#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 3.20 0.60 -2.13 2.47 -1.26 -5.00 114.94 112.82 3dkl s ASN 10 Ca 0.00 -1.07 0.30 0.00 0.42 0.00 0.00 52.86 52.51 3dkl s ASN 10 Cb 0.00 -0.53 1.69 0.00 -1.45 0.00 0.00 41.25 40.96 3dkl s ASN 10 CO 0.00 -0.37 2.08 -0.29 -3.72 0.00 0.00 177.10 174.80 3dkl h ILE 11 N 6.47 0.38 0.00 -5.21 2.10 -1.91 0.21 117.51 119.55 3dkl h ILE 11 Ca -0.16 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.78 3dkl h ILE 11 Cb 1.08 0.81 0.00 0.00 -1.09 0.00 0.00 36.82 37.61 3dkl h ILE 11 CO 0.38 0.00 0.00 -0.07 -1.08 0.00 0.00 178.15 177.38 3dkl h LEU 12 N 0.00 0.00 -3.10 2.19 4.07 -1.91 -2.53 115.31 114.03 3dkl h LEU 12 Ca 0.09 0.00 0.00 0.00 0.08 0.00 0.00 57.88 58.05 3dkl h LEU 12 Cb 0.55 0.00 0.00 0.00 1.08 0.00 0.00 40.66 42.29 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 -2.91 3.07 -2.31 1.67 4.77 0.73 -4.72 117.00 117.29 3dkl n LEU 13 Ca 0.00 -2.77 -0.27 0.00 -0.03 0.00 0.00 56.01 52.94 3dkl n LEU 13 Cb 0.25 -0.40 0.02 0.00 -2.33 0.00 0.00 43.42 40.95 3dkl n LEU 13 CO 0.24 0.67 0.35 0.00 -1.33 0.00 0.00 177.39 177.32 3dkl n ALA 14 N -0.64 5.22 -2.20 -1.18 0.00 -0.95 -4.98 120.51 115.77 3dkl n ALA 14 Ca 0.16 -4.05 -0.12 0.00 0.00 0.00 0.00 53.44 49.43 3dkl n ALA 14 Cb 0.68 -0.62 -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 -5.09 0.25 0.25 0.00 -1.32 -1.26 -4.38 115.64 104.09 3dkl s THR 15 Ca 0.50 -1.95 -0.30 0.00 -1.21 0.00 0.00 61.69 58.73 3dkl s THR 15 Cb 0.41 -2.23 -0.10 0.00 -1.51 0.00 0.00 72.50 69.08 3dkl s THR 15 CO -0.10 -0.31 1.34 -1.81 -2.21 0.00 0.00 174.62 171.53 3dkl s ASP 16 N -3.13 6.80 0.26 8.08 1.01 -1.26 -4.92 116.67 123.51 3dkl s ASP 16 Ca 0.29 2.56 -0.04 0.00 0.71 0.00 0.00 52.55 56.07 3dkl s ASP 16 Cb 0.07 -2.62 0.54 0.00 1.01 0.00 0.00 42.92 41.91 3dkl s ASP 16 CO 0.06 -0.57 1.64 0.28 0.21 0.00 0.00 175.17 176.79 3dkl h SER 17 N 4.71 -0.21 -0.49 0.27 0.02 -2.00 -0.96 113.55 114.89 3dkl h SER 17 Ca -0.46 0.20 0.14 0.00 -0.84 0.00 0.00 61.79 60.83 3dkl h SER 17 Cb 1.22 0.31 -0.02 0.00 0.14 0.00 0.00 62.40 64.05 3dkl h SER 17 CO 0.74 -0.17 0.41 0.10 -1.14 0.00 0.00 176.83 176.77 3dkl h TYR 18 N 0.15 0.00 0.00 3.45 -0.00 -2.02 -0.99 116.97 117.56 3dkl h TYR 18 Ca 0.47 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 59.17 3dkl h TYR 18 Cb 0.87 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.59 