1.13 0.25 115.11 121.52 3dkl h GLN 81 Ca -0.01 -0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 58.44 3dkl h GLN 81 Cb 0.18 -0.00 -0.03 0.00 1.07 0.00 0.00 27.48 28.70 3dkl h GLN 81 CO 0.02 0.01 0.23 1.49 -2.65 0.00 0.00 178.83 177.93 3dkl h GLU 82 N 0.02 0.98 -0.40 1.69 4.57 -1.04 -0.37 114.58 120.03 3dkl h GLU 82 Ca 0.12 -0.19 -0.00 0.00 -1.18 0.00 0.00 59.36 58.11 3dkl h GLU 82 Cb 0.18 -0.15 -0.02 0.00 -0.16 0.00 0.00 28.75 28.60 3dkl h GLU 82 CO -0.25 0.84 0.25 0.00 -1.18 0.00 0.00 179.01 178.67 3dkl h ALA 83 N 1.09 0.51 -0.48 2.92 0.00 -1.08 -1.08 119.26 121.15 3dkl h ALA 83 Ca 0.21 -0.05 0.09 0.00 0.00 0.00 0.00 54.91 55.16 3dkl h ALA 83 Cb 0.25 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 17.81 3dkl h ALA 83 CO -0.01 -0.01 0.05 -0.22 0.00 0.00 0.00 179.25 179.06 3dkl h LYS 84 N 0.53 0.16 -0.50 0.00 3.64 -0.45 -0.63 116.57 119.33 3dkl h LYS 84 Ca 0.14 -0.01 -0.07 0.00 -1.27 0.00 0.00 60.65 59.44 3dkl h LYS 84 Cb -0.02 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 3dkl h LYS 84 CO -0.03 0.11 0.02 -0.44 -2.27 0.00 0.00 179.45 176.84 3dkl h ASP 85 N 0.17 0.84 -0.12 4.20 3.32 -0.71 -2.65 116.42 121.47 3dkl h ASP 85 Ca 0.24 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 56.99 3dkl h ASP 85 Cb 0.34 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 3dkl h ASP 85 CO -0.36 0.93 0.06 0.58 -1.72 0.00 0.00 179.24 178.74 3dkl h VAL 86 N 0.73 1.11 0.00 -1.35 2.07 -0.93 -3.18 116.25 114.70 3dkl h VAL 86 Ca 0.14 -0.30 -0.10 0.00 0.82 0.00 0.00 66.70 67.26 3dkl h VAL 86 Cb 0.49 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 3dkl h VAL 86 CO 0.02 0.10 -0.46 1.88 0.02 0.00 0.00 177.57 179.13 3dkl h TYR 87 N 0.08 0.00 -0.59 1.57 0.99 -1.06 0.40 116.97 118.37 3dkl h TYR 87 Ca 0.04 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.76 3dkl h TYR 87 Cb 0.10 0.00 -0.03 0.00 1.00 0.00 0.00 36.73 37.80 3dkl h TYR 87 CO -0.04 0.46 0.33 -0.22 -0.00 0.00 0.00 178.16 178.70 3dkl h LYS 88 N 0.00 0.81 0.09 4.88 3.64 -1.51 0.12 116.57 124.61 3dkl h LYS 88 Ca -0.00 -0.09 -0.27 0.00 -1.27 0.00 0.00 60.65 59.01 3dkl h LYS 88 Cb 0.88 -0.16 0.01 0.00 -0.41 0.00 0.00 32.23 32.55 3dkl h LYS 88 CO 0.06 0.62 -1.16 0.93 -2.27 0.00 0.00 179.45 177.62 3dkl h GLU 89 N 0.79 0.46 -0.34 1.90 4.39 -1.42 0.45 114.58 120.81 3dkl h GLU 89 Ca 0.21 -0.62 -0.10 0.00 0.34 0.00 0.00 59.36 59.19 3dkl h GLU 89 Cb 0.03 0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 3dkl h GLU 89 CO -0.03 1.25 -0.18 1.25 -1.16 0.00 0.00 179.01 180.14 3dkl h HIS 90 N 0.20 0.84 0.00 4.33 2.76 -0.68 -3.19 115.15 119.42 3dkl h HIS 90 Ca -0.14 -0.21 0.00 0.00 -2.20 0.00 0.00 60.37 57.81 3dkl h HIS 90 Cb 1.84 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 30.60 3dkl h HIS 90 CO 0.08 0.94 -1.02 1.19 -1.30 0.00 0.00 177.93 177.82 3dkl n PHE 91 N -4.31 0.66 -3.48 5.26 3.01 0.40 -4.97 117.46 114.02 3dkl n PHE 91 Ca -0.02 0.19 -0.21 0.00 1.01 0.00 0.00 57.45 58.41 3dkl n PHE 91 Cb 0.41 -0.75 0.07 0.00 -0.01 0.00 0.00 39.48 39.20 3dkl n PHE 91 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 3dkl n GLN 92 N -2.38 -7.16 0.00 -1.08 1.13 0.10 -4.93 117.38 103.06 3dkl n GLN 92 Ca 0.01 0.75 0.00 0.00 -1.94 0.00 0.00 57.00 55.82 3dkl n GLN 92 Cb 0.51 -5.56 0.00 0.00 0.11 0.00 0.00 30.24 25.30 3dkl n GLN 92 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 3dkl n ASP 93 N -2.60 0.00 -0.75 1.08 2.03 -0.91 -5.04 116.55 110.35 3dkl n ASP 93 Ca -0.01 0.00 0.02 0.00 0.52 0.00 0.00 54.79 55.32 3dkl n ASP 93 Cb 0.56 0.00 0.10 0.00 -0.72 0.00 0.00 41.12 41.06 3dkl n ASP 93 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 3dkl n ASP 94 N 0.00 1.97 0.24 1.67 8.00 -1.26 -4.11 116.55 123.06 3dkl n ASP 94 Ca 0.00 -2.19 0.16 0.00 0.71 0.00 0.00 54.79 53.47 3dkl n ASP 94 Cb 0.00 -0.46 0.70 0.00 -0.02 0.00 0.00 41.12 41.33 3dkl n ASP 94 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 3dkl h VAL 95 N 1.03 0.10 -2.00 2.53 2.07 -1.96 -3.45 116.25 114.58 3dkl h VAL 95 Ca 0.00 0.00 -0.63 0.00 0.82 0.00 0.00 66.70 66.89 3dkl h VAL 95 Cb 0.75 0.56 0.05 0.00 -1.52 0.00 0.00 31.29 31.13 3dkl h VAL 95 CO 0.10 0.00 0.77 0.33 0.02 0.00 0.00 177.57 178.79 3dkl n PHE 96 N -3.09 2.06 -0.90 1.57 7.35 -1.26 -4.83 117.46 118.35 3dkl n PHE 96 Ca 0.02 0.35 -0.28 0.00 -0.76 0.00 0.00 57.45 56.78 3dkl n PHE 96 Cb 0.56 -2.50 -0.02 0.00 0.35 0.00 0.00 39.48 37.87 3dkl n PHE 96 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 3dkl n ASN 97 N 3.94 5.18 -0.23 -2.13 5.15 -1.26 -4.74 115.26 121.17 3dkl n ASN 97 Ca 0.19 -2.41 0.02 0.00 -0.60 0.00 0.00 54.58 51.77 3dkl n ASN 97 Cb 0.25 -1.18 0.14 0.00 -0.53 0.00 0.00 39.78 38.45 3dkl n ASN 97 CO 0.00 0.00 0.00 -0.08 1.40 0.00 0.00 177.26 178.58 3dkl h GLU 98 N 6.29 0.50 -0.53 1.20 4.81 -1.94 -2.08 114.58 122.84 3dkl h GLU 98 Ca 0.54 -0.03 0.01 0.00 -0.13 0.00 0.00 59.36 59.76 3dkl h GLU 98 Cb 0.25 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.49 3dkl h GLU 98 CO 1.57 0.33 0.34 -0.22 -0.73 0.00 0.00 179.01 180.30 3dkl h LYS 99 N 0.52 0.68 -0.62 1.92 3.64 -1.99 0.03 116.57 120.74 3dkl h LYS 99 Ca 0.35 -0.04 0.01 0.00 -1.27 0.00 0.00 60.65 59.70 3dkl h LYS 99 Cb 0.41 -0.15 -0.03 0.00 -0.41 0.00 0.00 32.23 32.05 3dkl h LYS 99 CO -0.30 0.45 0.40 0.78 -2.27 0.00 0.00 179.45 178.51 3dkl h GLY 100 N 0.70 0.88 1.08 5.01 0.00 -1.79 -1.44 103.07 107.50 3dkl h GLY 100 Ca 0.20 -0.32 -0.16 0.00 0.00 0.00 0.00 47.33 47.06 3dkl h GLY 100 CO -0.06 0.30 -0.42 1.49 0.00 0.00 0.00 176.54 177.85 3dkl h TRP 101 N 0.82 1.02 -0.84 5.60 4.06 -1.12 -3.05 115.95 122.43 3dkl h TRP 101 Ca 0.23 -0.33 0.08 0.00 2.06 0.00 0.00 58.89 60.93 3dkl h TRP 101 Cb -0.06 -0.20 -0.06 0.00 -1.00 0.00 0.00 29.16 27.84 3dkl h TRP 101 CO -0.04 1.14 0.55 -0.91 -3.56 0.00 0.00 178.44 175.62 3dkl h ASN 102 N 0.61 0.78 -0.42 -3.49 4.21 -0.81 -1.81 115.58 114.64 3dkl h ASN 102 Ca 0.04 0.01 0.03 0.00 1.21 0.00 0.00 56.30 57.59 3dkl h ASN 102 Cb 1.01 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 38.03 3dkl h ASN 102 CO 0.10 0.48 0.23 0.22 -1.29 0.00 0.00 177.43 177.17 3dkl h TYR 103 N 0.87 0.42 -0.80 1.19 3.20 -1.16 -0.84 116.97 119.84 3dkl h TYR 103 Ca 0.37 0.02 -0.00 0.00 3.14 0.00 0.00 58.73 62.26 3dkl h TYR 103 Cb 0.32 -0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.42 3dkl h TYR 103 CO -0.00 0.23 0.49 0.82 -1.64 0.00 0.00 178.16 178.05 3dkl h ILE 104 N 0.46 1.22 -0.31 1.81 2.04 -1.30 -0.37 117.51 121.06 3dkl h ILE 104 Ca 0.18 -0.49 -0.01 0.00 1.00 0.00 0.00 64.86 65.54 3dkl h ILE 104 Cb 0.06 0.10 -0.01 0.00 -0.74 0.00 0.00 36.82 36.22 3dkl h ILE 104 CO -0.11 0.23 0.16 0.25 0.00 0.00 0.00 178.15 178.69 3dkl h LEU 105 N 1.10 0.39 -0.01 1.44 5.85 -1.03 -1.43 115.31 121.63 3dkl h LEU 105 Ca 0.29 -0.10 -0.25 0.00 0.84 0.00 0.00 57.88 58.65 3dkl h LEU 105 Cb -0.05 -0.10 0.01 0.00 0.37 0.00 0.00 40.66 40.89 3dkl h LEU 105 CO -0.05 0.38 -1.12 -0.33 -0.34 0.00 0.00 178.44 176.98 3dkl h GLU 106 N 0.37 0.35 0.07 1.25 5.08 -1.02 -1.78 114.58 118.91 3dkl h GLU 106 Ca 0.11 -0.48 -0.31 0.00 -1.00 0.00 0.00 59.36 57.68 3dkl h GLU 106 Cb 0.08 0.16 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 3dkl h GLU 106 CO -0.02 1.18 -1.71 -0.22 -1.00 0.00 0.00 179.01 177.24 3dkl h LYS 107 N 0.15 0.15 0.00 2.33 1.63 -1.14 -3.38 116.57 116.31 3dkl h LYS 107 Ca -0.12 -0.26 0.00 0.00 -0.85 0.00 0.00 60.65 59.43 3dkl h LYS 107 Cb 1.80 0.10 0.00 0.00 -0.60 0.00 0.00 32.23 33.53 3dkl h LYS 107 CO 0.19 0.90 -0.06 0.66 -3.45 0.00 0.00 179.45 177.69 3dkl n TYR 108 N -3.30 0.00 -3.97 1.91 4.02 -0.89 -4.97 117.16 109.96 3dkl n TYR 108 Ca -0.20 -0.76 -0.29 0.00 -0.01 0.00 0.00 57.90 56.63 3dkl n TYR 108 Cb 1.04 -0.12 0.00 0.00 -0.02 0.00 0.00 39.34 40.25 3dkl n TYR 108 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 3dkl n ASP 109 N -1.06 -2.91 -0.08 7.72 2.03 -0.68 -1.63 116.55 119.94 3dkl n ASP 109 Ca 0.11 -0.89 -0.01 0.00 0.52 0.00 0.00 54.79 54.51 3dkl n ASP 109 Cb 0.57 -3.44 -0.00 0.00 -0.72 0.00 0.00 41.12 37.52 3dkl n ASP 109 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3dkl n GLY 110 N -1.66 0.44 3.77 0.27 0.00 -0.59 -4.61 105.19 102.80 3dkl n GLY 110 Ca -0.08 -0.13 -0.39 0.00 0.00 0.00 0.00 46.02 45.42 3dkl n GLY 110 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3dkl s HIS 111 N -1.80 3.72 -0.10 1.61 3.76 -0.64 -0.15 115.29 121.69 3dkl s HIS 111 Ca 0.00 1.28 -0.30 0.00 -0.15 0.00 0.00 55.06 55.90 3dkl s HIS 111 Cb 0.00 -2.64 -0.04 0.00 1.11 0.00 0.00 32.58 31.01 3dkl s HIS 111 CO 0.00 0.38 1.47 -0.51 -0.85 0.00 0.00 174.74 175.23 3dkl s LEU 112 N -0.35 4.26 -1.09 0.89 1.43 -1.26 -4.77 118.68 117.79 3dkl s LEU 112 Ca 0.32 2.00 -0.19 0.00 -1.03 0.00 0.00 54.13 55.23 3dkl s LEU 112 Cb -0.19 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.43 3dkl s LEU 112 CO 0.19 -0.84 2.00 -0.81 0.23 0.00 0.00 176.35 177.11 3dkl n PRO 113 N 6.78 2.10 -4.01 1.29 -0.04 -1.26 -2.22 135.00 137.64 3dkl n PRO 113 Ca 0.16 -2.31 -0.15 0.00 -0.04 0.00 0.00 63.50 61.16 3dkl n PRO 113 Cb 0.44 -3.20 -0.15 0.00 -0.04 0.00 0.00 33.50 30.55 3dkl n PRO 113 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3dkl s ILE 114 N 5.22 0.22 -0.15 0.52 -1.09 -1.26 -0.40 121.20 124.27 3dkl s ILE 114 Ca 0.55 -0.07 -0.00 0.00 -2.23 0.00 0.00 60.65 58.90 3dkl s ILE 114 Cb 0.11 -0.23 -0.01 0.00 -1.58 0.00 0.00 42.46 40.75 3dkl s ILE 114 CO 0.06 0.09 -0.13 -0.70 -1.23 0.00 0.00 174.94 173.03 3dkl s GLU 115 N 0.22 3.33 -0.15 2.79 2.12 0.28 -1.38 118.70 125.91 3dkl s GLU 115 Ca -0.02 -0.70 0.01 0.00 0.36 0.00 0.00 54.97 54.62 3dkl s GLU 115 Cb -0.05 -2.67 -0.00 0.00 0.26 0.00 0.00 34.13 31.68 3dkl s GLU 115 CO -0.01 0.11 -0.16 0.42 -0.54 0.00 0.00 175.26 175.09 3dkl s ILE 116 N 0.61 2.62 -0.10 -3.70 1.01 -0.32 -1.19 121.20 120.13 3dkl s ILE 116 Ca -0.08 -0.79 0.01 0.00 0.00 0.00 0.00 60.65 59.79 3dkl s ILE 116 Cb -0.16 -2.10 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 3dkl s ILE 116 CO 0.03 0.52 -0.12 -0.54 0.00 0.00 0.00 174.94 174.83 3dkl s LYS 117 N 0.77 3.05 0.02 2.79 1.02 -0.80 -0.78 119.74 125.80 3dkl s LYS 117 Ca -0.06 -0.67 0.01 0.00 0.02 0.00 0.00 55.97 55.27 3dkl s LYS 117 Cb -0.15 -2.56 -0.02 0.00 -0.52 0.00 0.00 37.83 34.58 3dkl s LYS 117 CO 0.00 0.40 -0.04 0.00 -0.92 0.00 0.00 175.35 174.79 3dkl s ALA 118 N -0.12 0.26 0.46 5.17 0.00 0.41 -1.06 121.76 126.89 3dkl s ALA 118 Ca -0.01 -0.47 -0.25 0.00 0.00 0.00 0.00 51.96 51.23 3dkl s ALA 118 Cb -0.14 0.06 -0.08 0.00 0.00 0.00 0.00 23.12 22.97 3dkl s ALA 118 CO 0.03 -0.06 1.39 0.54 0.00 0.00 0.00 175.76 177.67 3dkl s VAL 119 N -0.97 2.17 0.34 0.00 0.11 -0.36 -1.27 120.40 120.42 3dkl s VAL 119 Ca -0.09 0.15 -0.28 0.00 -2.93 0.00 0.00 61.98 58.83 3dkl s VAL 119 Cb -0.07 -3.08 -0.12 0.00 -1.53 0.00 0.00 36.38 31.57 3dkl s VAL 119 CO -0.00 0.02 1.22 -2.65 -3.33 0.00 0.00 175.10 170.35 3dkl n PRO 120 N -0.31 1.91 -2.00 1.54 -0.02 -1.26 -4.91 135.00 129.95 3dkl n PRO 120 Ca 0.06 0.67 -0.41 0.00 -2.02 0.00 0.00 63.50 61.80 3dkl n PRO 120 Cb 0.43 -2.22 -0.02 0.00 -0.02 0.00 0.00 33.50 31.66 3dkl n PRO 120 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 3dkl s GLU 121 N -1.86 4.26 0.00 -0.52 2.02 -1.26 -2.01 118.70 119.33 3dkl s GLU 121 Ca 0.57 2.31 0.00 0.00 0.02 0.00 0.00 54.97 57.87 3dkl s GLU 121 Cb -0.59 -3.10 0.00 0.00 0.10 0.00 0.00 34.13 30.54 3dkl s GLU 121 CO 0.61 -0.43 0.00 0.41 0.02 0.00 0.00 175.26 175.87 3dkl n GLY 122 N 2.18 3.22 3.65 -1.39 0.00 0.13 -4.31 105.19 108.68 3dkl n GLY 122 Ca 0.07 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.64 3dkl n GLY 122 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3dkl n PHE 123 N -1.36 1.94 -3.63 1.61 3.01 -0.85 -2.74 117.46 115.43 3dkl n PHE 123 Ca 0.00 0.54 -0.39 0.00 1.01 0.00 0.00 57.45 58.60 3dkl n PHE 123 Cb 0.00 -2.39 -0.11 0.00 -0.01 0.00 0.00 39.48 36.96 3dkl n PHE 123 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 3dkl s VAL 124 N -0.49 4.64 -0.06 -4.37 1.01 -1.26 -1.59 120.40 118.27 3dkl s VAL 124 Ca 0.64 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 62.14 3dkl s VAL 124 Cb -0.66 -3.43 -0.00 0.00 0.00 0.00 0.00 36.38 32.29 3dkl s VAL 124 CO 0.55 -0.02 -0.20 -0.63 0.00 0.00 0.00 175.10 174.80 3dkl s ILE 125 N 1.60 1.70 0.62 2.22 -1.09 -0.37 -4.87 121.20 121.01 3dkl s ILE 125 Ca 0.04 -0.84 -0.19 0.00 -2.23 0.00 0.00 60.65 57.43 3dkl s ILE 125 Cb -0.18 -1.47 -0.02 0.00 -1.58 0.00 0.00 42.46 39.22 3dkl s ILE 125 CO 0.07 0.48 1.30 -2.84 -1.23 0.00 0.00 174.94 172.71 3dkl s PRO 126 N 0.17 2.73 0.48 2.79 0.02 -1.26 0.10 135.00 140.02 3dkl s PRO 126 Ca -0.09 2.07 -0.21 0.00 0.02 0.00 0.00 61.00 62.78 3dkl s PRO 126 Cb -0.14 -1.94 -0.10 0.00 0.02 0.00 0.00 34.50 32.33 3dkl s PRO 126 CO 0.05 -1.46 0.67 0.54 -0.33 0.00 0.00 177.00 176.46 3dkl n ARG 127 N -1.68 0.74 -0.75 5.54 5.12 -0.12 -3.64 116.66 121.87 3dkl n ARG 127 Ca 0.14 0.27 0.00 0.00 -1.93 0.00 0.00 57.85 56.34 3dkl n ARG 127 Cb 0.48 -1.72 0.00 0.00 -1.16 0.00 0.00 32.46 30.05 3dkl n ARG 127 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3dkl n GLY 128 N 1.62 0.55 3.61 -0.13 0.00 0.16 -4.77 105.19 106.23 3dkl n GLY 128 Ca 0.11 -0.70 -0.28 0.00 0.00 0.00 0.00 46.02 45.15 3dkl n GLY 128 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dkl s ASN 129 N -2.64 4.50 0.13 1.61 0.01 -1.24 -4.86 114.94 112.45 3dkl s ASN 129 Ca 0.00 -0.44 -0.31 0.00 -0.71 0.00 0.00 52.86 51.40 3dkl s ASN 129 Cb 0.00 -0.87 -0.10 0.00 0.41 0.00 0.00 41.25 40.69 3dkl s ASN 129 CO 0.00 0.13 1.61 0.54 -1.51 0.00 0.00 177.10 177.87 3dkl s VAL 130 N -1.53 2.73 -0.17 1.60 0.11 -1.26 -4.32 120.40 117.56 3dkl s VAL 130 Ca 0.25 0.43 0.12 0.00 -2.93 0.00 0.00 61.98 59.85 3dkl s VAL 130 Cb -0.10 -3.27 -0.19 0.00 -1.53 0.00 0.00 36.38 31.28 3dkl s VAL 130 CO 0.16 0.02 0.01 0.18 -3.33 0.00 0.00 175.10 172.14 3dkl n LEU 131 N 4.57 0.57 -3.52 2.54 4.77 -0.50 -4.86 117.00 120.57 3dkl n LEU 131 Ca 0.15 -0.02 -0.17 0.00 -0.03 0.00 0.00 56.01 55.94 3dkl n LEU 131 Cb 0.39 0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.61 3dkl n LEU 131 CO 0.62 0.50 0.41 0.72 -1.33 0.00 0.00 177.39 178.30 3dkl s PHE 132 N -2.41 -0.61 0.14 -1.77 -0.12 -1.24 -1.23 117.98 110.74 3dkl s PHE 132 Ca -0.12 0.94 0.09 0.00 -0.05 0.00 0.00 56.93 57.78 3dkl s PHE 132 Cb 0.05 0.42 -0.04 0.00 -0.63 0.00 0.00 43.02 42.82 3dkl s PHE 132 CO 0.64 -0.64 -0.21 0.95 -0.05 0.00 0.00 175.22 175.92 3dkl s THR 133 N -1.66 1.87 -0.04 -4.49 -4.23 -0.22 -0.98 115.64 105.89 3dkl s THR 133 Ca -0.09 -1.74 0.02 0.00 -1.18 0.00 0.00 61.69 58.70 3dkl s THR 133 Cb -0.00 -1.75 0.01 0.00 1.34 0.00 0.00 72.50 72.09 3dkl s THR 133 CO 0.06 -0.14 -0.08 -0.69 -0.54 0.00 0.00 174.62 173.23 3dkl s VAL 134 N -1.50 0.73 0.09 2.29 1.01 0.22 -1.90 120.40 121.34 3dkl s VAL 134 Ca 0.12 -0.28 -0.07 0.00 0.00 0.00 0.00 61.98 61.75 3dkl s VAL 134 Cb -0.08 -0.69 -0.01 0.00 0.00 0.00 0.00 36.38 35.59 3dkl s VAL 134 CO 0.06 0.25 0.15 -1.83 0.00 0.00 0.00 175.10 173.73 3dkl s GLU 135 N 0.57 0.85 0.22 2.72 -1.05 -0.33 -0.96 118.70 120.71 3dkl s GLU 135 Ca -0.09 -1.08 -0.23 0.00 -0.15 0.00 0.00 54.97 53.43 3dkl s GLU 135 Cb -0.12 0.31 -0.08 0.00 -0.44 0.00 0.00 34.13 33.80 3dkl s GLU 135 CO 0.01 -0.26 0.78 0.54 0.95 0.00 0.00 175.26 177.29 3dkl s ASN 136 N -2.90 7.23 0.00 0.83 4.22 -1.24 -0.56 114.94 122.52 3dkl s ASN 136 Ca 0.08 1.58 0.24 0.00 -2.14 0.00 0.00 52.86 52.62 3dkl s ASN 136 Cb 0.05 -2.48 0.17 0.00 1.28 0.00 0.00 41.25 40.28 3dkl s ASN 136 CO -0.08 0.08 1.23 0.35 -2.04 0.00 0.00 177.10 176.63 3dkl n THR 137 N 1.01 0.00 -4.41 0.54 -2.24 0.46 -4.83 114.28 104.81 3dkl n THR 137 Ca -0.03 -0.38 -0.24 0.00 -2.27 0.00 0.00 64.05 61.13 3dkl n THR 137 Cb 0.50 1.33 -0.17 0.00 -2.10 0.00 0.00 70.33 69.89 3dkl n THR 137 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dkl s ASP 138 N -2.20 1.62 0.54 3.42 3.68 -1.26 -5.02 116.67 117.45 3dkl s ASP 138 Ca 0.25 -0.26 0.25 0.00 2.13 0.00 0.00 52.55 54.92 3dkl s ASP 138 Cb 0.19 -0.74 1.43 0.00 -1.45 0.00 0.00 42.92 42.36 3dkl s ASP 138 CO 0.41 -0.01 2.04 1.55 0.13 0.00 0.00 175.17 179.29 3dkl h PRO 139 N 7.16 0.00 0.00 4.34 0.13 -1.89 0.14 132.00 141.88 3dkl h PRO 139 Ca -0.32 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.78 3dkl h PRO 139 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 3dkl h PRO 139 CO 0.46 0.00 -0.12 0.93 -0.23 0.00 0.00 178.00 179.04 3dkl h GLU 140 N 0.00 0.00 -0.87 0.86 4.39 -1.90 -3.19 114.58 113.87 3dkl h GLU 140 Ca 0.18 0.00 -0.39 0.00 0.34 0.00 0.00 59.36 59.49 3dkl h GLU 140 Cb 0.76 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 29.18 3dkl h GLU 140 CO -0.00 0.12 0.48 0.00 -1.16 0.00 0.00 179.01 178.45 3dkl h TYR 142 N 1.66 0.07 0.00 0.00 -0.00 -1.67 -0.28 116.97 116.76 3dkl h TYR 142 Ca 0.48 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.21 3dkl h TYR 142 Cb 2.62 -0.02 0.00 0.00 0.00 0.00 0.00 36.73 39.33 3dkl h TYR 142 CO 1.46 0.03 0.00 0.11 -0.00 0.00 0.00 178.16 179.76 3dkl h TRP 143 N 0.07 0.00 -0.00 0.10 5.08 -1.90 -3.33 115.95 115.97 3dkl h TRP 143 Ca 0.17 0.00 -0.18 0.00 1.08 0.00 0.00 58.89 59.96 3dkl h TRP 143 Cb 0.60 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.74 3dkl h TRP 143 CO -0.00 0.00 -0.82 1.25 -1.28 0.00 0.00 178.44 177.59 3dkl h LEU 144 N 0.00 0.15 -0.39 0.11 5.85 -1.40 -2.82 115.31 116.81 3dkl h LEU 144 Ca 0.00 -0.12 0.08 0.00 0.84 0.00 0.00 57.88 58.68 3dkl h LEU 144 Cb 0.71 -0.04 -0.07 0.00 0.37 0.00 0.00 40.66 41.62 3dkl h LEU 144 CO 0.00 0.90 -0.10 0.74 -0.34 0.00 0.00 178.44 179.64 3dkl h THR 145 N 0.07 0.60 0.00 1.05 2.02 -1.70 -2.40 112.91 112.55 3dkl h THR 145 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.15 3dkl h THR 145 Cb 1.43 0.60 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 3dkl h THR 145 CO 0.12 0.00 -0.94 0.59 0.37 0.00 0.00 175.52 175.66 3dkl n ASN 146 N -5.31 0.64 -0.27 4.18 4.13 -1.25 -3.44 115.26 113.95 3dkl n ASN 146 Ca 0.02 -0.05 0.07 0.00 1.68 0.00 0.00 54.58 56.30 3dkl n ASN 146 Cb 0.22 0.62 0.20 0.00 -1.54 0.00 0.00 39.78 39.27 3dkl n ASN 146 CO 0.00 0.00 0.00 -0.25 0.28 0.00 0.00 177.26 177.29 3dkl h TRP 147 N 0.00 0.09 -0.43 3.10 2.91 -1.16 -1.77 115.95 118.70 3dkl h TRP 147 Ca 0.00 0.05 0.00 0.00 1.13 0.00 0.00 58.89 60.07 3dkl h TRP 147 Cb 0.77 0.08 0.00 0.00 -0.51 0.00 0.00 29.16 29.50 3dkl h TRP 147 CO 0.00 -0.22 0.00 0.44 -1.03 0.00 0.00 178.44 177.63 3dkl n ILE 148 N -5.29 0.62 -0.23 2.65 -5.35 -1.11 -4.05 119.36 106.59 3dkl n ILE 148 Ca 0.16 -0.58 0.02 0.00 -0.27 0.00 0.00 62.75 62.07 3dkl n ILE 148 Cb 0.53 0.26 0.14 0.00 -1.74 0.00 0.00 39.64 38.83 3dkl n ILE 148 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3dkl h GLU 149 N 2.50 0.46 -0.11 6.28 4.81 -1.42 -2.61 114.58 124.49 3dkl h GLU 149 Ca 0.00 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.20 3dkl h GLU 149 Cb 0.61 -0.10 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 3dkl h GLU 149 CO 0.01 0.30 0.06 1.15 -0.73 0.00 0.00 179.01 179.81 3dkl h THR 150 N 0.47 1.08 -0.35 0.32 2.02 -1.78 -0.13 112.91 114.54 3dkl h THR 150 Ca 0.35 -0.23 -0.13 0.00 0.77 0.00 0.00 66.41 67.17 3dkl h THR 150 Cb 0.45 1.04 -0.01 0.00 -1.74 0.00 0.00 68.15 67.89 3dkl h THR 150 CO -0.33 0.08 -0.30 -0.29 0.37 0.00 0.00 175.52 175.05 3dkl h ILE 151 N 0.08 1.28 -0.13 3.11 2.10 -1.76 -3.14 117.51 119.05 3dkl h ILE 151 Ca 0.04 -1.44 -0.21 0.00 1.08 0.00 0.00 64.86 64.33 3dkl h ILE 151 Cb 0.07 1.33 0.01 0.00 -1.09 0.00 0.00 36.82 37.14 3dkl h ILE 151 CO -0.01 0.47 -0.73 -0.07 -1.08 0.00 0.00 178.15 176.73 3dkl h LEU 152 N 0.63 0.88 -2.12 2.19 3.38 -1.28 -3.18 115.31 115.82 3dkl h LEU 152 Ca 0.07 -0.64 0.02 0.00 0.09 0.00 0.00 57.88 57.43 3dkl h LEU 152 Cb 0.82 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.31 3dkl h LEU 152 CO 0.07 1.38 0.07 0.58 0.09 0.00 0.00 178.44 180.62 3dkl h VAL 153 N 0.44 0.82 0.00 1.22 2.07 -0.99 -0.13 116.25 119.69 3dkl h VAL 153 Ca -0.05 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.47 3dkl h VAL 153 Cb 1.37 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 32.09 3dkl h VAL 153 CO 0.15 0.00 0.06 0.00 0.02 0.00 0.00 177.57 177.80 3dkl n GLN 154 N -4.31 0.09 0.27 1.57 6.02 -1.19 0.05 117.38 119.87 3dkl n GLN 154 Ca -0.01 0.57 0.15 0.00 -0.01 0.00 0.00 57.00 57.70 3dkl n GLN 154 Cb 0.18 -1.86 0.79 0.00 1.02 0.00 0.00 30.24 30.37 3dkl n GLN 154 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 3dkl h SER 155 N 0.00 0.00 -0.66 1.08 4.64 -1.19 -2.19 113.55 115.23 3dkl h SER 155 Ca 0.00 0.00 0.14 0.00 -0.47 0.00 0.00 61.79 61.46 3dkl h SER 155 Cb 0.13 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.18 3dkl h SER 155 CO 0.00 0.00 0.45 4.11 -0.87 0.00 0.00 176.83 180.52 3dkl h TRP 156 N 0.00 0.37 0.32 4.77 5.08 -0.62 -2.36 115.95 123.51 3dkl h TRP 156 Ca 0.00 0.01 -0.02 0.00 1.08 0.00 0.00 58.89 59.96 3dkl h TRP 156 Cb 0.32 -0.12 0.00 0.00 -3.00 0.00 0.00 29.16 26.36 3dkl h TRP 156 CO 0.00 0.15 -0.16 -0.92 -1.28 0.00 0.00 178.44 176.24 3dkl h TYR 157 N 0.32 -0.40 -0.27 0.12 3.20 -1.63 -0.53 116.97 117.79 3dkl h TYR 157 Ca 0.32 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.18 3dkl h TYR 157 Cb 0.80 0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.19 3dkl h TYR 157 CO -0.00 -0.19 0.16 -1.00 -1.64 0.00 0.00 178.16 175.49 3dkl h PRO 158 N -1.09 0.35 -0.22 1.82 0.13 -1.74 -1.29 132.00 129.96 3dkl h PRO 158 Ca -0.04 -0.02 0.04 0.00 -0.87 0.00 0.00 66.00 65.10 3dkl h PRO 158 Cb 0.39 -0.08 -0.03 0.00 0.13 0.00 0.00 31.00 31.41 3dkl h PRO 158 CO 0.07 0.24 0.00 0.82 -0.23 0.00 0.00 178.00 178.91 3dkl h ILE 159 N 0.36 0.84 -0.19 -3.56 2.04 -1.36 -1.40 117.51 114.25 3dkl h ILE 159 Ca 0.10 -0.02 -0.14 0.00 1.00 0.00 0.00 64.86 65.80 3dkl h ILE 159 Cb -0.02 0.77 0.00 0.00 -0.74 0.00 0.00 36.82 36.83 3dkl h ILE 159 CO -0.02 0.01 -0.42 0.74 0.00 0.00 0.00 178.15 178.47 3dkl h THR 160 N 0.07 1.33 0.03 -0.27 2.02 -0.61 0.47 112.91 115.94 3dkl h THR 160 Ca 0.10 -1.66 -0.00 0.00 0.77 0.00 0.00 66.41 65.63 3dkl h THR 160 Cb 0.13 1.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 3dkl h THR 160 CO -0.18 0.51 -0.01 0.58 0.37 0.00 0.00 175.52 176.79 3dkl h VAL 161 N 0.29 0.97 -0.59 3.16 2.07 -1.28 0.19 116.25 121.06 3dkl h VAL 161 Ca 0.00 -0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.60 3dkl h VAL 161 Cb 1.02 0.97 -0.07 0.00 -1.52 0.00 0.00 31.29 31.70 3dkl h VAL 161 CO 0.09 0.00 0.23 0.00 0.02 0.00 0.00 177.57 177.91 3dkl h ALA 162 N 0.93 0.76 0.16 1.67 0.00 -1.15 -0.66 119.26 120.96 3dkl h ALA 162 Ca -0.00 0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.97 3dkl h ALA 162 Cb 0.03 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.87 3dkl h ALA 162 CO 0.01 -0.18 -0.07 1.15 0.00 0.00 0.00 179.25 180.15 3dkl h THR 163 N 0.41 0.98 -0.32 0.00 2.02 -0.73 -1.57 112.91 113.70 3dkl h THR 163 Ca 0.29 -0.80 -0.05 0.00 0.77 0.00 0.00 66.41 66.63 3dkl h THR 163 Cb 0.34 1.46 -0.02 0.00 -1.74 0.00 0.00 68.15 68.20 3dkl h THR 163 CO -0.29 0.18 -0.01 -1.13 0.37 0.00 0.00 175.52 174.64 3dkl h ASN 164 N -0.61 0.47 -0.52 4.18 -1.24 -0.59 -0.49 115.58 116.78 3dkl h ASN 164 Ca -0.02 -0.09 -0.10 0.00 0.71 0.00 0.00 56.30 56.80 3dkl h ASN 164 Cb 0.46 -0.12 -0.02 0.00 0.73 0.00 0.00 38.32 39.37 3dkl h ASN 164 CO 0.04 0.55 -0.08 -1.28 -1.29 0.00 0.00 177.43 175.37 3dkl h SER 165 N 0.48 0.97 0.33 1.15 0.87 -1.07 -2.16 113.55 114.12 3dkl h SER 165 Ca 0.10 -0.34 -0.14 0.00 -1.23 0.00 0.00 61.79 60.18 3dkl h SER 165 Cb 0.33 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.02 3dkl h SER 165 CO 0.01 1.08 -0.57 -0.09 -0.53 0.00 0.00 176.83 176.73 3dkl h ARG 166 N 0.84 0.26 -0.76 2.24 2.43 -0.88 -0.94 114.38 117.56 3dkl h ARG 166 Ca 0.14 -0.17 -0.04 0.00 -0.81 0.00 0.00 59.98 59.10 3dkl h ARG 166 Cb 0.63 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 3dkl h ARG 166 CO 0.04 0.76 0.32 0.93 -1.51 0.00 0.00 179.97 180.51 3dkl h GLU 167 N 0.19 1.13 -0.46 0.20 4.39 -0.95 -0.30 114.58 118.79 3dkl h GLU 167 Ca -0.00 -0.20 -0.06 0.00 0.34 0.00 0.00 59.36 59.44 3dkl h GLU 167 Cb 1.06 -0.19 -0.02 0.00 -0.10 0.00 0.00 28.75 29.50 3dkl h GLU 167 CO 0.09 0.91 0.04 1.96 -1.16 0.00 0.00 179.01 180.85 3dkl h GLN 168 N 1.10 0.74 -0.97 2.33 4.20 -0.95 -2.44 115.11 119.11 3dkl h GLN 168 Ca 0.26 -0.18 0.03 0.00 0.06 0.00 0.00 58.65 58.82 3dkl h GLN 168 Cb 0.19 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 27.82 3dkl h GLN 168 CO -0.02 0.73 0.64 -0.22 -0.67 0.00 0.00 178.83 179.28 3dkl h LYS 169 N 0.70 1.21 -0.21 1.46 3.64 -0.57 -1.22 116.57 121.59 3dkl h LYS 169 Ca 0.15 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.45 3dkl h LYS 169 Cb 0.38 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 3dkl h LYS 169 CO 0.01 0.80 0.10 0.87 -2.27 0.00 0.00 179.45 178.97 3dkl h LYS 170 N 1.25 0.30 -0.13 1.90 1.57 -0.60 0.29 116.57 121.15 3dkl h LYS 170 Ca 0.38 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 59.15 3dkl h LYS 170 Cb -0.03 -0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.19 3dkl h LYS 170 CO -0.11 0.32 -0.08 0.82 -0.57 0.00 0.00 179.45 179.83 3dkl h ILE 171 N 0.21 0.75 -0.33 1.86 2.04 -1.35 -1.53 117.51 119.17 3dkl h ILE 171 Ca 0.07 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.94 3dkl h ILE 171 Cb 0.11 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 36.93 3dkl h ILE 171 CO -0.01 0.00 0.22 -0.07 0.00 0.00 0.00 178.15 178.29 3dkl h LEU 172 N -0.08 0.38 -0.43 1.44 3.38 -0.98 -2.18 115.31 116.84 3dkl h LEU 172 Ca 0.08 -0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.07 3dkl h LEU 172 Cb 0.20 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.82 3dkl h LEU 172 CO -0.18 0.28 0.22 0.00 0.09 0.00 0.00 178.44 178.84 3dkl h ALA 173 N 1.12 0.54 0.56 1.53 0.00 -0.30 -0.43 119.26 122.27 3dkl h ALA 173 Ca 0.12 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3dkl h ALA 173 Cb -0.05 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.67 3dkl h ALA 173 CO -0.03 -0.14 -0.32 -0.22 0.00 0.00 0.00 179.25 178.55 3dkl h LYS 174 N 0.44 -0.79 -0.29 0.00 3.64 -0.90 -0.21 116.57 118.45 3dkl h LYS 174 Ca 0.18 0.05 -0.12 0.00 -1.27 0.00 0.00 60.65 59.50 3dkl h LYS 174 Cb 0.09 0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 32.08 3dkl h LYS 174 CO -0.13 -0.53 -0.31 1.88 -2.27 0.00 0.00 179.45 178.10 3dkl h TYR 175 N -0.82 0.72 -0.57 1.91 -1.99 -1.37 -2.10 116.97 112.74 3dkl h TYR 175 Ca -0.07 -0.18 -0.04 0.00 2.00 0.00 0.00 58.73 60.45 3dkl h TYR 175 Cb 0.66 -0.16 -0.02 0.00 2.00 0.00 0.00 36.73 39.20 3dkl h TYR 175 CO -0.08 0.86 0.21 1.25 -0.00 0.00 0.00 178.16 180.40 3dkl h LEU 176 N 0.53 0.80 -0.42 3.88 5.85 -1.00 -0.87 115.31 124.08 3dkl h LEU 176 Ca 0.06 -0.18 -0.04 0.00 0.84 0.00 0.00 57.88 58.56 3dkl h LEU 176 Cb 0.80 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.60 3dkl h LEU 176 CO 0.07 0.76 0.11 0.25 -0.34 0.00 0.00 178.44 179.29 3dkl h LEU 177 N 0.79 0.64 -0.21 2.25 5.85 -0.94 -0.18 115.31 123.50 3dkl h LEU 177 Ca 0.19 -0.23 -0.04 0.00 0.84 0.00 0.00 57.88 58.64 3dkl h LEU 177 Cb 0.22 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.08 3dkl h LEU 177 CO -0.01 0.70 -0.03 -0.08 -0.34 0.00 0.00 178.44 178.68 3dkl h GLU 178 N 0.55 0.40 0.00 1.25 4.81 -1.29 0.24 114.58 120.54 3dkl h GLU 178 Ca 0.13 -0.14 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 3dkl h GLU 178 Cb 0.31 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.66 3dkl h GLU 178 CO 0.00 0.62 -0.33 1.79 -0.73 0.00 0.00 179.01 180.36 3dkl h THR 179 N 0.14 0.00 0.00 0.32 1.35 -1.10 -3.40 112.91 110.22 3dkl h THR 179 Ca 0.06 -0.63 0.00 0.00 -0.55 0.00 0.00 66.41 65.29 3dkl h THR 179 Cb 0.46 1.43 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 3dkl h THR 179 CO 0.02 0.00 -0.42 -1.54 -0.25 0.00 0.00 175.52 173.33 3dkl n SER 180 N -2.40 2.08 0.00 5.36 3.41 -0.09 -4.56 113.62 117.42 3dkl n