3dkl h TYR 18 CO -0.36 0.00 -0.10 0.87 -0.00 0.00 0.00 178.16 178.57 3dkl h LYS 19 N 0.00 0.00 0.00 0.10 1.57 -1.55 -0.33 116.57 116.36 3dkl h LYS 19 Ca 0.24 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 59.00 3dkl h LYS 19 Cb 1.04 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.35 3dkl h LYS 19 CO -0.00 0.10 -0.05 0.28 -0.57 0.00 0.00 179.45 179.20 3dkl h VAL 20 N 0.00 0.98 -0.01 0.50 2.07 -1.28 -2.72 116.25 115.79 3dkl h VAL 20 Ca -0.00 -0.18 0.00 0.00 0.82 0.00 0.00 66.70 67.34 3dkl h VAL 20 Cb 0.69 1.10 0.00 0.00 -1.52 0.00 0.00 31.29 31.56 3dkl h VAL 20 CO 0.01 0.05 -0.23 0.35 0.02 0.00 0.00 177.57 177.78 3dkl n THR 21 N -4.40 0.00 0.17 2.57 -2.24 -0.14 -4.48 114.28 105.76 3dkl n THR 21 Ca -0.03 -0.23 0.04 0.00 -2.27 0.00 0.00 64.05 61.56 3dkl n THR 21 Cb 0.13 0.75 0.26 0.00 -2.10 0.00 0.00 70.33 69.37 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 2.14 0.00 -0.09 4.78 -0.00 -1.44 -3.02 115.15 117.51 3dkl h HIS 22 Ca 0.00 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.40 3dkl h HIS 22 Cb 0.62 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 28.03 3dkl h HIS 22 CO 0.00 0.45 0.11 0.10 -0.00 0.00 0.00 177.93 178.59 3dkl h TYR 23 N 0.00 0.00 -0.00 2.45 -0.00 -1.78 0.30 116.97 117.93 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 1.01 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.74 3dkl h TYR 23 CO 0.00 0.00 -0.02 1.63 -0.00 0.00 0.00 178.16 179.77 3dkl n LYS 24 N -3.76 1.10 -0.01 0.10 4.76 -1.14 -4.35 118.16 114.86 3dkl n LYS 24 Ca -0.01 -0.32 0.01 0.00 -2.87 0.00 0.00 58.31 55.13 3dkl n LYS 24 Cb 0.22 -1.49 -0.04 0.00 -1.84 0.00 0.00 35.03 31.87 3dkl n LYS 24 CO 0.00 0.00 0.00 1.04 -1.37 0.00 0.00 177.40 177.07 3dkl n GLN 25 N -0.67 0.97 -1.28 1.97 6.02 0.09 -5.03 117.38 119.45 3dkl n GLN 25 Ca 0.20 -0.03 -0.33 0.00 -0.01 0.00 0.00 57.00 56.83 3dkl n GLN 25 Cb 0.22 -1.12 0.11 0.00 1.02 0.00 0.00 30.24 30.47 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 -2.28 2.02 0.55 1.08 1.51 -1.18 -4.96 117.35 114.08 3dkl s TYR 26 Ca -0.02 1.64 -0.21 0.00 -1.01 0.00 0.00 57.07 57.46 3dkl s TYR 26 Cb 0.03 -3.40 -0.05 0.00 -0.11 0.00 0.00 41.96 38.43 3dkl s TYR 26 CO 0.20 -2.55 1.33 -2.14 -1.11 0.00 0.00 175.55 171.28 3dkl s PRO 27 N -4.15 3.16 0.48 -1.71 0.02 -1.26 -4.93 135.00 126.60 3dkl s PRO 27 Ca 0.71 2.16 -0.22 0.00 0.02 0.00 0.00 61.00 63.67 3dkl s PRO 27 Cb -0.26 -2.23 -0.09 0.00 0.02 0.00 0.00 34.50 31.93 3dkl s PRO 27 CO 0.49 -1.15 0.90 -2.30 -0.33 0.00 0.00 177.00 174.60 3dkl n PRO 28 N -1.05 1.08 -3.63 5.54 -0.02 -1.26 -2.95 135.00 132.72 3dkl n PRO 28 Ca 0.11 0.40 -0.24 0.00 -2.02 0.00 0.00 63.50 61.74 3dkl n PRO 28 Cb 0.46 -1.98 0.07 0.00 -0.02 0.00 0.00 33.50 32.03 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 0.30 -5.97 -4.68 2.55 3.02 -1.26 -4.62 115.26 104.60 3dkl n ASN 29 Ca 0.11 -0.57 -0.39 0.00 -0.03 0.00 0.00 54.58 53.69 3dkl n ASN 29 Cb 0.42 -4.91 -0.06 0.00 -0.61 0.00 0.00 39.78 34.62 3dkl n ASN 29 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3dkl s THR 30 N -3.32 5.11 -0.38 3.41 2.01 -1.15 -1.13 115.64 120.18 3dkl s THR 30 Ca 0.56 1.01 0.09 0.00 0.31 0.00 0.00 61.69 63.67 3dkl s THR 30 Cb -0.25 -3.86 -0.11 0.00 0.01 0.00 0.00 72.50 68.29 3dkl s THR 30 CO 0.74 0.20 0.37 -1.54 -0.69 0.00 0.00 174.62 173.70 3dkl n SER 31 N 4.56 0.73 -3.72 3.53 3.41 -0.39 -4.74 113.62 117.00 3dkl n SER 31 Ca -0.04 -0.63 -0.14 0.00 -0.26 0.00 0.00 58.87 57.80 3dkl n SER 31 Cb 0.51 1.05 -0.14 0.00 -0.26 0.00 0.00 64.21 65.37 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 -1.96 0.13 -0.13 4.33 2.47 -1.20 -4.04 119.74 119.33 3dkl s LYS 32 Ca 0.03 0.49 0.03 0.00 -1.56 0.00 0.00 55.97 54.96 3dkl s LYS 32 Cb 0.07 -0.16 0.01 0.00 -1.46 0.00 0.00 37.83 36.29 3dkl s LYS 32 CO 0.38 -0.20 -0.22 0.08 0.16 0.00 0.00 175.35 175.55 3dkl s VAL 33 N 1.50 2.12 -0.11 4.02 1.01 -1.26 -1.62 120.40 126.05 3dkl s VAL 33 Ca -0.06 -0.97 0.03 0.00 0.00 0.00 0.00 61.98 60.98 3dkl s VAL 33 Cb -0.11 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.43 3dkl s VAL 33 CO -0.07 0.55 -0.20 -0.47 0.00 0.00 0.00 175.10 174.91 3dkl s TYR 34 N 0.70 2.37 0.24 5.22 5.04 0.08 -3.47 117.35 127.53 3dkl s TYR 34 Ca -0.10 -1.09 0.04 0.00 -2.44 0.00 0.00 57.07 53.49 3dkl s TYR 34 Cb -0.16 -1.63 -0.05 0.00 0.35 0.00 0.00 41.96 40.47 3dkl s TYR 34 CO 0.01 -0.49 -0.01 -1.12 -1.34 0.00 0.00 175.55 172.59 3dkl s SER 35 N 0.70 2.06 0.06 4.32 0.01 0.23 -1.43 113.70 119.65 3dkl s SER 35 Ca -0.11 -1.22 -0.10 0.00 1.31 0.00 0.00 55.95 55.83 3dkl s SER 35 Cb -0.16 -0.03 0.01 0.00 0.21 0.00 0.00 66.02 66.04 3dkl s SER 35 CO 0.02 -0.48 0.22 -0.72 0.41 0.00 0.00 173.24 172.69 3dkl s