SER 180 Ca 0.04 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.62 3dkl n SER 180 Cb 0.46 0.48 0.00 0.00 -0.26 0.00 0.00 64.21 64.89 3dkl n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dkl n GLY 181 N 1.10 0.77 2.32 5.00 0.00 0.85 -4.86 105.19 110.37 3dkl n GLY 181 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 3dkl n GLY 181 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dkl n ASN 182 N 0.00 -1.08 -0.17 1.61 0.23 -1.26 -4.98 115.26 109.61 3dkl n ASN 182 Ca 0.00 -2.21 0.07 0.00 -0.53 0.00 0.00 54.58 51.90 3dkl n ASN 182 Cb 0.00 1.94 0.11 0.00 -2.08 0.00 0.00 39.78 39.75 3dkl n ASN 182 CO 0.00 0.00 0.00 0.18 -0.93 0.00 0.00 177.26 176.51 3dkl n LEU 183 N 0.00 2.44 -4.70 -4.53 4.32 -1.26 -3.53 117.00 109.74 3dkl n LEU 183 Ca -0.01 -2.68 -0.43 0.00 -0.02 0.00 0.00 56.01 52.86 3dkl n LEU 183 Cb 0.39 -0.30 -0.03 0.00 -1.62 0.00 0.00 43.42 41.86 3dkl n LEU 183 CO 0.19 0.64 1.34 0.47 -1.22 0.00 0.00 177.39 178.81 3dkl n ASP 184 N -0.94 3.75 0.00 -1.43 8.00 -1.26 -1.70 116.55 122.97 3dkl n ASP 184 Ca 0.11 1.06 0.00 0.00 0.71 0.00 0.00 54.79 56.67 3dkl n ASP 184 Cb 0.53 -1.53 0.00 0.00 -0.02 0.00 0.00 41.12 40.11 3dkl n ASP 184 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dkl n GLY 185 N 3.85 0.90 0.30 0.44 0.00 -1.26 -4.91 105.19 104.52 3dkl n GLY 185 Ca 0.17 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.29 3dkl n GLY 185 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dkl h LEU 186 N 0.00 0.26 0.00 0.99 5.85 -1.74 -0.30 115.31 120.37 3dkl h LEU 186 Ca 0.00 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.87 3dkl h LEU 186 Cb 0.00 0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.17 3dkl h LEU 186 CO 0.00 0.01 0.00 -0.62 -0.34 0.00 0.00 178.44 177.49 3dkl n GLU 187 N -5.06 0.23 -0.08 1.25 1.02 -1.26 -2.00 120.64 114.74 3dkl n GLU 187 Ca 0.20 0.13 0.03 0.00 -0.02 0.00 0.00 57.16 57.50 3dkl n GLU 187 Cb 0.58 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.57 3dkl n GLU 187 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3dkl n TYR 188 N -1.25 0.19 0.87 -0.32 4.02 -0.13 -0.65 117.16 119.89 3dkl n TYR 188 Ca 0.07 -0.54 0.13 0.00 -0.01 0.00 0.00 57.90 57.56 3dkl n TYR 188 Cb 0.11 -0.05 0.40 0.00 -0.02 0.00 0.00 39.34 39.77 3dkl n TYR 188 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 3dkl n LYS 189 N -0.18 0.09 -3.73 -0.72 4.76 -0.85 -4.60 118.16 112.93 3dkl n LYS 189 Ca 0.06 0.05 -0.28 0.00 -2.87 0.00 0.00 58.31 55.26 3dkl n LYS 189 Cb 0.35 -1.58 -0.16 0.00 -1.84 0.00 0.00 35.03 31.80 3dkl n LYS 189 CO 0.00 0.00 0.00 -1.17 -1.37 0.00 0.00 177.40 174.86 3dkl s LEU 190 N -3.44 1.38 -0.13 -0.35 2.96 -1.26 -0.74 118.68 117.11 3dkl s LEU 190 Ca 0.11 -1.03 -0.10 0.00 -0.22 0.00 0.00 54.13 52.89 3dkl s LEU 190 Cb 0.17 -0.65 -0.05 0.00 0.50 0.00 0.00 46.19 46.16 3dkl s LEU 190 CO 0.62 -0.34 0.21 -2.28 -1.32 0.00 0.00 176.35 173.24 3dkl s HIS 191 N 1.82 3.55 -0.40 5.38 5.65 0.52 -4.58 115.29 127.22 3dkl s HIS 191 Ca 0.02 0.56 -0.29 0.00 0.25 0.00 0.00 55.06 55.60 3dkl s HIS 191 Cb -0.17 -2.12 0.02 0.00 -1.18 0.00 0.00 32.58 29.13 3dkl s HIS 191 CO -0.14 0.52 1.24 0.34 -0.65 0.00 0.00 174.74 176.06 3dkl s ASP 192 N -0.42 6.60 -0.06 9.88 -1.08 -0.97 -1.26 116.67 129.36 3dkl s ASP 192 Ca 0.15 0.78 0.18 0.00 -0.52 0.00 0.00 52.55 53.14 3dkl s ASP 192 Cb -0.13 -2.54 0.59 0.00 -1.46 0.00 0.00 42.92 39.38 3dkl s ASP 192 CO 0.04 -1.22 1.50 0.49 0.52 0.00 0.00 175.17 176.50 3dkl n PHE 193 N 7.94 1.05 0.38 -5.34 0.99 0.20 -1.11 117.46 121.57 3dkl n PHE 193 Ca 0.14 -0.57 0.08 0.00 -0.00 0.00 0.00 57.45 57.09 3dkl n PHE 193 Cb 0.48 -0.13 0.22 0.00 -1.00 0.00 0.00 39.48 39.06 3dkl n PHE 193 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 3dkl n GLY 194 N 1.00 1.39 0.09 1.37 0.00 -1.24 -4.48 105.19 103.32 3dkl n GLY 194 Ca 0.22 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.59 3dkl n GLY 194 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3dkl h TYR 195 N 2.94 -0.09 0.00 1.61 5.03 -1.90 -2.15 116.97 122.40 3dkl h TYR 195 Ca 0.00 0.01 -0.01 0.00 2.58 0.00 0.00 58.73 61.31 3dkl h TYR 195 Cb 0.70 0.05 -0.00 0.00 1.55 0.00 0.00 36.73 39.03 3dkl h TYR 195 CO 0.35 -0.06 -0.04 0.07 -1.32 0.00 0.00 178.16 177.15 3dkl h ARG 196 N -0.03 0.00 -0.02 1.82 0.11 -1.99 -3.25 114.38 111.02 3dkl h ARG 196 Ca 0.05 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.13 3dkl h ARG 196 Cb 0.10 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.18 3dkl h ARG 196 CO -0.10 0.04 -0.13 0.41 0.10 0.00 0.00 179.97 180.28 3dkl n GLY 197 N 0.26 0.03 4.00 0.08 0.00 -0.83 -4.91 105.19 103.82 3dkl n GLY 197 Ca 0.01 -0.51 -0.18 0.00 0.00 0.00 0.00 46.02 45.34 3dkl n GLY 197 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3dkl s VAL 198 N -2.20 2.82 -0.89 1.61 -7.23 -1.08 -4.70 120.40 108.73 3dkl s VAL 198 Ca 0.30 -0.91 0.26 0.00 -1.81 0.00 0.00 61.98 59.82 3dkl s VAL 198 Cb 0.20 -2.91 0.11 0.00 0.56 0.00 0.00 36.38 34.34 3dkl s VAL 198 CO 0.41 0.00 1.58 -1.54 -0.31 0.00 0.00 175.10 175.24 3dkl n SER 199 N -2.03 0.44 -3.66 4.85 3.41 -1.26 -4.95 113.62 110.42 3dkl n SER 199 Ca 0.09 0.13 -0.04 0.00 -0.26 0.00 0.00 58.87 58.79 3dkl n SER 199 Cb 0.59 -0.09 -0.01 0.00 -0.26 0.00 0.00 64.21 64.44 3dkl n SER 199 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3dkl s SER 200 N -3.43 -0.22 0.23 4.04 1.04 -1.26 -5.02 113.70 109.08 3dkl s SER 200 Ca 0.11 -0.24 -0.06 0.00 0.48 0.00 0.00 55.95 56.23 3dkl s SER 200 Cb 0.16 0.41 0.31 0.00 0.10 0.00 0.00 66.02 67.01 3dkl s SER 200 CO 0.65 -0.73 1.83 1.56 0.98 0.00 0.00 173.24 177.53 3dkl h GLN 201 N 2.00 0.83 -0.22 4.02 1.08 -1.94 -1.42 115.11 119.46 3dkl h GLN 201 Ca -0.24 -0.05 -0.04 0.00 -1.45 0.00 0.00 58.65 56.87 3dkl h GLN 201 Cb 1.23 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 28.46 3dkl h GLN 201 CO 0.27 0.55 -0.03 1.49 -0.95 0.00 0.00 178.83 180.16 3dkl h GLU 202 N 0.85 0.41 -0.94 1.46 4.81 -2.01 -2.55 114.58 116.61 3dkl h GLU 202 Ca 0.35 -0.15 0.15 0.00 -0.13 0.00 0.00 59.36 59.58 3dkl h GLU 202 Cb 0.21 -0.03 -0.09 0.00 0.63 0.00 0.00 28.75 29.47 3dkl h GLU 202 CO -0.19 0.63 0.55 1.15 -0.73 0.00 0.00 179.01 180.43 3dkl h THR 203 N 0.15 0.80 0.02 0.32 2.02 -1.92 -2.32 112.91 111.97 3dkl h THR 203 Ca 0.06 -0.27 0.02 0.00 0.77 0.00 0.00 66.41 66.98 3dkl h THR 203 Cb 0.47 -0.07 -0.02 0.00 -1.74 0.00 0.00 68.15 66.79 3dkl h THR 203 CO 0.02 0.15 -0.11 0.00 0.37 0.00 0.00 175.52 175.94 3dkl h ALA 204 N 1.57 -0.14 -0.62 6.16 0.00 -0.85 0.15 119.26 125.53 3dkl h ALA 204 Ca 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.41 3dkl h ALA 204 Cb 0.65 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 3dkl h ALA 204 CO -0.33 -0.61 0.36 0.78 0.00 0.00 0.00 179.25 179.45 3dkl h GLY 205 N -0.20 0.92 0.66 0.00 0.00 -1.23 -0.17 103.07 103.04 3dkl h GLY 205 Ca 0.04 -0.40 -0.00 0.00 0.00 0.00 0.00 47.33 46.97 3dkl h GLY 205 CO -0.10 0.38 -0.00 -2.22 0.00 0.00 0.00 176.54 174.60 3dkl h ILE 206 N 0.85 1.27 -0.11 2.60 2.04 -1.10 -1.42 117.51 121.63 3dkl h ILE 206 Ca 0.22 -0.81 0.00 0.00 1.00 0.00 0.00 64.86 65.28 3dkl h ILE 206 Cb 0.01 1.82 -0.01 0.00 -0.74 0.00 0.00 36.82 37.90 3dkl h ILE 206 CO -0.04 0.21 0.06 1.23 0.00 0.00 0.00 178.15 179.62 3dkl h GLY 207 N -0.34 0.15 0.96 5.37 0.00 -0.69 -1.58 103.07 106.94 3dkl h GLY 207 Ca 0.00 -0.05 0.02 0.00 0.00 0.00 0.00 47.33 47.30 3dkl h GLY 207 CO 0.00 0.05 0.52 0.00 0.00 0.00 0.00 176.54 177.11 3dkl h ALA 208 N 1.05 1.02 -0.80 3.60 0.00 -1.04 -2.02 119.26 121.07 3dkl h ALA 208 Ca 0.04 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.93 3dkl h ALA 208 Cb -0.01 -0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.44 3dkl h ALA 208 CO -0.02 0.39 0.53 0.66 0.00 0.00 0.00 179.25 180.80 3dkl h SER 209 N 1.05 0.88 -0.51 0.00 4.64 -1.05 -2.22 113.55 116.34 3dkl h SER 209 Ca 0.30 -0.01 -0.10 0.00 -0.47 0.00 0.00 61.79 61.51 3dkl h SER 209 Cb -0.08 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 61.78 3dkl h SER 209 CO -0.08 0.62 -0.06 0.00 -0.87 0.00 0.00 176.83 176.44 3dkl h ALA 210 N 1.52 0.70 -0.65 5.18 0.00 -0.68 -2.80 119.26 122.54 3dkl h ALA 210 Ca 0.31 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 3dkl h ALA 210 Cb -0.02 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.55 3dkl h ALA 210 CO -0.08 0.56 0.31 1.25 0.00 0.00 0.00 179.25 181.30 3dkl h HIS 211 N 0.81 0.91 0.00 0.00 6.17 -1.23 -2.70 115.15 119.12 3dkl h HIS 211 Ca 0.14 -0.03 0.00 0.00 0.71 0.00 0.00 60.37 61.19 3dkl h HIS 211 Cb 0.60 -0.29 0.00 0.00 2.52 0.00 0.00 27.41 30.25 3dkl h HIS 211 CO 0.04 0.67 0.00 1.28 0.71 0.00 0.00 177.93 180.63 3dkl n LEU 212 N -4.35 0.00 0.26 0.26 4.77 -0.85 -1.37 117.00 115.73 3dkl n LEU 212 Ca 0.06 0.44 0.10 0.00 -0.03 0.00 0.00 56.01 56.59 3dkl n LEU 212 Cb 0.13 -0.44 0.71 0.00 -2.33 0.00 0.00 43.42 41.49 3dkl n LEU 212 CO 0.38 -0.24 1.03 0.58 -1.33 0.00 0.00 177.39 177.80 3dkl h VAL 213 N 0.00 0.80 0.00 4.08 2.07 -1.38 -3.32 116.25 118.50 3dkl h VAL 213 Ca 0.00 -0.27 -0.11 0.00 0.82 0.00 0.00 66.70 67.15 3dkl h VAL 213 Cb 0.20 1.16 -0.02 0.00 -1.52 0.00 0.00 31.29 31.10 3dkl h VAL 213 CO 0.00 0.07 -1.40 0.59 0.02 0.00 0.00 177.57 176.85 3dkl n ASN 214 N -4.09 3.57 -4.27 0.57 3.02 -0.47 -4.59 115.26 108.99 3dkl n ASN 214 Ca -0.03 -0.00 -0.21 0.00 -0.03 0.00 0.00 54.58 54.31 3dkl n ASN 214 Cb 0.16 0.64 -0.10 0.00 -0.61 0.00 0.00 39.78 39.87 3dkl n ASN 214 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3dkl s PHE 215 N -2.14 1.77 -0.18 3.10 0.40 -0.90 -4.81 117.98 115.21 3dkl s PHE 215 Ca -0.03 -1.15 0.04 0.00 -0.60 0.00 0.00 56.93 55.19 3dkl s PHE 215 Cb 0.02 -1.10 -0.04 0.00 0.51 0.00 0.00 43.02 42.41 3dkl s PHE 215 CO 0.24 -0.23 0.16 1.63 0.70 0.00 0.00 175.22 177.73 3dkl n LYS 216 N -0.68 5.69 -3.82 0.44 4.76 0.18 -4.34 118.16 120.41 3dkl n LYS 216 Ca -0.02 -0.01 -0.36 0.00 -2.87 0.00 0.00 58.31 55.05 3dkl n LYS 216 Cb 0.66 -0.68 -0.10 0.00 -1.84 0.00 0.00 35.03 33.07 3dkl n LYS 216 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 3dkl s GLY 217 N -1.34 1.92 -0.16 0.72 0.00 -1.25 -0.07 107.32 107.14 3dkl s GLY 217 Ca 0.01 -0.87 -0.15 0.00 0.00 0.00 0.00 44.72 43.71 3dkl s GLY 217 CO 0.15 0.28 0.44 -1.08 0.00 0.00 0.00 173.10 172.89 3dkl s THR 218 N 0.87 0.00 -2.10 0.90 -1.32 -0.78 -2.29 115.64 110.92 3dkl s THR 218 Ca 0.05 -0.02 0.18 0.00 -1.21 0.00 0.00 61.69 60.69 3dkl s THR 218 Cb -0.13 -0.62 0.20 0.00 -1.51 0.00 0.00 72.50 70.44 3dkl s THR 218 CO 0.03 -0.01 1.12 0.47 -2.21 0.00 0.00 174.62 174.01 3dkl n ASP 219 N 2.76 2.64 -4.45 8.08 9.92 -0.27 -4.23 116.55 131.00 3dkl n ASP 219 Ca -0.14 -1.78 -0.44 0.00 -0.53 0.00 0.00 54.79 51.90 3dkl n ASP 219 Cb 0.57 -0.06 -0.01 0.00 -0.64 0.00 0.00 41.12 40.98 3dkl n ASP 219 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 3dkl s THR 220 N -1.40 4.98 0.37 -3.53 2.01 -1.25 -4.84 115.64 111.97 3dkl s THR 220 Ca 0.23 -2.31 0.11 0.00 0.31 0.00 0.00 61.69 60.04 3dkl s THR 220 Cb 0.16 -4.85 0.34 0.00 0.01 0.00 0.00 72.50 68.16 3dkl s THR 220 CO 0.23 -1.55 1.85 0.58 -0.69 0.00 0.00 174.62 175.03 3dkl h VAL 221 N 5.02 0.75 -1.17 3.82 2.07 -1.96 -2.26 116.25 122.52 3dkl h VAL 221 Ca 0.25 -0.21 0.33 0.00 0.82 0.00 0.00 66.70 67.90 3dkl h VAL 221 Cb 0.93 0.09 -0.08 0.00 -1.52 0.00 0.00 31.29 30.71 3dkl h VAL 221 CO 1.18 0.11 0.79 0.00 0.02 0.00 0.00 177.57 179.67 3dkl h ALA 222 N 1.61 2.68 -0.27 1.67 0.00 -1.90 -0.71 119.26 122.34 3dkl h ALA 222 Ca 0.48 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.39 3dkl h ALA 222 Cb 0.91 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 3dkl h ALA 222 CO -0.23 -1.11 0.02 0.78 0.00 0.00 0.00 179.25 178.72 3dkl h GLY 223 N 0.20 0.42 0.93 0.00 0.00 -1.55 -3.20 103.07 99.86 3dkl h GLY 223 Ca 0.64 -0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.76 3dkl h GLY 223 CO -0.21 0.21 0.24 1.41 0.00 0.00 0.00 176.54 178.18 3dkl h LEU 224 N 0.38 0.39 -0.30 3.11 3.38 -1.32 -2.15 115.31 118.79 3dkl h LEU 224 Ca 0.09 -0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.90 3dkl h LEU 224 Cb 0.22 -0.08 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 3dkl h LEU 224 CO 0.00 0.28 -0.44 0.00 0.09 0.00 0.00 178.44 178.38 3dkl h ALA 225 N 1.17 0.46 -0.40 1.53 0.00 -1.70 -1.96 119.26 118.36 3dkl h ALA 225 Ca 0.15 -0.47 0.05 0.00 0.00 0.00 0.00 54.91 54.64 3dkl h ALA 225 Cb -0.01 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.65 3dkl h ALA 225 CO -0.06 0.60 0.15 1.25 0.00 0.00 0.00 179.25 181.19 3dkl h LEU 226 N 0.61 0.18 -0.26 0.00 6.46 -1.51 -0.19 115.31 120.58 3dkl h LEU 226 Ca 0.03 0.04 -0.03 0.00 -0.12 0.00 0.00 57.88 57.81 3dkl h LEU 226 Cb 1.04 0.02 -0.01 0.00 -0.73 0.00 0.00 40.66 40.98 3dkl h LEU 226 CO 0.10 0.14 0.06 0.40 -0.62 0.00 0.00 178.44 178.52 3dkl h ILE 227 N 0.32 1.22 -0.77 4.05 2.04 -1.09 0.95 117.51 124.23 3dkl h ILE 227 Ca 0.18 -0.72 0.05 0.00 1.00 0.00 0.00 64.86 65.37 3dkl h ILE 227 Cb 0.16 1.19 -0.05 0.00 -0.74 0.00 0.00 36.82 37.37 3dkl h ILE 227 CO -0.18 0.23 0.47 0.50 0.00 0.00 0.00 178.15 179.18 3dkl h LYS 228 N 0.25 0.86 0.13 2.37 3.64 -1.04 0.41 116.57 123.20 3dkl h LYS 228 Ca 0.08 -0.05 -0.29 0.00 -1.27 0.00 0.00 60.65 59.12 3dkl h LYS 228 Cb 0.29 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 31.92 3dkl h LYS 228 CO 0.00 0.57 -1.35 -0.22 -2.27 0.00 0.00 179.45 176.18 3dkl h LYS 229 N 0.89 0.28 0.00 1.90 3.64 -0.85 -3.37 116.57 119.05 3dkl h LYS 229 Ca 0.33 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 3dkl h LYS 229 Cb 0.11 0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.10 3dkl h LYS 229 CO -0.15 1.20 -1.58 0.66 -2.27 0.00 0.00 179.45 177.30 3dkl n TYR 230 N -3.51 0.00 0.03 1.91 4.02 0.31 -4.88 117.16 115.04 3dkl n TYR 230 Ca -0.11 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.78 3dkl n TYR 230 Cb 1.03 -0.31 0.00 0.00 -0.02 0.00 0.00 39.34 40.05 3dkl n TYR 230 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 