TYR 36 N -3.32 0.06 -0.11 2.43 -0.85 0.04 -1.12 117.35 114.47 3dkl s TYR 36 Ca 0.29 -0.35 -0.00 0.00 -0.52 0.00 0.00 57.07 56.48 3dkl s TYR 36 Cb 0.05 -0.01 -0.02 0.00 0.38 0.00 0.00 41.96 42.36 3dkl s TYR 36 CO 0.10 -0.50 -0.10 0.12 -1.52 0.00 0.00 175.55 173.65 3dkl s PHE 37 N -3.11 2.88 0.07 -3.49 5.36 -0.40 -1.43 117.98 117.85 3dkl s PHE 37 Ca -0.01 -0.36 0.00 0.00 -0.96 0.00 0.00 56.93 55.61 3dkl s PHE 37 Cb 0.01 -1.82 -0.04 0.00 -0.34 0.00 0.00 43.02 40.84 3dkl s PHE 37 CO -0.07 -0.00 -0.05 -1.83 -1.46 0.00 0.00 175.22 171.81 3dkl s GLU 38 N -0.02 0.68 -0.94 10.12 -1.05 -0.63 -1.05 118.70 125.81 3dkl s GLU 38 Ca -0.02 -1.21 -0.17 0.00 -0.15 0.00 0.00 54.97 53.42 3dkl s GLU 38 Cb -0.14 0.02 0.15 0.00 -0.44 0.00 0.00 34.13 33.73 3dkl s GLU 38 CO 0.03 -0.06 1.08 0.00 0.95 0.00 0.00 175.26 177.26 3dkl s ARG 40 N 2.03 2.75 -0.03 0.00 3.52 -0.44 -0.47 118.95 126.31 3dkl s ARG 40 Ca 0.31 1.79 -0.30 0.00 -0.13 0.00 0.00 55.73 57.39 3dkl s ARG 40 Cb -0.06 -1.90 -0.04 0.00 -1.56 0.00 0.00 34.95 31.38 3dkl s ARG 40 CO -0.09 -1.37 1.32 -2.00 -0.81 0.00 0.00 175.30 172.35 3dkl s GLU 41 N -3.53 4.30 -0.84 5.12 2.12 -1.26 -4.54 118.70 120.07 3dkl s GLU 41 Ca 0.76 1.84 -0.02 0.00 0.36 0.00 0.00 54.97 57.91 3dkl s GLU 41 Cb -0.30 -3.59 0.00 0.00 0.26 0.00 0.00 34.13 30.50 3dkl s GLU 41 CO 0.37 -0.54 0.64 0.66 -0.54 0.00 0.00 175.26 175.84 3dkl n TYR 54 N 5.44 -2.23 0.75 5.30 4.02 -1.26 -5.00 117.16 124.17 3dkl n TYR 54 Ca 0.12 0.86 0.13 0.00 -0.01 0.00 0.00 57.90 59.01 3dkl n TYR 54 Cb 0.45 -3.12 0.42 0.00 -0.02 0.00 0.00 39.34 37.07 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 -2.59 0.17 -4.02 -0.72 0.28 -1.26 -4.81 120.64 107.69 3dkl n GLU 55 Ca -0.23 0.12 -0.13 0.00 -0.16 0.00 0.00 57.16 56.76 3dkl n GLU 55 Cb 0.64 -1.68 -0.13 0.00 1.43 0.00 0.00 31.44 31.70 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 -3.07 0.28 0.01 3.44 -1.05 -1.26 -0.93 118.70 116.12 3dkl s GLU 56 Ca 0.11 -0.26 0.08 0.00 -0.15 0.00 0.00 54.97 54.74 3dkl s GLU 56 Cb 0.15 -0.19 -0.02 0.00 -0.44 0.00 0.00 34.13 33.63 3dkl s GLU 56 CO 0.60 0.04 -0.24 0.95 0.95 0.00 0.00 175.26 177.57 3dkl s THR 57 N -0.44 1.91 -0.18 1.83 -4.23 0.60 -4.88 115.64 110.26 3dkl s THR 57 Ca -0.03 -1.13 -0.26 0.00 -1.18 0.00 0.00 61.69 59.09 3dkl s THR 57 Cb -0.04 -1.61 -0.01 0.00 1.34 0.00 0.00 72.50 72.18 3dkl