176.86 176.51 3dkl n TYR 231 N -1.95 -0.46 0.00 -0.72 4.02 0.10 -4.83 117.16 113.32 3dkl n TYR 231 Ca -0.02 0.08 0.00 0.00 -0.01 0.00 0.00 57.90 57.95 3dkl n TYR 231 Cb 0.38 0.27 0.00 0.00 -0.02 0.00 0.00 39.34 39.97 3dkl n TYR 231 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dkl n GLY 232 N 2.33 -0.32 3.20 2.72 0.00 0.10 -3.35 105.19 109.88 3dkl n GLY 232 Ca 0.00 -1.35 -0.21 0.00 0.00 0.00 0.00 46.02 44.47 3dkl n GLY 232 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3dkl s THR 233 N -1.26 1.31 0.27 2.61 -4.23 -1.26 -0.62 115.64 112.46 3dkl s THR 233 Ca 0.00 -1.27 -0.03 0.00 -1.18 0.00 0.00 61.69 59.21 3dkl s THR 233 Cb 0.00 -1.21 0.27 0.00 1.34 0.00 0.00 72.50 72.90 3dkl s THR 233 CO 0.00 -0.08 1.91 0.11 -0.54 0.00 0.00 174.62 176.02 3dkl h LYS 234 N 4.47 1.19 -7.09 3.99 1.79 -1.98 -3.43 116.57 115.50 3dkl h LYS 234 Ca -0.42 -0.07 -0.47 0.00 -2.18 0.00 0.00 60.65 57.51 3dkl h LYS 234 Cb 1.18 -0.27 0.03 0.00 -1.58 0.00 0.00 32.23 31.59 3dkl h LYS 234 CO 0.41 0.79 0.38 -0.51 -1.08 0.00 0.00 179.45 179.44 3dkl s ASP 235 N -6.01 6.34 0.22 0.86 1.01 -1.26 -4.97 116.67 112.86 3dkl s ASP 235 Ca -0.12 1.89 -0.11 0.00 0.71 0.00 0.00 52.55 54.92 3dkl s ASP 235 Cb 0.19 -2.55 0.31 0.00 1.01 0.00 0.00 42.92 41.88 3dkl s ASP 235 CO 0.81 -0.78 1.65 -0.65 0.21 0.00 0.00 175.17 176.41 3dkl h PRO 236 N 1.46 0.09 -5.01 8.23 0.11 -2.04 -3.42 132.00 131.41 3dkl h PRO 236 Ca -0.49 -0.01 -0.36 0.00 0.11 0.00 0.00 66.00 65.25 3dkl h PRO 236 Cb 1.22 -0.02 -0.22 0.00 0.11 0.00 0.00 31.00 32.09 3dkl h PRO 236 CO 0.59 0.06 -0.76 0.14 -0.21 0.00 0.00 178.00 177.82 3dkl s VAL 237 N -6.16 0.87 -0.94 3.15 -7.23 -1.26 -4.99 120.40 103.84 3dkl s VAL 237 Ca -0.14 -1.14 0.25 0.00 -1.81 0.00 0.00 61.98 59.14 3dkl s VAL 237 Cb 0.20 -0.86 0.22 0.00 0.56 0.00 0.00 36.38 36.49 3dkl s VAL 237 CO 0.74 -0.24 1.79 -0.81 -0.31 0.00 0.00 175.10 176.27 3dkl n PRO 238 N 1.49 0.04 -3.58 4.82 -0.04 -1.26 -4.95 135.00 131.53 3dkl n PRO 238 Ca -0.21 0.10 -0.14 0.00 -0.04 0.00 0.00 63.50 63.22 3dkl n PRO 238 Cb 0.55 -1.56 -0.05 0.00 -0.04 0.00 0.00 33.50 32.39 3dkl n PRO 238 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3dkl s GLY 239 N -3.10 -0.42 0.07 0.55 0.00 -1.26 -4.73 107.32 98.42 3dkl s GLY 239 Ca 0.12 0.60 0.02 0.00 0.00 0.00 0.00 44.72 45.46 3dkl s GLY 239 CO 0.47 0.30 -0.07 -0.19 0.00 0.00 0.00 173.10 173.61 3dkl s TYR 240 N -2.40 0.77 0.29 1.90 1.51 0.90 -4.90 117.35 115.43 3dkl s TYR 240 Ca -0.06 -0.69 0.03 0.00 -1.01 0.00 0.00 57.07 55.34 3dkl s TYR 240 Cb -0.01 -0.46 -0.04 0.00 -0.11 0.00 0.00 41.96 41.35 3dkl s TYR 240 CO -0.01 -0.11 0.14 0.45 -1.11 0.00 0.00 175.55 174.90 3dkl s SER 241 N -2.24 1.48 0.18 2.29 0.15 -1.26 -1.86 113.70 112.43 3dkl s SER 241 Ca -0.00 -1.51 0.07 0.00 0.70 0.00 0.00 55.95 55.21 3dkl s SER 241 Cb -0.03 0.32 -0.05 0.00 -1.71 0.00 0.00 66.02 64.55 3dkl s SER 241 CO -0.02 -0.84 -0.13 0.68 1.20 0.00 0.00 173.24 174.13 3dkl s VAL 242 N -3.64 1.54 0.45 4.45 -7.23 -1.26 -5.09 120.40 109.61 3dkl s VAL 242 Ca 0.36 -2.13 -0.25 0.00 -1.81 0.00 0.00 61.98 58.15 3dkl s VAL 242 Cb 0.06 -1.95 -0.09 0.00 0.56 0.00 0.00 36.38 34.97 3dkl s VAL 242 CO 0.16 -0.62 1.30 -2.65 -0.31 0.00 0.00 175.10 172.98 3dkl n PRO 243 N -0.25 1.93 -3.66 4.82 -0.02 -1.26 -4.88 135.00 131.69 3dkl n PRO 243 Ca -0.09 0.69 -0.14 0.00 -2.02 0.00 0.00 63.50 61.93 3dkl n PRO 243 Cb 0.60 -2.45 -0.08 0.00 -0.02 0.00 0.00 33.50 31.55 3dkl n PRO 243 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3dkl s ALA 244 N -1.22 -1.45 0.55 3.55 0.00 -1.26 -1.65 121.76 120.27 3dkl s ALA 244 Ca 0.63 1.50 -0.07 0.00 0.00 0.00 0.00 51.96 54.02 3dkl s ALA 244 Cb -0.48 -0.74 -0.02 0.00 0.00 0.00 0.00 23.12 21.88 3dkl s ALA 244 CO 0.56 -0.29 0.88 0.00 0.00 0.00 0.00 175.76 176.91 3dkl s ALA 245 N -0.05 3.29 0.44 0.00 0.00 0.07 -4.95 121.76 120.57 3dkl s ALA 245 Ca -0.03 -0.46 0.03 0.00 0.00 0.00 0.00 51.96 51.50 3dkl s ALA 245 Cb -0.04 -2.71 -0.03 0.00 0.00 0.00 0.00 23.12 20.35 3dkl s ALA 245 CO 0.02 -0.57 0.06 -1.83 0.00 0.00 0.00 175.76 173.45 3dkl s GLU 246 N -4.92 2.01 0.38 0.00 -1.05 -1.26 -4.45 118.70 109.42 3dkl s GLU 246 Ca 0.51 -2.24 0.09 0.00 -0.15 0.00 0.00 54.97 53.18 3dkl s GLU 246 Cb -0.11 -1.08 0.77 0.00 -0.44 0.00 0.00 34.13 33.28 3dkl s GLU 246 CO 0.47 -0.37 1.92 0.45 0.95 0.00 0.00 175.26 178.68 3dkl h HIS 247 N 1.64 0.31 -0.34 4.83 3.86 -2.00 -2.24 115.15 121.22 3dkl h HIS 247 Ca -0.40 -0.03 -0.06 0.00 -1.16 0.00 0.00 60.37 58.72 3dkl h HIS 247 Cb 1.28 -0.09 -0.02 0.00 1.06 0.00 0.00 27.41 29.65 3dkl h HIS 247 CO 1.37 0.39 -0.05 0.66 0.86 0.00 0.00 177.93 181.16 3dkl h SER 248 N 0.29 0.53 1.42 2.45 4.64 -1.97 0.11 113.55 121.02 3dkl h SER 248 Ca 0.06 -0.12 -0.03 0.00 -0.47 0.00 0.00 61.79 61.23 3dkl h SER 248 Cb 0.33 -0.14 -0.00 0.00 -0.31 0.00 0.00 62.40 62.27 3dkl h SER 248 CO 0.02 0.64 -0.15 0.71 -0.87 0.00 0.00 176.83 177.18 3dkl h THR 249 N 0.53 0.29 0.00 2.95 1.35 -1.82 -2.16 112.91 114.06 3dkl h THR 249 Ca 0.11 -1.14 -0.06 0.00 -0.55 0.00 0.00 66.41 64.76 3dkl h THR 249 Cb 0.42 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 68.74 3dkl h THR 249 CO 0.02 0.14 -0.48 0.40 -0.25 0.00 0.00 175.52 175.35 3dkl h ILE 250 N 0.00 0.65 -0.06 6.82 1.08 -1.26 -3.41 117.51 121.33 3dkl h ILE 250 Ca -0.00 -1.62 -0.04 0.00 -0.39 0.00 0.00 64.86 62.80 3dkl h ILE 250 Cb 0.89 1.37 -0.01 0.00 -3.07 0.00 0.00 36.82 36.00 3dkl h ILE 250 CO 0.02 0.22 -0.15 0.71 -0.69 0.00 0.00 178.15 178.26 3dkl h THR 251 N -1.00 1.14 -0.62 -0.27 1.35 -0.88 -2.78 112.91 109.86 3dkl h THR 251 Ca -0.10 -0.65 0.18 0.00 -0.55 0.00 0.00 66.41 65.29 3dkl h THR 251 Cb 0.72 1.26 -0.02 0.00 -1.73 0.00 0.00 68.15 68.38 3dkl h THR 251 CO -0.06 0.19 0.66 0.00 -0.25 0.00 0.00 175.52 176.06 3dkl h ALA 252 N 1.76 2.39 0.00 6.62 0.00 -1.59 0.10 119.26 128.54 3dkl h ALA 252 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dkl h ALA 252 Cb 0.32 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.16 3dkl h ALA 252 CO 0.02 -0.97 0.00 0.91 0.00 0.00 0.00 179.25 179.21 3dkl n TRP 253 N -3.63 0.54 0.00 0.00 7.02 -1.05 -5.01 117.44 115.31 3dkl n TRP 253 Ca 0.12 0.16 0.00 0.00 -1.02 0.00 0.00 57.50 56.76 3dkl n TRP 253 Cb 0.88 -0.76 0.00 0.00 -2.42 0.00 0.00 31.31 29.01 3dkl n TRP 253 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 3dkl n GLY 254 N 1.33 1.57 0.33 6.99 0.00 0.02 -4.44 105.19 111.00 3dkl n GLY 254 Ca 0.06 -1.67 0.08 0.00 0.00 0.00 0.00 46.02 44.50 3dkl n GLY 254 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3dkl h LYS 255 N 0.00 0.47 0.00 1.61 2.10 -1.93 0.07 116.57 118.88 3dkl h LYS 255 Ca 0.00 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.62 3dkl h LYS 255 Cb 0.00 -0.11 0.00 0.00 -0.90 0.00 0.00 32.23 31.22 3dkl h LYS 255 CO 0.00 0.31 0.00 -0.25 -2.00 0.00 0.00 179.45 177.51 3dkl n ASP 256 N -4.47 0.00 -0.48 7.07 8.00 -1.26 -3.89 116.55 121.52 3dkl n ASP 256 Ca 0.07 -0.65 0.07 0.00 0.71 0.00 0.00 54.79 54.99 3dkl n ASP 256 Cb 0.24 -0.09 0.15 0.00 -0.02 0.00 0.00 41.12 41.40 3dkl n ASP 256 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 3dkl n HIS 257 N -1.09 0.00 -0.27 1.24 8.25 0.01 -4.73 115.22 118.63 3dkl n HIS 257 Ca 0.19 -1.09 0.05 0.00 -0.26 0.00 0.00 57.72 56.60 3dkl n HIS 257 Cb 0.13 -0.19 0.19 0.00 1.12 0.00 0.00 29.99 31.25 3dkl n HIS 257 CO 0.00 0.00 0.00 1.49 0.64 0.00 0.00 176.34 178.47 3dkl h GLU 258 N 0.54 0.54 -0.69 -0.41 4.81 -1.67 -1.34 114.58 116.36 3dkl h GLU 258 Ca -0.02 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.20 3dkl h GLU 258 Cb 1.12 -0.12 -0.04 0.00 0.63 0.00 0.00 28.75 30.33 3dkl h GLU 258 CO 0.01 0.36 0.43 -0.22 -0.73 0.00 0.00 179.01 178.86 3dkl h LYS 259 N 0.56 0.82 -0.91 1.92 3.64 -1.92 -0.06 116.57 120.61 3dkl h LYS 259 Ca 0.42 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.75 3dkl h LYS 259 Cb 0.58 -0.18 -0.04 0.00 -0.41 0.00 0.00 32.23 32.17 3dkl h LYS 259 CO -0.35 0.54 0.56 -0.44 -2.27 0.00 0.00 179.45 177.48 3dkl h ASP 260 N 0.84 1.09 0.02 4.20 3.32 -1.69 0.34 116.42 124.55 3dkl h ASP 260 Ca 0.28 -0.06 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 3dkl h ASP 260 Cb 0.02 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.29 3dkl h ASP 260 CO -0.11 0.84 -0.01 0.00 -1.72 0.00 0.00 179.24 178.24 3dkl h ALA 261 N 1.30 -0.03 -0.01 3.45 0.00 -0.69 -0.98 119.26 122.30 3dkl h ALA 261 Ca 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.18 3dkl h ALA 261 Cb -0.06 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 17.74 3dkl h ALA 261 CO -0.06 -0.47 0.01 0.74 0.00 0.00 0.00 179.25 179.47 3dkl h PHE 262 N -0.13 0.02 -0.44 0.00 -1.00 -0.69 -1.80 116.94 112.90 3dkl h PHE 262 Ca -0.00 0.00 0.04 0.00 2.81 0.00 0.00 57.97 60.81 3dkl h PHE 262 Cb 0.12 -0.01 -0.04 0.00 3.61 0.00 0.00 35.95 39.64 3dkl h PHE 262 CO -0.04 0.03 0.22 1.49 -1.61 0.00 0.00 178.31 178.40 3dkl h GLU 263 N -0.00 0.43 -0.26 1.51 4.81 -0.92 -1.58 114.58 118.57 3dkl h GLU 263 Ca 0.00 -0.03 0.03 0.00 -0.13 0.00 0.00 59.36 59.24 3dkl h GLU 263 Cb 0.02 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.27 3dkl h GLU 263 CO -0.00 0.28 0.07 1.25 -0.73 0.00 0.00 179.01 179.89 3dkl h HIS 264 N 0.44 0.13 -0.31 0.92 2.76 -0.99 -2.28 115.15 115.82 3dkl h HIS 264 Ca 0.19 0.01 -0.05 0.00 -2.20 0.00 0.00 60.37 58.32 3dkl h HIS 264 Cb 0.10 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.02 3dkl h HIS 264 CO -0.10 0.05 -0.00 0.82 -1.30 0.00 0.00 177.93 177.40 3dkl h ILE 265 N 0.18 1.26 0.00 6.26 2.04 -0.93 0.23 117.51 126.55 3dkl h ILE 265 Ca 0.12 -0.96 -0.10 0.00 1.00 0.00 0.00 64.86 64.92 3dkl h ILE 265 Cb 0.10 1.26 -0.01 0.00 -0.74 0.00 0.00 36.82 37.43 3dkl h ILE 265 CO -0.13 0.31 -0.48 -0.37 0.00 0.00 0.00 178.15 177.47 3dkl h VAL 266 N 0.35 1.26 -0.12 1.67 -1.51 -1.28 -2.13 116.25 114.48 3dkl h VAL 266 Ca 0.09 -1.71 -0.22 0.00 -1.23 0.00 0.00 66.70 63.63 3dkl h VAL 266 Cb 0.45 1.94 0.01 0.00 -2.13 0.00 0.00 31.29 31.56 3dkl h VAL 266 CO 0.02 0.47 -0.79 0.74 -1.23 0.00 0.00 177.57 176.78 3dkl h THR 267 N 0.00 1.30 -0.72 7.19 2.02 -1.23 -2.82 112.91 118.66 3dkl h THR 267 Ca -0.00 -2.04 0.06 0.00 0.77 0.00 0.00 66.41 65.20 3dkl h THR 267 Cb 0.91 2.04 -0.04 0.00 -1.74 0.00 0.00 68.15 69.31 3dkl h THR 267 CO 0.06 0.64 0.47 1.56 0.37 0.00 0.00 175.52 178.62 3dkl h GLN 268 N 0.47 0.75 -2.07 6.66 1.08 -0.55 -3.21 115.11 118.23 3dkl h GLN 268 Ca -0.05 -0.05 -0.58 0.00 -1.45 0.00 0.00 58.65 56.52 3dkl h GLN 268 Cb 1.41 -0.17 -0.42 0.00 -0.05 0.00 0.00 27.48 28.25 3dkl h GLN 268 CO 0.16 0.50 -0.69 1.19 -0.95 0.00 0.00 178.83 179.04 3dkl n PHE 269 N -4.47 3.73 0.54 2.96 3.01 -0.84 -4.86 117.46 117.52 3dkl n PHE 269 Ca 0.10 -3.76 0.13 0.00 1.01 0.00 0.00 57.45 54.93 3dkl n PHE 269 Cb 0.20 -0.39 0.34 0.00 -0.01 0.00 0.00 39.48 39.63 3dkl n PHE 269 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3dkl h SER 270 N 2.88 0.00 0.00 4.37 4.64 -1.51 -3.31 113.55 120.62 3dkl h SER 270 Ca 0.17 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.48 3dkl h SER 270 Cb 0.63 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.72 3dkl h SER 270 CO 0.81 0.01 0.00 -1.54 -0.87 0.00 0.00 176.83 175.24 3dkl n SER 271 N -2.43 1.54 -4.36 4.97 3.41 -1.26 -4.82 113.62 110.67 3dkl n SER 271 Ca 0.05 -1.73 -0.18 0.00 -0.26 0.00 0.00 58.87 56.75 3dkl n SER 271 Cb 0.45 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.30 3dkl n SER 271 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3dkl s VAL 272 N -0.73 1.09 0.49 -3.33 -7.23 -1.25 -4.72 120.40 104.72 3dkl s VAL 272 Ca 0.00 -2.03 -0.24 0.00 -1.81 0.00 0.00 61.98 57.90 3dkl s VAL 272 Cb 0.00 -2.47 -0.07 0.00 0.56 0.00 0.00 36.38 34.40 3dkl s VAL 272 CO 0.00 -0.23 1.37 -2.84 -0.31 0.00 0.00 175.10 173.09 3dkl s PRO 273 N -3.87 3.49 -0.05 4.82 0.02 -1.25 -4.57 135.00 133.59 3dkl s PRO 273 Ca 0.31 2.28 -0.02 0.00 0.02 0.00 0.00 61.00 63.59 3dkl s PRO 273 Cb 0.06 -2.49 0.04 0.00 0.02 0.00 0.00 34.50 32.13 3dkl s PRO 273 CO 0.11 -0.92 0.10 0.54 -0.33 0.00 0.00 177.00 176.49 3dkl s VAL 274 N -1.27 -0.09 -0.15 3.83 0.11 -0.82 -4.00 120.40 118.02 3dkl s VAL 274 Ca 0.65 0.24 -0.15 0.00 -2.93 0.00 0.00 61.98 59.80 3dkl s VAL 274 Cb -0.41 -0.19 -0.04 0.00 -1.53 0.00 0.00 36.38 34.21 3dkl s VAL 274 CO 0.51 0.10 0.34 -0.55 -3.33 0.00 0.00 175.10 172.17 3dkl s SER 275 N 1.40 6.49 -0.20 3.54 0.15 -0.66 -0.53 113.70 123.88 3dkl s SER 275 Ca -0.06 0.57 -0.01 0.00 0.70 0.00 0.00 55.95 57.15 3dkl s SER 275 Cb -0.12 -2.21 0.06 0.00 -1.71 0.00 0.00 66.02 62.04 3dkl s SER 275 CO -0.05 0.07 -0.02 -0.69 1.20 0.00 0.00 173.24 173.76 3dkl s VAL 276 N 0.55 1.03 0.15 4.45 1.01 0.26 -0.75 120.40 127.10 3dkl s VAL 276 Ca 0.19 -0.83 -0.31 0.00 0.00 0.00 0.00 61.98 61.02 3dkl s VAL 276 Cb -0.13 -1.38 -0.10 0.00 0.00 0.00 0.00 36.38 34.77 3dkl s VAL 276 CO 0.05 -0.10 1.64 0.54 0.00 0.00 0.00 175.10 177.23 3dkl s VAL 277 N 1.63 2.59 0.00 2.92 0.11 -1.26 -1.81 120.40 124.58 3dkl s VAL 277 Ca -0.03 0.34 0.00 0.00 -2.93 0.00 0.00 61.98 59.36 3dkl s VAL 277 Cb -0.17 -3.22 0.00 0.00 -1.53 0.00 0.00 36.38 31.46 3dkl s VAL 277 CO -0.07 0.02 0.82 -1.20 -3.33 0.00 0.00 175.10 171.33 3dkl n SER 278 N 4.47 1.36 -1.03 3.54 7.64 -0.69 -4.68 113.62 124.24 3dkl n SER 278 Ca 0.15 -1.65 0.08 0.00 1.01 0.00 0.00 58.87 58.45 3dkl n SER 278 Cb 0.38 0.00 0.26 0.00 -1.01 0.00 0.00 64.21 63.84 3dkl n SER 278 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 3dkl n ASP 279 N -0.33 3.91 -0.31 6.43 3.85 -1.26 -3.71 116.55 125.12 3dkl n ASP 279 Ca 0.00 -2.57 0.15 0.00 -0.71 0.00 0.00 54.79 51.66 3dkl n ASP 279 Cb 0.30 -0.47 0.34 0.00 -1.35 0.00 0.00 41.12 39.95 3dkl n ASP 279 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.20 176.47 3dkl h SER 280 N 2.52 0.35 0.00 -1.12 0.02 -1.96 -3.37 113.55 109.99 3dkl h SER 280 Ca 0.00 0.16 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 3dkl h SER 280 Cb 1.26 0.14 0.00 0.00 0.14 0.00 0.00 62.40 63.94 3dkl h SER 280 CO 0.17 -0.03 -0.81 -1.22 -1.14 0.00 0.00 176.83 173.80 3dkl n TYR 281 N -5.05 0.00 -3.15 3.45 4.02 -1.26 -5.03 117.16 110.14 3dkl n TYR 281 Ca 0.24 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 58.17 3dkl n TYR 281 Cb 0.72 0.06 -0.00 0.00 -0.02 0.00 0.00 39.34 40.10 3dkl n TYR 281 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 3dkl s ASP 282 N -4.59 -1.43 0.37 7.72 -1.08 -1.26 -5.04 116.67 111.36 3dkl s ASP 282 Ca 0.00 0.01 0.11 0.00 -0.52 0.00 0.00 52.55 52.15 3dkl s ASP 282 Cb 0.00 1.89 0.88 0.00 -1.46 0.00 0.00 42.92 44.23 3dkl s ASP 282 CO 0.00 -0.24 1.86 -0.29 0.52 0.00 0.00 175.17 177.02 3dkl h ILE 283 N 5.59 0.79 -0.10 4.11 6.09 -1.79 -1.17 117.51 131.02 3dkl h ILE 283 Ca -0.01 -0.21 -0.19 0.00 -1.37 0.00 0.00 64.86 63.08 3dkl h ILE 283 Cb 1.19 0.11 0.01 0.00 0.47 0.00 0.00 36.82 38.60 3dkl h ILE 283 CO 0.10 0.11 -0.67 1.88 -3.07 0.00 0.00 178.15 176.51 3dkl h TYR 284 N 0.62 0.87 -0.57 2.19 0.99 -1.96 -1.32 116.97 117.79 3dkl h TYR 284 Ca 0.46 -0.40 -0.02 0.00 2.00 0.00 0.00 58.73 60.77 3dkl h TYR 284 Cb 0.84 -0.13 -0.03 0.00 1.00 0.00 0.00 36.73 38.41 3dkl h TYR 284 CO -0.00 1.21 0.29 -0.97 -0.00 0.00 0.00 178.16 178.69 3dkl h ASN 285 N 0.29 0.74 -0.95 3.88 -1.24 -1.90 -0.96 115.58 115.44 3dkl h ASN 285 Ca -0.05 -0.12 0.00 0.00 0.71 0.00 0.00 56.30 56.84 3dkl h ASN 285 Cb 1.32 -0.19 -0.05 0.00 0.73 0.00 0.00 38.32 40.13 3dkl h ASN 285 CO 0.14 0.65 0.61 0.00 -1.29 0.00 0.00 177.43 177.54 3dkl h ALA 286 N 1.12 1.21 0.15 1.57 0.00 -0.99 0.26 119.26 122.59 3dkl h ALA 286 Ca 0.20 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 3dkl h ALA 286 Cb 0.10 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.50 3dkl h ALA 286 CO -0.03 0.63 -0.07 0.00 0.00 0.00 0.00 179.25 179.78 3dkl h GLU 288 N -0.68 0.34 0.03 0.00 4.81 -1.09 -0.97 114.58 117.01 3dkl h GLU 288 Ca -0.02 -0.30 -0.39 0.00 -0.13 0.00 0.00 59.36 58.52 3dkl h GLU 288 Cb 0.50 0.07 -0.06 0.00 0.63 0.00 0.00 28.75 29.89 3dkl h GLU 288 CO 0.03 0.96 -2.32 1.17 -0.73 0.00 0.00 179.01 178.12 3dkl n LYS 289 N -4.39 0.66 -0.05 1.92 4.81 0.91 -3.55 118.16 118.46 3dkl n LYS 289 Ca -0.09 0.22 -0.01 0.00 -0.87 0.00 0.00 58.31 57.56 3dkl n LYS 289 Cb 0.54 -1.57 -0.00 0.00 0.02 0.00 0.00 35.03 34.02 3dkl n LYS 289 CO 0.00 0.00 0.00 0.82 1.17 0.00 0.00 177.40 179.39 3dkl h ILE 290 N -0.23 0.00 -0.16 3.15 2.04 -1.25 -0.50 117.51 120.56 3dkl h ILE 290 Ca -0.56 -0.95 -0.19 0.00 1.00 0.00 0.00 64.86 64.17 3dkl h ILE 290 Cb 1.84 0.00 -0.00 0.00 -0.74 0.00 0.00 36.82 37.92 3dkl h ILE 290 CO -0.12 0.00 -0.66 -0.50 0.00 0.00 0.00 178.15 176.87 3dkl h TRP 291 N -0.95 0.79 0.00 1.37 -0.00 -0.70 0.28 115.95 116.75 3dkl h TRP 291 Ca 0.00 -0.32 0.00 0.00 -0.00 0.00 0.00 58.89 58.57 3dkl h TRP 291 Cb 0.12 -0.13 0.00 0.00 -0.00 0.00 0.00 29.16 29.15 3dkl h TRP 291 CO -0.05 1.10 -0.12 0.41 -0.00 0.00 0.00 178.44 179.77 3dkl n GLY 292 N 0.47 -1.60 1.59 1.49 0.00 -0.37 -1.85 105.19 104.92 3dkl n GLY 292 Ca -0.05 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.88 3dkl n GLY 292 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dkl n GLU 293 N -2.04 0.00 -0.18 1.61 1.02 -1.08 -4.74 120.64 115.23 3dkl n GLU 293 Ca 0.06 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.19 3dkl n GLU 293 Cb 0.41 0.00 0.09 0.00 -0.02 0.00 0.00 31.44 31.92 3dkl n GLU 293 CO 0.00 0.00 0.00 -0.44 1.18 0.00 0.00 177.13 177.87 3dkl h ASP 294 N 0.00 0.00 -0.22 1.62 3.32 -0.86 -2.93 116.42 117.35 3dkl h ASP 294 Ca 0.00 0.10 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3dkl h ASP 294 Cb 0.00 0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3dkl h ASP 294 CO 0.00 0.02 0.00 0.18 -1.72 0.00 0.00 179.24 177.72 3dkl n LEU 295 N -5.12 2.53 -0.38 1.55 4.77 0.96 -4.65 117.00 116.66 3dkl n LEU 295 Ca 0.07 -1.74 0.30 0.00 -0.03 0.00 0.00 56.01 54.61 3dkl n LEU 295 Cb 0.28 -0.15 0.58 0.00 -2.33 0.00 0.00 43.42 41.80 3dkl n LEU 295 CO 0.19 0.61 1.21 -0.09 -1.33 0.00 0.00 177.39 177.97 3dkl h ARG 296 N 1.75 0.21 0.00 3.23 2.43 -1.17 0.22 114.38 121.06 3dkl h ARG 296 Ca 0.00 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.15 3dkl h ARG 296 Cb 0.62 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 30.12 3dkl h ARG 296 CO 0.00 0.14 -0.02 1.12 -1.51 0.00 0.00 179.97 179.70 3dkl h HIS 297 N 0.22 0.00 -0.00 2.20 2.07 -1.83 -1.79 115.15 116.01 3dkl h HIS 297 Ca 0.74 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 58.26 3dkl h HIS 297 Cb 2.09 0.00 0.00 0.00 2.57 0.00 0.00 27.41 32.07 3dkl h HIS 297 CO -0.01 0.02 -0.48 1.28 -3.07 0.00 0.00 177.93 175.67 3dkl n LEU 298 N -3.13 0.86 -0.13 6.12 4.77 0.78 -4.07 117.00 122.19 3dkl n LEU 298 Ca -0.00 -0.21 -0.28 0.00 -0.03 0.00 0.00 56.01 55.48 3dkl n LEU 298 Cb 0.25 -0.15 -0.09 0.00 -2.33 0.00 0.00 43.42 41.09 3dkl n LEU 298 CO 0.26 0.18 -1.37 -0.38 -1.33 0.00 0.00 177.39 174.76 3dkl n ILE 299 N -1.10 1.53 0.25 -0.08 5.41 -0.76 -4.41 119.36 120.20 3dkl n ILE 299 Ca 0.08 -0.34 0.12 0.00 1.00 0.00 0.00 62.75 63.61 3dkl n ILE 299 Cb 0.35 -1.92 0.56 0.00 -0.71 0.00 0.00 39.64 37.91 3dkl n ILE 299 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 3dkl n VAL 300 N -4.27 0.95 1.02 1.39 0.24 -0.75 -1.55 118.33 115.35 3dkl n VAL 300 Ca -0.51 0.54 0.12 0.00 -2.04 0.00 0.00 64.34 62.45 3dkl n VAL 300 Cb 0.85 -1.52 0.17 0.00 -1.47 0.00 0.00 33.84 31.88 3dkl n VAL 300 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 3dkl n SER 301 N -2.27 0.66 -4.78 -1.34 3.41 -1.26 -4.94 113.62 103.11 3dkl n SER 301 Ca -0.00 -0.47 -0.33 0.00 -0.26 0.00 0.00 58.87 57.81 3dkl n SER 301 Cb 0.11 0.41 0.04 0.00 -0.26 0.00 0.00 64.21 64.51 3dkl n SER 301 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 3dkl s ARG 302 N -2.96 2.89 0.64 4.33 0.52 -0.60 -5.04 118.95 118.74 3dkl s ARG 302 Ca 0.11 1.32 -0.10 0.00 -0.52 0.00 0.00 55.73 56.54 3dkl s ARG 302 Cb 0.17 -1.97 -0.01 0.00 0.52 0.00 0.00 34.95 33.67 3dkl s ARG 302 CO 0.72 -1.16 1.02 0.45 0.02 0.00 0.00 175.30 176.34 3dkl s SER 303 N -2.73 5.76 0.44 0.23 0.15 -1.26 -4.69 113.70 111.60 3dkl s SER 303 Ca 0.65 1.12 0.18 0.00 0.70 0.00 0.00 55.95 58.60 3dkl s SER 303 Cb -0.19 -2.07 1.01 0.00 -1.71 0.00 0.00 66.02 63.07 3dkl s SER 303 CO 0.42 -1.09 1.94 0.74 1.20 0.00 0.00 173.24 176.45 3dkl h THR 304 N -0.40 1.00 -0.01 6.45 2.02 -1.97 -2.64 112.91 117.37 3dkl h THR 304 Ca -0.45 -0.87 0.00 0.00 0.77 0.00 0.00 66.41 65.86 3dkl h THR 304 Cb 1.23 1.49 0.00 0.00 -1.74 0.00 0.00 68.15 69.14 3dkl h THR 304 CO 0.63 0.23 -0.08 0.00 0.37 0.00 0.00 175.52 176.67 3dkl n GLN 305 N -4.00 1.10 -2.93 6.66 3.00 -1.26 -4.28 117.38 115.67 3dkl n GLN 305 Ca -0.02 -0.49 -0.14 0.00 -0.01 0.00 0.00 57.00 56.35 3dkl n GLN 305 Cb 0.31 -1.49 0.00 0.00 0.00 0.00 0.00 30.24 29.07 3dkl n GLN 305 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 3dkl n ALA 306 N -0.52 2.59 -1.21 -1.58 0.00 -1.00 -3.95 120.51 114.84 3dkl n ALA 306 Ca 0.17 -3.20 -0.32 0.00 0.00 0.00 0.00 53.44 50.09 3dkl n ALA 306 Cb 0.29 -0.94 0.10 0.00 0.00 0.00 0.00 19.45 18.90 3dkl n ALA 306 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3dkl s PRO 307 N -2.65 2.09 -0.04 0.00 0.04 -1.19 -4.24 135.00 129.00 3dkl s PRO 307 Ca 0.33 1.38 -0.30 0.00 0.04 0.00 0.00 61.00 62.46 3dkl s PRO 307 Cb 0.40 -1.86 -0.03 0.00 0.04 0.00 0.00 34.50 33.04 3dkl s PRO 307 CO -0.02 -1.80 1.15 -1.17 0.04 0.00 0.00 177.00 175.19 3dkl s LEU 308 N -5.73 4.30 -0.41 -3.56 2.96 -0.09 -1.94 118.68 114.20 3dkl s LEU 308 Ca 0.65 1.78 -0.08 0.00 -0.22 0.00 0.00 54.13 56.27 3dkl s LEU 308 Cb -0.21 -3.56 0.08 0.00 0.50 0.00 0.00 46.19 43.00 3dkl s LEU 308 CO 0.52 -0.51 0.24 -0.63 -1.32 0.00 0.00 176.35 174.65 3dkl s ILE 309 N 1.88 4.06 0.07 6.68 1.01 0.31 -0.82 121.20 134.39 3dkl s ILE 309 Ca 0.55 -1.49 -0.30 0.00 0.00 0.00 0.00 60.65 59.40 3dkl s ILE 309 Cb -0.24 -3.52 -0.06 0.00 0.01 0.00 0.00 42.46 38.66 3dkl s ILE 309 CO 0.23 -0.52 1.17 -0.63 0.00 0.00 0.00 174.94 175.19 3dkl s ILE 310 N 1.38 4.09 -0.39 2.92 1.01 0.56 -0.58 121.20 130.19 3dkl s ILE 310 Ca 0.03 1.53 -0.01 0.00 0.00 0.00 0.00 60.65 62.21 3dkl s ILE 310 Cb -0.23 -3.98 0.11 0.00 0.01 0.00 0.00 42.46 38.37 3dkl s ILE 310 CO 0.01 0.14 0.16 -0.60 0.00 0.00 0.00 174.94 174.64 3dkl s ARG 311 N 0.89 1.84 0.78 2.79 3.52 -0.75 -1.54 118.95 126.47 3dkl s ARG 311 Ca 0.57 -1.85 -0.13 0.00 -0.13 0.00 0.00 55.73 54.19 3dkl s ARG 311 Cb -0.29 -3.47 0.07 0.00 -1.56 0.00 0.00 34.95 29.70 3dkl s ARG 311 CO 0.30 -1.03 1.15 -1.25 -0.81 0.00 0.00 175.30 173.65 3dkl s PRO 312 N 1.04 1.96 -0.06 5.12 0.04 -1.24 -1.70 135.00 140.16 3dkl s PRO 312 Ca 0.09 1.51 0.11 0.00 0.04 0.00 0.00 61.00 62.76 3dkl s PRO 312 Cb -0.22 -1.84 0.22 0.00 0.04 0.00 0.00 34.50 32.71 3dkl s PRO 312 CO -0.05 -1.92 1.13 -3.47 0.04 0.00 0.00 177.00 172.73 3dkl n ASP 313 N -3.26 -0.25 -3.61 6.66 4.64 -1.26 -4.10 116.55 115.38 3dkl n ASP 313 Ca 0.12 -2.03 -0.02 0.00 -1.38 0.00 0.00 54.79 51.48 3dkl n ASP 313 Cb 0.52 0.10 -0.01 0.00 -1.04 0.00 0.00 41.12 40.69 3dkl n ASP 313 CO 0.00 0.00 0.00 -0.94 -0.82 0.00 0.00 177.20 175.44 3dkl s SER 314 N -1.54 -0.10 0.00 1.67 1.04 -1.26 -4.84 113.70 108.66 3dkl s SER 314 Ca 0.14 -0.05 0.00 0.00 0.48 0.00 0.00 55.95 56.51 3dkl s SER 314 Cb 0.20 0.15 0.00 0.00 0.10 0.00 0.00 66.02 66.47 3dkl s SER 314 CO -0.07 -0.25 0.00 0.61 0.98 0.00 0.00 173.24 174.50 3dkl n GLY 315 N -0.24 -0.84 3.67 7.32 0.00 -1.26 -4.83 105.19 109.01 3dkl n GLY 315 Ca -0.03 -1.69 -0.43 0.00 0.00 0.00 0.00 46.02 43.87 3dkl n GLY 315 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3dkl n ASN 316 N -1.18 4.00 -0.17 1.61 5.15 -1.26 -4.88 115.26 118.53 3dkl n ASN 316 Ca 0.00 0.94 -0.03 0.00 -0.60 0.00 0.00 54.58 54.89 3dkl n ASN 316 Cb 0.00 -1.50 0.06 0.00 -0.53 0.00 0.00 39.78 37.81 3dkl n ASN 316 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 3dkl h PRO 317 N 9.80 0.38 -0.01 1.20 0.11 -1.88 -0.65 132.00 140.95 3dkl h PRO 317 Ca -0.49 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.60 3dkl h PRO 317 Cb 1.24 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.27 3dkl h PRO 317 CO 0.94 0.25 0.00 1.25 -0.21 0.00 0.00 178.00 180.23 3dkl h LEU 318 N 0.39 0.01 -0.98 2.35 6.46 -1.92 -1.75 115.31 119.88 3dkl h LEU 318 Ca 0.24 -0.25 -0.01 0.00 -0.12 0.00 0.00 57.88 57.74 3dkl h LEU 318 Cb 0.24 -0.00 -0.04 0.00 -0.73 0.00 0.00 40.66 40.13 3dkl h LEU 318 CO -0.23 0.26 0.50 0.44 -0.62 0.00 0.00 178.44 178.79 3dkl h ASP 319 N -0.24 1.08 -0.00 1.25 3.32 -1.88 -2.03 116.42 117.91 3dkl h ASP 319 Ca 0.00 -0.08 -0.00 0.00 0.02 0.00 0.00 57.03 56.97 3dkl h ASP 319 Cb 0.25 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.53 3dkl h ASP 319 CO 0.00 0.85 -0.00 0.74 -1.72 0.00 0.00 179.24 179.11 3dkl h THR 320 N 1.22 1.42 -0.46 0.35 2.02 -1.09 -1.79 112.91 114.59 3dkl h THR 320 Ca 0.31 -1.23 0.09 0.00 0.77 0.00 0.00 66.41 66.35 3dkl h THR 320 Cb -0.01 2.24 -0.07 0.00 -1.74 0.00 0.00 68.15 68.58 3dkl h THR 320 CO -0.05 0.32 0.02 0.58 0.37 0.00 0.00 175.52 176.75 3dkl h VAL 321 N -0.51 0.66 -0.35 3.16 2.07 -1.19 -0.28 116.25 119.81 3dkl h VAL 321 Ca 0.00 -0.05 -0.04 0.00 0.82 0.00 0.00 66.70 67.43 3dkl h VAL 321 Cb 0.53 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 3dkl h VAL 321 CO 0.00 0.02 0.03 -0.07 0.02 0.00 0.00 177.57 177.57 3dkl h LEU 322 N 0.13 0.50 0.06 2.57 3.38 -1.24 -0.10 115.31 120.62 3dkl h LEU 322 Ca 0.23 -0.09 -0.28 0.00 0.09 0.00 0.00 57.88 57.83 3dkl h LEU 322 Cb 0.33 -0.13 0.03 0.00 0.09 0.00 0.00 40.66 40.98 3dkl h LEU 322 CO -0.37 0.55 -1.16 0.50 0.09 0.00 0.00 178.44 178.05 3dkl h LYS 323 N 0.52 0.65 -0.28 1.13 3.64 -0.95 -0.74 116.57 120.54 3dkl h LYS 323 Ca 0.11 -0.79 0.02 0.00 -1.27 0.00 0.00 60.65 58.73 3dkl h LYS 323 Cb 0.29 0.25 -0.03 0.00 -0.41 0.00 0.00 32.23 32.33 3dkl h LYS 323 CO 0.01 1.35 0.12 0.28 -2.27 0.00 0.00 179.45 178.94 3dkl h VAL 324 N 0.32 0.97 -0.61 2.00 2.07 -0.89 -1.11 116.25 119.00 3dkl h VAL 324 Ca -0.16 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.27 3dkl h VAL 324 Cb 1.82 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 32.24 3dkl h VAL 324 CO 0.22 0.05 0.39 -0.07 0.02 0.00 0.00 177.57 178.18 3dkl h LEU 325 N 0.27 0.71 -0.65 2.57 3.38 -0.90 -1.27 115.31 119.41 3dkl h LEU 325 Ca 0.12 -0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.11 3dkl h LEU 325 Cb 0.06 -0.18 -0.05 0.00 0.09 0.00 0.00 40.66 40.57 3dkl h LEU 325 CO -0.10 0.53 0.36 -0.08 0.09 0.00 0.00 178.44 179.24 3dkl h GLU 326 N 0.83 0.64 0.40 1.13 4.81 -0.90 0.72 114.58 122.21 3dkl h GLU 326 Ca 0.22 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.39 3dkl h GLU 326 Cb -0.07 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.17 3dkl h GLU 326 CO -0.05 0.42 -0.19 0.82 -0.73 0.00 0.00 179.01 179.28 3dkl h ILE 327 N 0.66 0.61 -0.54 2.32 2.04 -0.87 -2.59 117.51 119.13 3dkl h ILE 327 Ca 0.29 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 66.04 3dkl h ILE 327 Cb 0.19 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.90 3dkl h ILE 327 CO -0.18 0.02 0.26 -0.07 0.00 0.00 0.00 178.15 178.18 3dkl h LEU 328 N -0.60 0.68 -1.35 1.44 3.38 -1.14 -2.05 115.31 115.68 3dkl h LEU 328 Ca -0.06 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.85 3dkl h LEU 328 Cb 0.45 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.02 3dkl h LEU 328 CO 0.09 0.58 0.00 1.23 0.09 0.00 0.00 178.44 180.43 3dkl h GLY 329 N 0.86 0.00 1.21 0.83 0.00 -0.67 0.07 103.07 105.38 3dkl h GLY 329 Ca 0.19 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.45 3dkl h GLY 329 CO -0.03 0.00 -0.98 0.50 0.00 0.00 0.00 176.54 176.03 3dkl h LYS 330 N 0.00 0.00 0.00 4.80 1.57 -1.00 -3.38 116.57 118.56 3dkl h LYS 330 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dkl h LYS 330 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.84 3dkl h LYS 330 CO 0.00 0.15 -1.44 1.63 -0.57 0.00 0.00 179.45 179.22 3dkl n LYS 331 N -2.85 0.39 -4.24 3.15 4.76 -0.85 -4.98 118.16 113.53 3dkl n LYS 331 Ca -0.03 -0.08 -0.19 0.00 -2.87 0.00 0.00 58.31 55.14 3dkl n LYS 331 Cb 0.67 -1.55 -0.11 0.00 -1.84 0.00 0.00 35.03 32.19 3dkl n LYS 331 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3dkl s PHE 332 N -3.29 1.45 -0.36 2.13 0.40 -0.04 -5.01 117.98 113.25 3dkl s PHE 332 Ca -0.00 -0.51 -0.28 0.00 -0.60 0.00 0.00 56.93 55.53 3dkl s PHE 332 Cb 0.14 -0.77 -0.03 0.00 0.51 0.00 0.00 43.02 42.87 3dkl s PHE 332 CO 0.87 0.15 1.98 -1.25 0.70 0.00 0.00 175.22 177.67 3dkl s PRO 333 N -2.42 3.04 0.12 0.24 0.04 -1.26 -4.64 135.00 130.10 3dkl s PRO 333 Ca 0.07 1.44 -0.23 0.00 0.04 0.00 0.00 61.00 62.33 3dkl s PRO 333 Cb -0.06 -4.31 -0.07 0.00 0.04 0.00 0.00 34.50 30.09 3dkl s PRO 333 CO 0.03 -2.21 0.69 0.08 0.04 0.00 0.00 177.00 175.63 3dkl s VAL 334 N 8.17 4.55 0.45 -0.36 1.01 -1.26 -3.86 120.40 129.10 3dkl s VAL 334 Ca 0.85 1.51 0.08 0.00 0.00 0.00 0.00 61.98 64.41 3dkl s VAL 334 Cb -0.23 -4.04 -0.00 0.00 0.00 0.00 0.00 36.38 32.11 3dkl s VAL 334 CO 0.31 0.52 0.43 0.42 0.00 0.00 0.00 175.10 176.78 3dkl s THR 335 N -1.01 2.50 -0.18 3.92 -4.23 -0.37 -4.94 115.64 111.33 3dkl s THR 335 Ca 0.33 -1.31 0.01 0.00 -1.18 0.00 0.00 61.69 59.54 3dkl s THR 335 Cb -0.21 -2.81 0.02 0.00 1.34 0.00 0.00 72.50 70.83 3dkl s THR 335 CO 0.23 0.00 -0.19 -0.70 -0.54 0.00 0.00 174.62 173.42 3dkl s GLU 336 N -4.21 3.02 0.94 3.99 2.12 -1.26 -0.66 118.70 122.63 3dkl s GLU 336 Ca 0.48 -0.82 -0.16 0.00 0.36 0.00 0.00 54.97 54.83 3dkl s GLU 336 Cb -0.04 -2.59 0.22 0.00 0.26 0.00 0.00 34.13 31.99 3dkl s GLU 336 CO 0.28 -0.19 1.10 0.27 -0.54 0.00 0.00 175.26 176.18 3dkl n ASN 337 N 4.58 -0.62 0.04 -1.70 0.23 -0.18 -4.84 115.26 112.76 3dkl n ASN 337 Ca -0.21 -1.31 0.09 0.00 -0.53 0.00 0.00 54.58 52.62 3dkl n ASN 337 Cb 0.50 -0.89 0.38 0.00 -2.08 0.00 0.00 39.78 37.69 3dkl n ASN 337 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 3dkl n SER 338 N -4.06 0.19 -0.40 0.53 3.41 -1.26 -0.83 113.62 111.19 3dkl n SER 338 Ca 0.14 0.54 0.12 0.00 -0.26 0.00 0.00 58.87 59.42 3dkl n SER 338 Cb 0.51 -0.58 0.25 0.00 -0.26 0.00 0.00 64.21 64.13 3dkl n SER 338 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3dkl n LYS 339 N -1.70 1.15 -0.46 4.33 4.01 -1.26 -4.95 118.16 119.29 3dkl n LYS 339 Ca 0.03 -0.81 0.00 0.00 -0.51 0.00 0.00 58.31 57.02 3dkl n LYS 339 Cb 0.20 -1.48 0.00 0.00 -0.51 0.00 0.00 35.03 33.24 3dkl n LYS 339 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3dkl n GLY 340 N 1.35 0.75 3.92 0.72 0.00 -0.01 -5.04 105.19 106.88 3dkl n GLY 340 Ca 0.12 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.83 3dkl n GLY 340 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dkl s TYR 341 N -2.36 3.52 0.32 1.61 1.51 -1.26 -4.80 117.35 115.90 3dkl s TYR 341 Ca 0.00 0.30 -0.27 0.00 -1.01 0.00 0.00 57.07 56.09 3dkl s TYR 341 Cb 0.00 -1.79 -0.09 0.00 -0.11 0.00 0.00 41.96 39.96 3dkl s TYR 341 CO 0.00 0.58 1.00 0.15 -1.11 0.00 0.00 175.55 176.16 3dkl s LYS 342 N -2.48 4.52 -0.06 -0.62 1.02 0.11 -1.01 119.74 121.21 3dkl s LYS 342 Ca 0.35 1.48 -0.01 0.00 0.02 0.00 0.00 55.97 57.81 3dkl s LYS 342 Cb -0.13 -2.86 0.03 0.00 -0.52 0.00 0.00 37.83 34.34 3dkl s LYS 342 CO 0.27 0.19 -0.00 -1.17 -0.92 0.00 0.00 175.35 173.72 3dkl s LEU 343 N -1.98 0.79 0.89 3.17 2.96 0.16 -1.31 118.68 123.36 3dkl s LEU 343 Ca 0.50 -0.08 -0.11 0.00 -0.22 0.00 0.00 54.13 54.22 3dkl s LEU 343 Cb -0.23 -0.40 0.12 0.00 0.50 0.00 0.00 46.19 46.19 3dkl s LEU 343 CO 0.29 -0.16 1.09 -0.76 -1.32 0.00 0.00 176.35 175.50 3dkl s LEU 344 N 1.65 2.43 0.76 -0.68 1.43 -1.26 -1.24 118.68 121.77 3dkl s LEU 344 Ca -0.00 1.67 -0.14 0.00 -1.03 0.00 0.00 54.13 54.63 3dkl s LEU 344 Cb -0.13 -4.12 0.06 0.00 0.03 0.00 0.00 46.19 42.03 3dkl s LEU 344 CO -0.04 -2.67 1.21 -2.84 0.23 0.00 0.00 176.35 172.25 3dkl s PRO 345 N -4.85 1.93 0.63 1.29 0.02 -1.25 -4.83 135.00 127.94 3dkl s PRO 345 Ca 0.64 1.78 0.42 0.00 0.02 0.00 0.00 61.00 63.85 3dkl s PRO 345 Cb -0.19 -1.81 2.18 0.00 0.02 0.00 0.00 34.50 34.71 3dkl s PRO 345 CO 0.57 -2.00 2.27 -1.00 -0.33 0.00 0.00 177.00 176.52 3dkl h PRO 346 N -0.53 0.00 -0.02 5.54 0.13 -1.95 -1.92 132.00 133.24 3dkl h PRO 346 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3dkl h PRO 346 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 3dkl h PRO 346 CO 0.48 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.73 3dkl n TYR 347 N -3.05 0.02 -3.85 1.56 0.18 -1.26 -4.60 117.16 106.16 3dkl n TYR 347 Ca -0.02 -0.01 -0.18 0.00 1.88 0.00 0.00 57.90 59.56 3dkl n TYR 347 Cb 0.12 0.00 -0.17 0.00 -0.38 0.00 0.00 39.34 38.91 3dkl n TYR 347 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 3dkl s LEU 348 N -1.86 0.89 0.24 -3.48 2.96 -0.72 -0.91 118.68 115.79 3dkl s LEU 348 Ca 0.40 -0.01 -0.04 0.00 -0.22 0.00 0.00 54.13 54.25 3dkl s LEU 348 Cb 0.19 -0.23 -0.02 0.00 0.50 0.00 0.00 46.19 46.63 3dkl s LEU 348 CO 0.32 -0.14 0.29 -0.13 -1.32 0.00 0.00 176.35 175.37 3dkl s ARG 349 N 1.37 1.44 -0.03 1.98 1.81 -0.00 -4.57 118.95 120.94 3dkl s ARG 349 Ca -0.05 -1.55 0.04 0.00 -1.72 0.00 0.00 55.73 52.45 3dkl s ARG 349 Cb -0.13 0.36 -0.00 0.00 -0.45 0.00 0.00 34.95 34.72 3dkl s ARG 349 CO -0.03 -0.54 -0.16 0.08 -0.68 0.00 0.00 175.30 173.98 3dkl s VAL 350 N -3.93 1.29 -0.11 3.52 1.01 -0.90 -0.33 120.40 120.95 3dkl s VAL 350 Ca 0.33 -0.66 0.02 0.00 0.00 0.00 0.00 61.98 61.68 3dkl s VAL 350 Cb 0.03 -1.10 0.01 0.00 0.00 0.00 0.00 36.38 35.32 3dkl s VAL 350 CO 0.13 0.37 -0.18 -0.51 0.00 0.00 0.00 175.10 174.92 3dkl s ILE 351 N -0.06 1.66 -0.32 2.22 2.07 -0.59 -1.26 121.20 124.93 3dkl s ILE 351 Ca -0.01 -0.76 -0.11 0.00 -1.41 0.00 0.00 60.65 58.36 3dkl s ILE 351 Cb -0.09 -1.49 -0.02 0.00 0.13 0.00 0.00 42.46 40.99 3dkl s ILE 351 CO 0.01 0.47 0.19 -1.58 -1.91 0.00 0.00 174.94 172.12 3dkl s GLN 352 N 0.76 3.49 -0.01 3.50 2.00 -0.34 -3.65 119.66 125.41 3dkl s GLN 352 Ca -0.11 -0.63 0.01 0.00 -2.00 0.00 0.00 55.36 52.63 3dkl s GLN 352 Cb -0.16 -3.66 0.02 0.00 0.80 0.00 0.00 33.01 30.00 3dkl s GLN 352 CO 0.01 -0.39 0.94 0.41 -0.50 0.00 0.00 175.29 175.76 3dkl n GLY 353 N 5.04 2.21 3.27 2.59 0.00 -1.26 -1.33 105.19 115.71 3dkl n GLY 353 Ca -0.13 -0.06 -0.32 0.00 0.00 0.00 0.00 46.02 45.50 3dkl n GLY 353 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3dkl s ASP 354 N -0.96 3.26 -1.51 1.61 2.15 -1.26 -4.68 116.67 115.27 3dkl s ASP 354 Ca 0.02 -0.49 0.00 0.00 0.43 0.00 0.00 52.55 52.51 3dkl s ASP 354 Cb 0.01 -1.19 0.00 0.00 -0.30 0.00 0.00 42.92 41.44 3dkl s ASP 354 CO 0.00 0.20 0.00 0.61 -0.17 0.00 0.00 175.17 175.81 3dkl n GLY 355 N 3.24 0.79 3.60 2.66 0.00 -1.26 -4.81 105.19 109.41 3dkl n GLY 355 Ca -0.18 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.16 3dkl n GLY 355 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dkl s VAL 356 N -2.66 4.81 0.35 1.61 1.01 -1.26 -4.75 120.40 119.51 3dkl s VAL 356 Ca 0.00 1.01 0.07 0.00 0.00 0.00 0.00 61.98 63.06 3dkl s VAL 356 Cb 0.00 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 32.22 3dkl s VAL 356 CO 0.00 -0.28 0.26 -0.90 0.00 0.00 0.00 175.10 174.18 3dkl n ASP 357 N 6.19 -0.34 -0.24 3.32 5.68 -1.26 -4.13 116.55 125.77 3dkl n ASP 357 Ca 0.02 -3.21 0.05 0.00 -0.50 0.00 0.00 54.79 51.15 3dkl n ASP 357 Cb 0.48 1.56 0.29 0.00 -1.14 0.00 0.00 41.12 42.31 3dkl n ASP 357 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3dkl h ILE 358 N 2.00 1.06 -0.03 2.12 2.10 -1.94 0.15 117.51 122.96 3dkl h ILE 358 Ca -0.25 -0.31 -0.01 0.00 1.08 0.00 0.00 64.86 65.37 3dkl h ILE 358 Cb 1.21 0.06 -0.00 0.00 -1.09 0.00 0.00 36.82 37.01 3dkl h ILE 358 CO 0.38 0.17 -0.01 0.78 -1.08 0.00 0.00 178.15 178.39 3dkl h ASN 359 N 0.92 0.06 0.59 2.19 2.35 -1.97 -2.67 115.58 117.05 3dkl h ASN 359 Ca 0.35 -0.37 -0.12 0.00 -0.55 0.00 0.00 56.30 55.60 3dkl h ASN 359 Cb 0.19 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.53 3dkl h ASN 359 CO -0.12 0.42 -0.58 0.71 -1.65 0.00 0.00 177.43 176.21 3dkl h THR 360 N -0.30 1.41 -0.64 2.81 1.35 -1.79 -1.28 112.91 114.47 3dkl h THR 360 Ca 0.01 -2.00 -0.00 0.00 -0.55 0.00 0.00 66.41 63.86 3dkl h THR 360 Cb 0.39 2.08 -0.03 0.00 -1.73 0.00 0.00 68.15 68.86 3dkl h THR 360 CO 0.00 0.57 0.39 0.25 -0.25 0.00 0.00 175.52 176.49 3dkl h LEU 361 N 0.00 0.76 -0.31 3.87 6.46 -0.74 -0.39 115.31 124.96 3dkl h LEU 361 Ca -0.01 -0.05 -0.00 0.00 -0.12 0.00 0.00 57.88 57.70 3dkl h LEU 361 Cb 1.04 -0.19 -0.01 0.00 -0.73 0.00 0.00 40.66 40.76 3dkl h LEU 361 CO 0.08 0.59 0.19 -0.61 -0.62 0.00 0.00 178.44 178.06 3dkl h GLN 362 N 0.87 0.42 -0.53 1.25 5.75 -1.25 -1.52 115.11 120.10 3dkl h GLN 362 Ca 0.23 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.75 3dkl h GLN 362 Cb -0.04 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 28.38 3dkl h GLN 362 CO -0.04 0.32 0.25 1.49 -2.65 0.00 0.00 178.83 178.20 3dkl h GLU 363 N 0.40 0.47 -0.03 1.69 4.81 -0.89 -1.32 114.58 119.71 3dkl h GLU 363 Ca 0.11 -0.03 -0.00 0.00 -0.13 0.00 0.00 59.36 59.31 3dkl h GLU 363 Cb 0.01 -0.11 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 3dkl h GLU 363 CO -0.02 0.31 0.00 0.82 -0.73 0.00 0.00 179.01 179.40 3dkl h ILE 364 N 0.49 1.23 -0.49 2.32 2.04 -0.95 -0.64 117.51 121.51 3dkl h ILE 364 Ca 0.24 -0.69 -0.07 0.00 1.00 0.00 0.00 64.86 65.33 3dkl h ILE 364 Cb 0.18 1.64 -0.02 0.00 -0.74 0.00 0.00 36.82 37.88 3dkl h ILE 364 CO -0.18 0.19 0.01 -0.37 0.00 0.00 0.00 178.15 177.79 3dkl h VAL 365 N -0.23 1.24 -0.09 1.67 -1.51 -1.22 0.15 116.25 116.27 3dkl h VAL 365 Ca 0.01 -1.01 -0.01 0.00 -1.23 0.00 0.00 66.70 64.46 3dkl h VAL 365 Cb 0.30 0.86 -0.00 0.00 -2.13 0.00 0.00 31.29 30.31 3dkl h VAL 365 CO 0.00 0.36 0.02 -0.08 -1.23 0.00 0.00 177.57 176.64 3dkl h GLU 366 N 0.77 0.14 -0.58 5.19 4.57 -1.23 -1.07 114.58 122.37 3dkl h GLU 366 Ca 0.15 -0.04 -0.02 0.00 -1.18 0.00 0.00 59.36 58.27 3dkl h GLU 366 Cb 0.45 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.00 3dkl h GLU 366 CO 0.02 0.34 0.26 0.78 -1.18 0.00 0.00 179.01 179.23 3dkl h GLY 367 N -0.08 0.88 0.96 1.92 0.00 -0.73 -0.85 103.07 105.17 3dkl h GLY 367 Ca 0.03 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 3dkl h GLY 367 CO 0.00 0.40 -0.23 -0.33 0.00 0.00 0.00 176.54 176.38 3dkl h MET 368 N 0.82 -0.60 -0.87 4.80 2.86 -0.87 -2.36 114.93 118.71 3dkl h MET 368 Ca 0.20 0.04 0.14 0.00 -2.06 0.00 0.00 59.70 58.03 3dkl h MET 368 Cb 0.11 0.14 -0.09 0.00 0.06 0.00 0.00 31.60 31.82 3dkl h MET 368 CO -0.02 -0.40 0.47 -0.22 1.06 0.00 0.00 176.91 177.80 3dkl h LYS 369 N -0.62 0.66 -0.90 1.72 3.64 -0.74 -0.60 116.57 119.72 3dkl h LYS 369 Ca -0.06 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.33 3dkl h LYS 369 Cb 0.49 -0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 32.11 3dkl h LYS 369 CO 0.08 0.44 0.59 0.37 -2.27 0.00 0.00 179.45 178.66 3dkl h GLN 370 N 0.68 1.07 -0.47 1.90 5.75 -1.07 -1.41 115.11 121.56 3dkl h GLN 370 Ca 0.47 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.91 3dkl h GLN 370 Cb 0.63 -0.24 0.00 0.00 1.07 0.00 0.00 27.48 28.94 3dkl h GLN 370 CO -0.34 0.71 0.00 1.63 -2.65 0.00 0.00 178.83 178.17 3dkl n LYS 371 N -4.46 2.12 -2.05 1.69 4.76 -0.34 -4.94 118.16 114.94 3dkl n LYS 371 Ca 0.12 -1.64 -0.12 0.00 -2.87 0.00 0.00 58.31 53.80 3dkl n LYS 371 Cb 0.13 -1.39 -0.02 0.00 -1.84 0.00 0.00 35.03 31.92 3dkl n LYS 371 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 3dkl n MET 372 N 0.80 -0.95 -3.55 1.97 2.81 -0.53 -4.96 117.12 112.70 3dkl n MET 372 Ca 0.15 0.67 -0.36 0.00 -1.81 0.00 0.00 57.70 56.34 3dkl n MET 372 Cb 0.41 -4.82 -0.07 0.00 -0.71 0.00 0.00 33.22 28.03 3dkl n MET 372 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 3dkl s TRP 373 N -2.58 3.43 0.32 2.03 0.52 -0.65 0.03 118.94 122.04 3dkl s TRP 373 Ca 0.00 0.53 -0.29 0.00 0.02 0.00 0.00 56.10 56.36 3dkl s TRP 373 Cb 0.00 -2.33 -0.10 0.00 -1.15 0.00 0.00 33.47 29.88 3dkl s TRP 373 CO 0.00 0.20 1.40 0.45 0.02 0.00 0.00 176.95 179.02 3dkl s SER 374 N 0.58 6.62 0.20 2.95 0.15 -0.43 -3.95 113.70 119.82 3dkl s SER 374 Ca 0.15 2.78 0.17 0.00 0.70 0.00 0.00 55.95 59.75 3dkl s SER 374 Cb -0.13 -2.65 0.83 0.00 -1.71 0.00 0.00 66.02 62.36 3dkl s SER 374 CO 0.04 -0.68 1.53 -0.38 1.20 0.00 0.00 173.24 174.94 3dkl n ILE 375 N 1.16 1.16 -0.03 6.45 2.08 -1.26 -1.71 119.36 127.21 3dkl n ILE 375 Ca 0.02 0.49 0.20 0.00 0.56 0.00 0.00 62.75 64.02 3dkl n ILE 375 Cb 0.41 -1.44 0.67 0.00 -0.75 0.00 0.00 39.64 38.53 3dkl n ILE 375 CO 0.00 0.00 0.00 -0.33 0.56 0.00 0.00 176.55 176.78 3dkl h GLU 376 N 0.00 0.05 0.00 0.38 5.08 -1.90 -2.83 114.58 115.35 3dkl h GLU 376 Ca 0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3dkl h GLU 376 Cb 0.13 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.37 3dkl h GLU 376 CO 0.00 0.03 0.00 -0.91 -1.00 0.00 0.00 179.01 177.13 3dkl h ASN 377 N 0.05 0.00 -4.10 1.42 2.35 -1.66 -3.46 115.58 110.18 3dkl h ASN 377 Ca 0.28 0.00 -0.64 0.00 -0.55 0.00 0.00 56.30 55.39 3dkl h ASN 377 Cb 1.05 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 39.19 3dkl h ASN 377 CO -0.02 0.00 -0.86 -0.51 -1.65 0.00 0.00 177.43 174.40 3dkl s ILE 378 N -3.40 2.00 0.18 2.81 1.10 -1.07 -2.12 121.20 120.71 3dkl s ILE 378 Ca 0.04 -1.57 0.03 0.00 -0.51 0.00 0.00 60.65 58.65 3dkl s ILE 378 Cb 0.09 -1.77 -0.05 0.00 0.15 0.00 0.00 42.46 40.88 3dkl s ILE 378 CO 0.52 0.10 -0.03 0.00 -2.11 0.00 0.00 174.94 173.42 3dkl s ALA 379 N -1.02 1.50 0.12 1.50 0.00 -0.39 -4.98 121.76 118.50 3dkl s ALA 379 Ca 0.11 -1.60 0.09 0.00 0.00 0.00 0.00 51.96 50.56 3dkl s ALA 379 Cb -0.10 0.36 -0.04 0.00 0.00 0.00 0.00 23.12 23.35 3dkl s ALA 379 CO 0.04 -0.23 -0.23 -0.06 0.00 0.00 0.00 175.76 175.29 3dkl s PHE 380 N -3.49 1.98 -0.03 0.00 0.40 0.08 -1.19 117.98 115.73 3dkl s PHE 380 Ca 0.23 -0.41 0.05 0.00 -0.60 0.00 0.00 56.93 56.20 3dkl s PHE 380 Cb 0.05 -1.06 -0.01 0.00 0.51 0.00 0.00 43.02 42.51 3dkl s PHE 380 CO 0.04 0.28 -0.18 0.20 0.70 0.00 0.00 175.22 176.26 3dkl s GLY 381 N -2.09 0.90 -0.05 4.36 0.00 -0.44 -0.35 107.32 109.65 3dkl s GLY 381 Ca 0.11 -0.74 -0.03 0.00 0.00 0.00 0.00 44.72 44.06 3dkl s GLY 381 CO 0.05 -0.52 0.12 -0.45 0.00 0.00 0.00 173.10 172.30 3dkl s SER 382 N -0.23 -0.08 0.00 1.64 0.15 -0.39 -4.21 113.70 110.58 3dkl s SER 382 Ca 0.02 0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.91 3dkl s SER 382 Cb -0.09 0.15 0.00 0.00 -1.71 0.00 0.00 66.02 64.37 3dkl s SER 382 CO 0.01 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 174.94 3dkl n GLY 383 N 3.91 -0.00 0.25 9.45 0.00 -1.26 -0.63 105.19 116.91 3dkl n GLY 383 Ca -0.23 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.82 3dkl n GLY 383 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dkl h GLY 384 N 0.00 0.93 0.75 -0.02 0.00 -1.86 -0.68 103.07 102.20 3dkl h GLY 384 Ca 0.00 -0.06 0.09 0.00 0.00 0.00 0.00 47.33 47.37 3dkl h GLY 384 CO 0.00 -0.14 0.56 -1.33 0.00 0.00 0.00 176.54 175.64 3dkl h GLY 385 N 0.31 1.23 0.75 4.60 0.00 -1.89 0.57 103.07 108.63 3dkl h GLY 385 Ca 0.37 -0.35 -0.24 0.00 0.00 0.00 0.00 47.33 47.10 3dkl h GLY 385 CO -0.44 0.20 -1.13 -2.00 0.00 0.00 0.00 176.54 173.17 3dkl h LEU 386 N 0.86 0.51 0.00 3.11 5.85 -1.62 -3.42 115.31 120.61 3dkl h LEU 386 Ca 0.40 -0.92 0.00 0.00 0.84 0.00 0.00 57.88 58.20 3dkl h LEU 386 Cb 0.40 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.27 3dkl h LEU 386 CO -0.17 1.53 -0.86 0.18 -0.34 0.00 0.00 178.44 178.78 3dkl n LEU 387 N -3.98 0.07 0.00 2.25 4.77 -0.33 -4.82 117.00 114.96 3dkl n LEU 387 Ca -0.18 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.63 3dkl n LEU 387 Cb 0.90 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.99 3dkl n LEU 387 CO 0.49 0.02 -0.44 1.67 -1.33 0.00 0.00 177.39 177.79 3dkl n GLN 388 N -1.46 0.45 -1.55 3.23 -0.06 -0.12 -4.83 117.38 113.03 3dkl n GLN 388 Ca -0.00 0.00 -0.40 0.00 -2.00 0.00 0.00 57.00 54.60 3dkl n GLN 388 Cb 0.10 -0.94 -0.02 0.00 -4.06 0.00 0.00 30.24 25.32 3dkl n GLN 388 CO 0.00 0.00 0.00 1.17 -0.20 0.00 0.00 177.06 178.03 3dkl n LYS 389 N -2.32 3.65 -3.78 3.69 4.81 0.18 -4.77 118.16 119.62 3dkl n LYS 389 Ca 0.00 -2.54 -0.13 0.00 -0.87 0.00 0.00 58.31 54.77 3dkl n LYS 389 Cb 0.44 -2.89 -0.11 0.00 0.02 0.00 0.00 35.03 32.50 3dkl n LYS 389 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 3dkl s LEU 390 N 0.25 1.01 0.30 3.14 1.43 -1.26 -4.92 118.68 118.63 3dkl s LEU 390 Ca 0.61 0.46 0.06 0.00 -1.03 0.00 0.00 54.13 54.23 3dkl s LEU 390 Cb 0.17 0.93 -0.06 0.00 0.03 0.00 0.00 46.19 47.25 3dkl s LEU 390 CO -0.07 -0.13 -0.01 0.42 0.23 0.00 0.00 176.35 176.79 3dkl s THR 391 N -0.05 1.50 0.35 5.49 -4.23 -1.26 -5.00 115.64 112.44 3dkl s THR 391 Ca -0.02 -2.07 0.36 0.00 -1.18 0.00 0.00 61.69 58.78 3dkl s THR 391 Cb -0.02 -2.61 0.36 0.00 1.34 0.00 0.00 72.50 71.57 3dkl s THR 391 CO 0.01 -0.18 2.11 -0.09 -0.54 0.00 0.00 174.62 175.93 3dkl h ARG 392 N 2.19 0.00 0.00 3.99 2.43 -1.95 -2.43 114.38 118.61 3dkl h ARG 392 Ca -0.40 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.77 3dkl h ARG 392 Cb 1.24 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 3dkl h ARG 392 CO 0.69 0.00 -0.50 -0.44 -1.51 0.00 0.00 179.97 178.22 3dkl h ASP 393 N 0.00 0.00 -0.63 -3.80 3.32 -1.94 -2.09 116.42 111.28 3dkl h ASP 393 Ca 0.00 -0.13 0.04 0.00 0.02 0.00 0.00 57.03 56.96 3dkl h ASP 393 Cb 0.01 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 39.51 3dkl h ASP 393 CO 0.00 0.06 0.36 0.25 -1.72 0.00 0.00 179.24 178.20 3dkl h LEU 394 N 0.00 0.57 -3.34 1.55 5.85 -1.84 -1.54 115.31 116.56 3dkl h LEU 394 Ca 0.00 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.74 3dkl h LEU 394 Cb 0.79 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 41.72 3dkl h LEU 394 CO 0.00 0.38 0.00 0.18 -0.34 0.00 0.00 178.44 178.66 3dkl n LEU 395 N -4.77 4.64 -4.00 2.25 4.77 -1.26 -4.97 117.00 113.66 3dkl n LEU 395 Ca 0.07 -2.85 -0.31 0.00 -0.03 0.00 0.00 56.01 52.89 3dkl n LEU 395 Cb 0.12 -0.58 0.00 0.00 -2.33 0.00 0.00 43.42 40.63 3dkl n LEU 395 CO 0.31 0.68 0.00 -3.20 -1.33 0.00 0.00 177.39 173.85 3dkl n ASN 396 N 0.19 -3.39 -4.70 -1.43 5.15 -0.58 -3.10 115.26 107.39 3dkl n ASN 396 Ca 0.24 -0.89 -0.42 0.00 -0.60 0.00 0.00 54.58 52.91 3dkl n ASN 396 Cb 0.98 -3.42 -0.03 0.00 -0.53 0.00 0.00 39.78 36.78 3dkl n ASN 396 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3dkl s SER 398 N 1.76 -0.24 -0.10 0.00 0.01 -0.74 -4.90 113.70 109.49 3dkl s SER 398 Ca 0.70 0.11 0.00 0.00 1.31 0.00 0.00 55.95 58.07 3dkl s SER 398 Cb -0.40 0.35 0.02 0.00 0.21 0.00 0.00 66.02 66.21 3dkl s SER 398 CO 0.31 -0.51 -0.08 0.12 0.41 0.00 0.00 173.24 173.48 3dkl s PHE 399 N -1.60 1.43 0.03 2.43 5.36 -1.26 -1.63 117.98 122.74 3dkl s PHE 399 Ca -0.11 -0.66 0.03 0.00 -0.96 0.00 0.00 56.93 55.23 3dkl s PHE 399 Cb -0.04 -1.16 -0.02 0.00 -0.34 0.00 0.00 43.02 41.47 3dkl s PHE 399 CO 0.03 -0.44 -0.09 0.15 -1.46 0.00 0.00 175.22 173.41 3dkl s LYS 400 N 1.43 0.65 -0.00 10.12 -0.14 -0.56 -4.95 119.74 126.28 3dkl s LYS 400 Ca -0.00 -0.60 -0.30 0.00 -1.36 0.00 0.00 55.97 53.70 3dkl s LYS 400 Cb -0.13 -0.56 -0.05 0.00 -1.68 0.00 0.00 37.83 35.40 3dkl s LYS 400 CO -0.05 0.13 1.35 0.00 -0.76 0.00 0.00 175.35 176.02 3dkl n SER 402 N 5.21 0.32 -3.65 0.00 3.41 -0.12 -4.27 113.62 114.52 3dkl n SER 402 Ca 0.12 -0.66 -0.12 0.00 -0.26 0.00 0.00 58.87 57.96 3dkl n SER 402 Cb 0.44 0.80 -0.08 0.00 -0.26 0.00 0.00 64.21 65.12 3dkl n SER 402 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3dkl s TYR 403 N -1.00 -0.82 0.04 7.33 5.04 -1.08 0.11 117.35 126.96 3dkl s TYR 403 Ca 0.01 1.87 0.00 0.00 -2.44 0.00 0.00 57.07 56.51 3dkl s TYR 403 Cb 0.02 0.36 -0.03 0.00 0.35 0.00 0.00 41.96 42.66 3dkl s TYR 403 CO 0.08 -0.40 -0.04 0.14 -1.34 0.00 0.00 175.55 173.98 3dkl s VAL 404 N 0.77 0.29 -0.20 3.14 -7.23 -0.80 -0.81 120.40 115.57 3dkl s VAL 404 Ca -0.03 -1.40 -0.02 0.00 -1.81 0.00 0.00 61.98 58.72 3dkl s VAL 404 Cb -0.05 -0.96 0.00 0.00 0.56 0.00 0.00 36.38 35.93 3dkl s VAL 404 CO -0.06 -0.71 -0.11 -0.69 -0.31 0.00 0.00 175.10 173.22 3dkl s VAL 405 N -2.63 2.82 -0.08 1.32 1.01 -0.49 -0.21 120.40 122.15 3dkl s VAL 405 Ca -0.03 -0.69 0.01 0.00 0.00 0.00 0.00 61.98 61.27 3dkl s VAL 405 Cb -0.01 -2.24 0.02 0.00 0.00 0.00 0.00 36.38 34.14 3dkl s VAL 405 CO -0.05 0.48 -0.07 -0.89 0.00 0.00 0.00 175.10 174.57 3dkl s THR 406 N 1.29 0.87 -1.46 3.92 2.01 -0.84 -0.49 115.64 120.94 3dkl s THR 406 Ca 0.04 -0.26 -0.10 0.00 0.31 0.00 0.00 61.69 61.67 3dkl s THR 406 Cb -0.14 -0.87 0.05 0.00 0.01 0.00 0.00 72.50 71.55 3dkl s THR 406 CO -0.06 0.32 0.89 0.59 -0.69 0.00 0.00 174.62 175.67 3dkl n ASN 407 N 4.38 -5.38 0.00 3.53 3.02 0.25 -2.24 115.26 118.82 3dkl n ASN 407 Ca -0.18 -0.56 0.00 0.00 -0.03 0.00 0.00 54.58 53.81 3dkl n ASN 407 Cb 0.51 -4.30 0.00 0.00 -0.61 0.00 0.00 39.78 35.38 3dkl n ASN 407 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3dkl n GLY 408 N -1.67 0.26 3.56 7.41 0.00 -1.26 -5.00 105.19 108.49 3dkl n GLY 408 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 3dkl n GLY 408 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dkl s LEU 409 N 0.00 3.49 0.21 0.99 1.43 -0.95 -5.09 118.68 118.77 3dkl s LEU 409 Ca 0.00 -0.03 -0.30 0.00 -1.03 0.00 0.00 54.13 52.77 3dkl s LEU 409 Cb 0.00 -1.86 -0.08 0.00 0.03 0.00 0.00 46.19 44.28 3dkl s LEU 409 CO 0.00 0.18 1.03 -0.83 0.23 0.00 0.00 176.35 176.96 3dkl s GLY 410 N 0.31 3.01 0.00 -3.19 0.00 -1.26 -1.98 107.32 104.20 3dkl s GLY 410 Ca -0.01 0.74 0.03 0.00 0.00 0.00 0.00 44.72 45.49 3dkl s GLY 410 CO 0.02 1.45 -0.11 -0.26 0.00 0.00 0.00 173.10 174.20 3dkl s ILE 411 N -0.71 0.83 -0.24 0.90 -4.36 0.71 -4.98 121.20 113.35 3dkl s ILE 411 Ca 0.45 -0.53 -0.25 0.00 -0.26 0.00 0.00 60.65 60.06 3dkl s ILE 411 Cb -0.28 -0.71 -0.00 0.00 1.25 0.00 0.00 42.46 42.71 3dkl s ILE 411 CO 0.35 0.17 0.86 0.20 0.24 0.00 0.00 174.94 176.76 3dkl s ASN 412 N -0.41 6.87 0.19 4.36 0.01 -1.26 -1.90 114.94 122.80 3dkl s ASN 412 Ca 0.03 1.08 0.11 0.00 -0.71 0.00 0.00 52.86 53.37 3dkl s ASN 412 Cb -0.05 -2.45 -0.04 0.00 0.41 0.00 0.00 41.25 39.12 3dkl s ASN 412 CO -0.00 -0.53 -0.22 0.68 -1.51 0.00 0.00 177.10 175.52 3dkl s VAL 413 N 2.86 2.21 -0.04 1.60 -7.23 -0.34 -4.78 120.40 114.69 3dkl s VAL 413 Ca 0.36 -2.04 -0.30 0.00 -1.81 0.00 0.00 61.98 58.19 3dkl s VAL 413 Cb -0.15 -2.06 0.11 0.00 0.56 0.00 0.00 36.38 34.83 3dkl s VAL 413 CO 0.07 -0.20 1.06 0.72 -0.31 0.00 0.00 175.10 176.44 3dkl s PHE 414 N -1.87 -0.19 0.19 2.82 -0.12 -1.26 -4.14 117.98 113.40 3dkl s PHE 414 Ca 0.20 0.06 0.06 0.00 -0.05 0.00 0.00 56.93 57.21 3dkl s PHE 414 Cb -0.07 0.55 -0.04 0.00 -0.63 0.00 0.00 43.02 42.83 3dkl s PHE 414 CO 0.09 -0.44 0.09 -1.59 -0.05 0.00 0.00 175.22 173.32 3dkl s LYS 415 N -2.82 2.71 -0.48 1.99 -2.85 -1.26 -4.98 119.74 112.05 3dkl s LYS 415 Ca 0.09 -1.00 0.06 0.00 -1.00 0.00 0.00 55.97 54.12 3dkl s LYS 415 Cb -0.00 -2.51 0.22 0.00 -2.06 0.00 0.00 37.83 33.47 3dkl s LYS 415 CO -0.05 0.46 0.75 -3.47 0.10 0.00 0.00 175.35 173.14 3dkl n ASP 416 N -0.42 -2.54 -4.75 0.03 2.03 -1.26 -1.64 116.55 108.00 3dkl n ASP 416 Ca -0.09 -3.03 -0.41 0.00 0.52 0.00 0.00 54.79 51.78 3dkl n ASP 416 Cb 0.56 1.33 -0.02 0.00 -0.72 0.00 0.00 41.12 42.26 3dkl n ASP 416 CO 0.00 0.00 0.00 -2.84 -1.92 0.00 0.00 177.20 172.44 3dkl s PRO 417 N 0.48 4.29 0.21 -0.67 0.02 -1.26 -4.91 135.00 133.16 3dkl s PRO 417 Ca 0.32 2.28 -0.09 0.00 0.02 0.00 0.00 61.00 63.53 3dkl s PRO 417 Cb 0.13 -3.10 0.27 0.00 0.02 0.00 0.00 34.50 31.82 3dkl s PRO 417 CO -0.16 -0.36 1.78 -0.24 -0.33 0.00 0.00 177.00 177.69 3dkl h VAL 418 N 3.40 0.87 -0.04 3.83 3.04 -2.02 -2.45 116.25 122.89 3dkl h VAL 418 Ca -0.47 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.03 3dkl h VAL 418 Cb 1.22 0.27 0.00 0.00 -2.01 0.00 0.00 31.29 30.77 3dkl h VAL 418 CO 0.74 0.10 0.00 0.00 -1.01 0.00 0.00 177.57 177.40 3dkl n ALA 419 N -2.40 2.58 -3.21 3.17 0.00 -1.26 -4.52 120.51 114.88 3dkl n ALA 419 Ca 0.09 -0.41 -0.17 0.00 0.00 0.00 0.00 53.44 52.94 3dkl n ALA 419 Cb 0.23 -1.21 -0.06 0.00 0.00 0.00 0.00 19.45 18.41 3dkl n ALA 419 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 3dkl s ASP 420 N -1.91 0.54 0.56 0.00 -1.08 -0.92 -4.97 116.67 108.88 3dkl s ASP 420 Ca 0.38 -2.23 0.31 0.00 -0.52 0.00 0.00 52.55 50.49 3dkl s ASP 420 Cb 0.20 0.53 1.46 0.00 -1.46 0.00 0.00 42.92 43.65 3dkl s ASP 420 CO 0.32 -0.16 1.84 -0.65 0.52 0.00 0.00 175.17 177.04 3dkl h PRO 421 N 5.91 0.00 0.00 4.34 0.11 -1.79 -0.11 132.00 140.46 3dkl h PRO 421 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3dkl h PRO 421 Cb 1.01 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.12 3dkl h PRO 421 CO 0.22 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.10 3dkl n ASN 422 N -3.99 0.71 -0.81 -2.05 3.02 -1.26 -1.98 115.26 108.90 3dkl n ASN 422 Ca 0.16 0.65 0.10 0.00 -0.03 0.00 0.00 54.58 55.46 3dkl n ASN 422 Cb 0.94 -0.81 0.28 0.00 -0.61 0.00 0.00 39.78 39.58 3dkl n ASN 422 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3dkl n LYS 423 N -2.26 2.05 -1.72 3.52 5.02 -0.05 -4.87 118.16 119.84 3dkl n LYS 423 Ca 0.03 -1.60 -0.43 0.00 -2.02 0.00 0.00 58.31 54.29 3dkl n LYS 423 Cb 0.27 -1.42 -0.02 0.00 -0.02 0.00 0.00 35.03 33.84 3dkl n LYS 423 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 3dkl n ARG 424 N 0.81 2.56 -3.84 1.97 0.63 -0.84 -4.65 116.66 113.30 3dkl n ARG 424 Ca 0.17 0.91 -0.22 0.00 -0.92 0.00 0.00 57.85 57.79 3dkl n ARG 424 Cb 0.42 -2.68 -0.04 0.00 0.45 0.00 0.00 32.46 30.61 3dkl n ARG 424 CO 0.00 0.00 0.00 -1.54 -2.51 0.00 0.00 177.63 173.58 3dkl s SER 425 N 0.56 5.02 0.49 6.15 1.04 -0.65 -5.00 113.70 121.31 3dkl s SER 425 Ca 0.67 -0.67 -0.16 0.00 0.48 0.00 0.00 55.95 56.27 3dkl s SER 425 Cb -0.53 -0.77 -0.08 0.00 0.10 0.00 0.00 66.02 64.73 3dkl s SER 425 CO 0.46 -0.43 0.95 -0.54 0.98 0.00 0.00 173.24 174.66 3dkl s LYS 426 N -3.99 3.95 -0.11 4.02 1.02 -1.26 -4.63 119.74 118.74 3dkl s LYS 426 Ca 0.42 0.90 -0.04 0.00 0.02 0.00 0.00 55.97 57.27 3dkl s LYS 426 Cb -0.04 -2.18 -0.04 0.00 -0.52 0.00 0.00 37.83 35.06 3dkl s LYS 426 CO 0.26 -0.21 0.04 0.15 -0.92 0.00 0.00 175.35 174.67 3dkl s LYS 427 N -3.95 3.22 1.69 1.68 1.02 -1.26 -4.60 119.74 117.54 3dkl s LYS 427 Ca 0.58 -0.33 0.00 0.00 0.02 0.00 0.00 55.97 56.24 3dkl s LYS 427 Cb -0.10 -2.94 0.00 0.00 -0.52 0.00 0.00 37.83 34.27 3dkl s LYS 427 CO 0.29 0.66 0.00 0.41 -0.92 0.00 0.00 175.35 175.80 3dkl n GLY 428 N 2.29 -1.39 3.75 -3.33 0.00 0.29 -1.03 105.19 105.77 3dkl n GLY 428 Ca -0.19 -1.26 -0.40 0.00 0.00 0.00 0.00 46.02 44.17 3dkl n GLY 428 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dkl s ARG 429 N 0.00 4.64 0.15 1.61 0.52 -1.26 -4.43 118.95 120.17 3dkl s ARG 429 Ca 0.00 1.77 0.10 0.00 -0.52 0.00 0.00 55.73 57.08 3dkl s ARG 429 Cb 0.00 -3.21 -0.04 0.00 0.52 0.00 0.00 34.95 32.22 3dkl s ARG 429 CO 0.00 0.19 -0.18 -0.51 0.02 0.00 0.00 175.30 174.82 3dkl s LEU 430 N -1.16 2.67 0.00 2.53 1.43 -1.26 -0.40 118.68 122.48 3dkl s LEU 430 Ca 0.46 -0.65 -0.16 0.00 -1.03 0.00 0.00 54.13 52.74 3dkl s LEU 430 Cb -0.31 -1.46 0.03 0.00 0.03 0.00 0.00 46.19 44.48 3dkl s LEU 430 CO 0.39 0.15 0.35 -0.94 0.23 0.00 0.00 176.35 176.53 3dkl s SER 431 N -2.41 -0.23 -0.13 2.29 1.04 -0.80 -4.98 113.70 108.48 3dkl s SER 431 Ca 0.20 0.06 -0.01 0.00 0.48 0.00 0.00 55.95 56.68 3dkl s SER 431 Cb -0.09 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.36 3dkl s SER 431 CO 0.11 -0.53 -0.11 -0.22 0.98 0.00 0.00 173.24 173.47 3dkl s LEU 432 N -1.58 2.83 0.09 2.42 2.96 -1.26 -0.29 118.68 123.85 3dkl s LEU 432 Ca -0.10 -0.28 0.02 0.00 -0.22 0.00 0.00 54.13 53.55 3dkl s LEU 432 Cb -0.03 -1.65 -0.04 0.00 0.50 0.00 0.00 46.19 44.97 3dkl s LEU 432 CO 0.02 0.17 -0.07 -1.00 -1.32 0.00 0.00 176.35 174.15 3dkl s HIS 433 N 0.31 0.91 0.24 5.38 3.76 0.36 -0.18 115.29 126.07 3dkl s HIS 433 Ca -0.09 -0.82 -0.30 0.00 -0.15 0.00 0.00 55.06 53.70 3dkl s HIS 433 Cb -0.15 -0.52 -0.09 0.00 1.11 0.00 0.00 32.58 32.93 3dkl s HIS 433 CO 0.05 -0.10 0.96 0.50 -0.85 0.00 0.00 174.74 175.29 3dkl s ARG 434 N -3.41 4.83 0.46 1.40 6.06 -1.26 -0.85 118.95 126.19 3dkl s ARG 434 Ca 0.09 1.52 -0.06 0.00 -2.50 0.00 0.00 55.73 54.78 3dkl s ARG 434 Cb 0.02 -3.28 -0.04 0.00 0.06 0.00 0.00 34.95 31.71 3dkl s ARG 434 CO -0.03 0.47 0.78 0.95 -2.50 0.00 0.00 175.30 174.97 3dkl s THR 435 N -1.12 4.89 0.40 4.11 -4.23 0.81 -4.84 115.64 115.67 3dkl s THR 435 Ca 0.42 0.26 0.18 0.00 -1.18 0.00 0.00 61.69 61.37 3dkl s THR 435 Cb -0.26 -3.84 0.39 0.00 1.34 0.00 0.00 72.50 70.12 3dkl s THR 435 CO 0.33 -0.79 1.78 -0.65 -0.54 0.00 0.00 174.62 174.76 3dkl h PRO 436 N 0.42 0.39 -0.22 3.99 0.11 -1.97 0.66 132.00 135.39 3dkl h PRO 436 Ca -0.47 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3dkl h PRO 436 Cb 1.20 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.22 3dkl h PRO 436 CO 0.62 0.26 0.00 0.00 -0.21 0.00 0.00 178.00 178.67 3dkl n ALA 437 N -2.48 2.51 -1.03 -0.75 0.00 -1.26 -4.89 120.51 112.61 3dkl n ALA 437 Ca 0.24 -0.16 -0.01 0.00 0.00 0.00 0.00 53.44 53.51 3dkl n ALA 437 Cb 0.84 -1.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.29 3dkl n ALA 437 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dkl n GLY 438 N 0.55 0.47 0.00 0.00 0.00 0.23 -5.06 105.19 101.38 3dkl n GLY 438 Ca 0.03 -1.03 0.00 0.00 0.00 0.00 0.00 46.02 45.02 3dkl n GLY 438 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dkl n ASN 439 N 1.80 0.00 -4.45 1.61 3.02 -1.25 -4.75 115.26 111.25 3dkl n ASN 439 Ca -0.01 -0.35 -0.29 0.00 -0.03 0.00 0.00 54.58 53.89 3dkl n ASN 439 Cb 0.04 0.00 -0.12 0.00 -0.61 0.00 0.00 39.78 39.09 3dkl n ASN 439 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3dkl s PHE 440 N 1.36 2.43 -0.06 3.10 0.40 -1.26 -0.13 117.98 123.83 3dkl s PHE 440 Ca 0.00 -0.32 -0.05 0.00 -0.60 0.00 0.00 56.93 55.96 3dkl s PHE 440 Cb 0.00 -1.30 0.01 0.00 0.51 0.00 0.00 43.02 42.25 3dkl s PHE 440 CO 0.00 0.37 0.15 0.54 0.70 0.00 0.00 175.22 176.98 3dkl s VAL 441 N -1.13 0.00 -0.28 -0.44 0.11 -0.03 -4.80 120.40 113.84 3dkl s VAL 441 Ca 0.16 -0.01 -0.10 0.00 -2.93 0.00 0.00 61.98 59.10 3dkl s VAL 441 Cb -0.10 -0.22 -0.04 0.00 -1.53 0.00 0.00 36.38 34.49 3dkl s VAL 441 CO 0.08 -0.00 0.17 -0.89 -3.33 0.00 0.00 175.10 171.13 3dkl s THR 442 N 0.07 5.05 -0.08 5.04 2.01 -1.26 -0.49 115.64 125.97 3dkl s THR 442 Ca -0.00 0.03 -0.18 0.00 0.31 0.00 0.00 61.69 61.85 3dkl s THR 442 Cb -0.01 -3.42 -0.05 0.00 0.01 0.00 0.00 72.50 69.03 3dkl s THR 442 CO 0.00 0.24 0.49 -0.76 -0.69 0.00 0.00 174.62 173.90 3dkl s LEU 443 N 1.72 4.33 0.37 4.42 1.43 0.60 -4.92 118.68 126.62 3dkl s LEU 443 Ca 0.07 0.90 0.07 0.00 -1.03 0.00 0.00 54.13 54.14 3dkl s LEU 443 Cb -0.16 -2.72 -0.02 0.00 0.03 0.00 0.00 46.19 43.32 3dkl s LEU 443 CO 0.09 0.06 0.38 -1.61 0.23 0.00 0.00 176.35 175.50 3dkl s GLU 444 N 0.24 2.75 -1.44 1.70 2.02 -1.26 -1.91 118.70 120.80 3dkl s GLU 444 Ca 0.27 -1.30 -0.01 0.00 0.02 0.00 0.00 54.97 53.94 3dkl s GLU 444 Cb -0.16 -2.54 0.00 0.00 0.10 0.00 0.00 34.13 31.53 3dkl s GLU 444 CO 0.12 -0.03 0.17 0.39 0.02 0.00 0.00 175.26 175.93 3dkl n GLU 445 N -1.52 -2.30 -1.15 1.61 1.02 -0.20 -1.70 120.64 116.41 3dkl n GLU 445 Ca 0.01 0.83 -0.05 0.00 -0.02 0.00 0.00 57.16 57.93 3dkl n GLU 445 Cb 0.60 -5.33 -0.02 0.00 -0.02 0.00 0.00 31.44 26.66 3dkl n GLU 445 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dkl n GLY 446 N -1.14 0.64 0.24 0.62 0.00 0.46 -4.75 105.19 101.26 3dkl n GLY 446 Ca -0.17 -0.13 0.17 0.00 0.00 0.00 0.00 46.02 45.88 3dkl n GLY 446 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dkl h LYS 447 N 0.21 0.00 0.00 1.61 1.57 -1.54 -2.19 116.57 116.23 3dkl h LYS 447 Ca -0.11 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3dkl h LYS 447 Cb 0.76 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.07 3dkl h LYS 447 CO 0.15 0.00 -0.01 0.78 -0.57 0.00 0.00 179.45 179.80 3dkl h GLY 448 N 0.54 0.00 2.00 3.86 0.00 -1.84 -2.27 103.07 105.36 3dkl h GLY 448 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3dkl h GLY 448 CO 0.00 0.00 -0.12 -0.55 0.00 0.00 0.00 176.54 175.87 3dkl h ASP 449 N 0.00 0.00 0.44 0.19 3.32 -1.80 -2.08 116.42 116.49 3dkl h ASP 449 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3dkl h ASP 449 Cb 0.13 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.68 3dkl h ASP 449 CO 0.00 0.12 0.00 0.18 -1.72 0.00 0.00 179.24 177.82 3dkl n LEU 450 N -3.50 0.09 -4.26 1.55 4.77 -0.85 -4.94 117.00 109.86 3dkl n LEU 450 Ca -0.01 0.52 -0.36 0.00 -0.03 0.00 0.00 56.01 56.14 3dkl n LEU 450 Cb 0.27 -0.52 -0.04 0.00 -2.33 0.00 0.00 43.42 40.80 3dkl n LEU 450 CO 0.30 -0.34 -0.13 -0.62 -1.33 0.00 0.00 177.39 175.27 3dkl n GLU 451 N -1.60 -2.48 0.00 3.23 1.02 -0.78 -4.83 120.64 115.20 3dkl n GLU 451 Ca 0.03 0.30 0.13 0.00 -0.02 0.00 0.00 57.16 57.60 3dkl n GLU 451 Cb 0.15 -4.79 0.28 0.00 -0.02 0.00 0.00 31.44 27.06 3dkl n GLU 451 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 3dkl n GLU 452 N -4.34 1.16 -1.18 3.49 1.02 -1.26 -4.35 120.64 115.17 3dkl n GLU 452 Ca -0.01 -0.79 0.05 0.00 -0.02 0.00 0.00 57.16 56.38 3dkl n GLU 452 Cb 0.53 -1.48 0.08 0.00 -0.02 0.00 0.00 31.44 30.55 3dkl n GLU 452 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3dkl n TYR 453 N -0.23 0.00 -4.70 -0.32 4.01 -1.26 -5.08 117.16 109.58 3dkl n TYR 453 Ca 0.13 -0.83 0.00 0.00 -0.16 0.00 0.00 57.90 57.04 3dkl n TYR 453 Cb 0.40 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.25 3dkl n TYR 453 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dkl n GLY 454 N -0.06 -1.07 3.87 2.72 0.00 -1.26 -4.44 105.19 104.96 3dkl n GLY 454 Ca 0.10 -1.10 -0.33 0.00 0.00 0.00 0.00 46.02 44.69 3dkl n GLY 454 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3dkl s GLN 455 N 0.00 3.79 0.14 1.61 -2.07 -1.26 -4.91 119.66 116.95 3dkl s GLN 455 Ca 0.00 0.23 -0.32 0.00 -1.82 0.00 0.00 55.36 53.45 3dkl s GLN 455 Cb 0.00 -2.76 -0.11 0.00 -1.09 0.00 0.00 33.01 29.04 3dkl s GLN 455 CO 0.00 0.40 1.81 -3.47 -1.32 0.00 0.00 175.29 172.71 3dkl n ASP 456 N 0.16 4.01 0.00 12.60 4.64 -1.26 -4.70 116.55 132.00 3dkl n ASP 456 Ca -0.02 1.00 0.10 0.00 -1.38 0.00 0.00 54.79 54.50 3dkl n ASP 456 Cb 0.52 -1.55 0.45 0.00 -1.04 0.00 0.00 41.12 39.51 3dkl n ASP 456 CO 0.00 0.00 0.00 0.18 -0.82 0.00 0.00 177.20 176.56 3dkl n LEU 457 N 5.27 0.03 -4.75 -2.67 4.77 0.74 -4.80 117.00 115.59 3dkl n LEU 457 Ca 0.18 0.50 -0.40 0.00 -0.03 0.00 0.00 56.01 56.27 3dkl n LEU 457 Cb 0.36 -0.50 -0.05 0.00 -2.33 0.00 0.00 43.42 40.90 3dkl n LEU 457 CO 0.66 -0.14 0.43 -0.76 -1.33 0.00 0.00 177.39 176.24 3dkl s LEU 458 N -3.06 4.44 0.10 2.23 1.43 -1.26 -4.31 118.68 118.26 3dkl s LEU 458 Ca 0.10 1.38 0.10 0.00 -1.03 0.00 0.00 54.13 54.69 3dkl s LEU 458 Cb 0.14 -3.16 -0.04 0.00 0.03 0.00 0.00 46.19 43.16 3dkl s LEU 458 CO 0.39 0.04 -0.27 -1.00 0.23 0.00 0.00 176.35 175.74 3dkl s HIS 459 N -0.10 2.32 0.00 0.29 3.76 -0.39 -4.76 115.29 116.41 3dkl s HIS 459 Ca 0.37 -0.39 -0.30 0.00 -0.15 0.00 0.00 55.06 54.59 3dkl s HIS 459 Cb -0.20 -1.29 -0.07 0.00 1.11 0.00 0.00 32.58 32.13 3dkl s HIS 459 CO 0.22 0.28 1.69 0.99 -0.85 0.00 0.00 174.74 177.06 3dkl s THR 460 N -0.99 3.32 -0.27 1.30 2.01 -1.26 -0.44 115.64 119.31 3dkl s THR 460 Ca 0.13 0.55 0.10 0.00 0.31 0.00 0.00 61.69 62.78 3dkl s THR 460 Cb -0.10 -3.35 -0.13 0.00 0.01 0.00 0.00 72.50 68.93 3dkl s THR 460 CO 0.05 -0.03 0.33 1.33 -0.69 0.00 0.00 174.62 175.61 3dkl n VAL 461 N 5.20 0.00 -3.76 3.82 0.24 0.04 -4.16 118.33 119.70 3dkl n VAL 461 Ca 0.17 -0.25 -0.12 0.00 -2.04 0.00 0.00 64.34 62.09 3dkl n VAL 461 Cb 0.42 0.69 -0.12 0.00 -1.47 0.00 0.00 33.84 33.35 3dkl n VAL 461 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3dkl s PHE 462 N -2.25 -0.32 -0.25 6.34 5.36 -1.16 -0.44 117.98 125.26 3dkl s PHE 462 Ca 0.01 0.76 -0.10 0.00 -0.96 0.00 0.00 56.93 56.64 3dkl s PHE 462 Cb 0.07 0.09 0.11 0.00 -0.34 0.00 0.00 43.02 42.95 3dkl s PHE 462 CO 0.41 -0.18 0.56 0.21 -1.46 0.00 0.00 175.22 174.76 3dkl s LYS 463 N 0.57 0.50 -1.38 10.12 2.20 -0.63 -1.17 119.74 129.95 3dkl s LYS 463 Ca -0.04 1.24 -0.03 0.00 -0.36 0.00 0.00 55.97 56.78 3dkl s LYS 463 Cb -0.05 0.54 0.02 0.00 -1.51 0.00 0.00 37.83 36.84 3dkl s LYS 463 CO -0.03 -0.21 0.71 0.09 -0.36 0.00 0.00 175.35 175.55 3dkl n ASN 464 N 5.20 -1.81 0.00 1.43 5.03 -0.48 -1.99 115.26 122.64 3dkl n ASN 464 Ca -0.13 -0.85 0.00 0.00 0.87 0.00 0.00 54.58 54.47 3dkl n ASN 464 Cb 0.51 -3.80 0.00 0.00 -1.02 0.00 0.00 39.78 35.47 3dkl n ASN 464 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3dkl n GLY 465 N -1.67 0.80 3.37 7.41 0.00 -0.94 -4.67 105.19 109.49 3dkl n GLY 465 Ca -0.22 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.48 3dkl n GLY 465 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dkl s LYS 466 N -0.51 2.51 -0.29 1.61 3.01 -0.84 -0.59 119.74 124.64 3dkl s LYS 466 Ca 0.00 -0.81 -0.29 0.00 -1.01 0.00 0.00 55.97 53.86 3dkl s LYS 466 Cb 0.00 -2.26 0.01 0.00 -1.01 0.00 0.00 37.83 34.57 3dkl s LYS 466 CO 0.00 0.50 1.06 0.08 0.51 0.00 0.00 175.35 177.50 3dkl s VAL 467 N -0.45 4.57 -0.79 3.17 1.01 -1.26 -1.60 120.40 125.06 3dkl s VAL 467 Ca 0.05 1.82 0.18 0.00 0.00 0.00 0.00 61.98 64.03 3dkl s VAL 467 Cb -0.12 -4.38 -0.20 0.00 0.00 0.00 0.00 36.38 31.69 3dkl s VAL 467 CO 0.01 -0.38 0.74 0.35 0.00 0.00 0.00 175.10 175.82 3dkl n THR 468 N 5.68 0.00 -3.64 3.92 -2.24 0.42 -4.91 114.28 113.52 3dkl n THR 468 Ca 0.12 -0.10 -0.04 0.00 -2.27 0.00 0.00 64.05 61.75 3dkl n THR 468 Cb 0.47 0.94 -0.06 0.00 -2.10 0.00 0.00 70.33 69.58 3dkl n THR 468 CO 0.00 0.00 0.00 -0.75 -0.57 0.00 0.00 175.07 173.75 3dkl s LYS 469 N -2.73 0.64 0.25 -0.78 2.47 -1.24 -4.93 119.74 113.42 3dkl s LYS 469 Ca 0.06 1.30 0.11 0.00 -1.56 0.00 0.00 55.97 55.88 3dkl s LYS 469 Cb 0.13 0.44 -0.05 0.00 -1.46 0.00 0.00 37.83 36.90 3dkl s LYS 469 CO 0.74 -0.17 -0.15 -1.12 0.16 0.00 0.00 175.35 174.81 3dkl s SER 470 N 2.16 3.87 -0.04 1.43 0.01 -1.26 -4.76 113.70 115.11 3dkl s SER 470 Ca -0.08 -0.85 0.04 0.00 1.31 0.00 0.00 55.95 56.37 3dkl s SER 470 Cb -0.08 -0.47 -0.00 0.00 0.21 0.00 0.00 66.02 65.67 3dkl s SER 470 CO -0.19 0.05 -0.17 -0.31 0.41 0.00 0.00 173.24 173.03 3dkl s TYR 471 N -2.21 1.64 0.65 2.43 1.51 -1.26 -5.11 117.35 115.00 3dkl s TYR 471 Ca 0.28 -0.44 -0.11 0.00 -1.01 0.00 0.00 57.07 55.79 3dkl s TYR 471 Cb -0.06 -1.10 -0.02 0.00 -0.11 0.00 0.00 41.96 40.66 3dkl s TYR 471 CO 0.15 -0.14 1.04 -1.54 -1.11 0.00 0.00 175.55 173.95 3dkl s SER 472 N -0.02 5.94 0.41 2.29 1.04 -1.26 -4.76 113.70 117.34 3dkl s SER 472 Ca -0.02 1.48 0.08 0.00 0.48 0.00 0.00 55.95 57.97 3dkl s SER 472 Cb -0.11 -2.47 0.87 0.00 0.10 0.00 0.00 66.02 64.42 3dkl s SER 472 CO 0.02 -1.07 2.04 0.15 0.98 0.00 0.00 173.24 175.36 3dkl h PHE 473 N -0.46 0.44 -0.43 5.02 3.57 -0.87 -2.31 116.94 121.91 3dkl h PHE 473 Ca -0.44 -0.00 0.02 0.00 3.53 0.00 0.00 57.97 61.08 3dkl h PHE 473 Cb 1.20 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.77 3dkl h PHE 473 CO 0.64 0.32 0.26 -0.44 -2.23 0.00 0.00 178.31 176.86 3dkl h ASP 474 N 0.46 0.43 -0.59 0.41 3.32 -1.91 -1.84 116.42 116.71 3dkl h ASP 474 Ca 0.12 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.14 3dkl h ASP 474 Cb 0.02 -0.09 -0.03 0.00 0.22 0.00 0.00 39.33 39.45 3dkl h ASP 474 CO -0.02 0.31 0.27 -0.33 -1.72 0.00 0.00 179.24 177.75 3dkl h GLU 475 N 0.53 0.86 -0.31 3.56 5.08 -1.82 -2.31 114.58 120.16 3dkl h GLU 475 Ca 0.17 -0.14 0.05 0.00 -1.00 0.00 0.00 59.36 58.44 3dkl h GLU 475 Cb -0.01 -0.15 -0.04 0.00 0.50 0.00 0.00 28.75 29.05 3dkl h GLU 475 CO -0.07 0.71 0.04 0.82 -1.00 0.00 0.00 179.01 179.51 3dkl h ILE 476 N 0.80 0.82 -0.51 3.13 2.04 -1.25 0.16 117.51 122.69 3dkl h ILE 476 Ca 0.20 -0.05 0.04 0.00 1.00 0.00 0.00 64.86 66.05 3dkl h ILE 476 Cb 0.15 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 36.85 3dkl h ILE 476 CO -0.02 0.03 0.27 0.03 0.00 0.00 0.00 178.15 178.45 3dkl h ARG 477 N 0.14 0.51 -0.12 2.37 3.08 -1.30 -0.30 114.38 118.76 3dkl h ARG 477 Ca 0.15 -0.03 0.01 0.00 0.07 0.00 0.00 59.98 60.18 3dkl h ARG 477 Cb 0.18 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 30.10 3dkl h ARG 477 CO -0.22 0.34 0.02 -0.22 -1.07 0.00 0.00 179.97 178.82 3dkl h LYS 478 N 0.53 0.07 -0.69 0.04 3.64 -0.99 -2.03 116.57 117.14 3dkl h LYS 478 Ca 0.22 -0.00 0.04 0.00 -1.27 0.00 0.00 60.65 59.64 3dkl h LYS 478 Cb 0.11 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 31.88 3dkl h LYS 478 CO -0.15 0.04 0.46 -0.91 -2.27 0.00 0.00 179.45 176.63 3dkl h ASN 479 N 0.07 0.70 -0.18 4.20 2.35 -0.26 -2.87 115.58 119.60 3dkl h ASN 479 Ca 0.05 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.80 3dkl h ASN 479 Cb 0.05 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 38.26 3dkl h ASN 479 CO -0.07 0.48 0.00 0.00 -1.65 0.00 0.00 177.43 176.19 3dkl n ALA 480 N -2.44 2.51 -1.48 -0.83 0.00 -0.16 -4.48 120.51 113.63 3dkl n ALA 480 Ca 0.09 -0.53 -0.38 0.00 0.00 0.00 0.00 53.44 52.62 3dkl n ALA 480 Cb 0.15 -1.08 0.05 0.00 0.00 0.00 0.00 19.45 18.56 3dkl n ALA 480 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 3dkl n GLN 481 N 0.35 0.57 -2.15 0.00 6.02 -0.81 -4.98 117.38 116.38 3dkl n GLN 481 Ca 0.16 0.23 -0.35 0.00 -0.01 0.00 0.00 57.00 57.03 3dkl n GLN 481 Cb 0.33 -1.86 0.01 0.00 1.02 0.00 0.00 30.24 29.75 3dkl n GLN 481 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3dkl s LEU 482 N -0.24 3.67 0.03 1.08 1.43 -1.26 -5.01 118.68 118.39 3dkl s LEU 482 Ca 0.71 2.15 -0.10 0.00 -1.03 0.00 0.00 54.13 55.85 3dkl s LEU 482 Cb -0.42 -4.58 -0.04 0.00 0.03 0.00 0.00 46.19 41.19 3dkl s LEU 482 CO 0.53 -1.32 1.16 0.78 0.23 0.00 0.00 176.35 177.73 3dkl h ASN 483 N 0.95 -0.51 0.00 2.29 2.35 -2.00 -3.54 115.58 115.12 3dkl h ASN 483 Ca -0.49 0.06 0.00 0.00 -0.55 0.00 0.00 56.30 55.32 3dkl h ASN 483 Cb 1.26 0.20 0.00 0.00 0.05 0.00 0.00 38.32 39.83 3dkl h ASN 483 CO 0.56 -0.14 0.00 -0.38 -1.65 0.00 0.00 177.43 175.82