s THR 57 CO -0.00 0.45 0.86 -0.69 -0.54 0.00 0.00 174.62 174.70 3dkl s VAL 58 N -0.65 4.85 -0.44 2.29 1.01 -1.26 -1.45 120.40 124.74 3dkl s VAL 58 Ca 0.10 1.69 -0.26 0.00 0.00 0.00 0.00 61.98 63.51 3dkl s VAL 58 Cb -0.09 -4.16 0.02 0.00 0.00 0.00 0.00 36.38 32.15 3dkl s VAL 58 CO 0.00 -0.00 0.95 0.12 0.00 0.00 0.00 175.10 176.17 3dkl s PHE 59 N 2.29 2.95 -0.14 5.22 5.36 -0.06 -4.57 117.98 129.03 3dkl s PHE 59 Ca 0.39 0.51 -0.12 0.00 -0.96 0.00 0.00 56.93 56.75 3dkl s PHE 59 Cb -0.16 -3.94 0.04 0.00 -0.34 0.00 0.00 43.02 38.61 3dkl s PHE 59 CO 0.12 -1.05 0.37 -0.47 -1.46 0.00 0.00 175.22 172.72 3dkl s TYR 60 N 3.76 -0.43 0.00 10.12 5.04 -1.26 0.12 117.35 134.69 3dkl s TYR 60 Ca 0.38 1.03 0.00 0.00 -2.44 0.00 0.00 57.07 56.04 3dkl s TYR 60 Cb -0.10 0.15 0.00 0.00 0.35 0.00 0.00 41.96 42.36 3dkl s TYR 60 CO 0.25 -0.22 0.00 0.41 -1.34 0.00 0.00 175.55 174.65 3dkl n GLY 61 N 3.18 1.64 0.35 8.97 0.00 -1.26 -2.76 105.19 115.30 3dkl n GLY 61 Ca -0.15 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.83 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 1.07 -0.95 0.99 5.85 -1.94 -3.02 115.31 117.33 3dkl h LEU 62 Ca 0.00 -0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.69 3dkl h LEU 62 Cb 0.00 -0.27 -0.06 0.00 0.37 0.00 0.00 40.66 40.70 3dkl h LEU 62 CO 0.00 0.85 0.61 -0.61 -0.34 0.00 0.00 178.44 178.95 3dkl h GLN 63 N 1.21 1.10 -0.40 1.25 4.15 -1.96 -0.07 115.11 120.39 3dkl h GLN 63 Ca 0.31 -0.07 0.08 0.00 0.77 0.00 0.00 58.65 59.75 3dkl h GLN 63 Cb -0.00 -0.25 -0.09 0.00 0.21 0.00 0.00 27.48 27.35 3dkl h GLN 63 CO -0.05 0.73 -0.30 -0.92 -1.93 0.00 0.00 178.83 176.35 3dkl h TYR 64 N 1.13 -0.83 0.06 3.99 3.20 -1.83 -1.60 116.97 121.10 3dkl h TYR 64 Ca 0.40 0.06 0.01 0.00 3.14 0.00 0.00 58.73 62.33 3dkl h TYR 64 Cb 0.10 0.42 -0.02 0.00 1.54 0.00 0.00 36.73 38.78 3dkl h TYR 64 CO -0.01 -0.37 -0.10 0.82 -1.64 0.00 0.00 178.16 176.86 3dkl h ILE 65 N -0.23 0.75 -0.35 1.81 2.04 -1.18 0.30 117.51 120.65 3dkl h ILE 65 Ca 0.18 0.00 0.08 0.00 1.00 0.00 0.00 64.86 66.12 3dkl h ILE 65 Cb 0.52 0.75 -0.08 0.00 -0.74 0.00 0.00 36.82 37.28 3dkl h ILE 65 CO -0.53 0.00 -0.18 -0.07 0.00 0.00 0.00 178.15 177.37 3dkl h LEU 66 N -0.21 -0.59 -0.07 1.44 3.38 -1.00 -0.16 115.31 118.10 3dkl h LEU 66 Ca 0.02 0.14 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 3dkl h LEU 66 Cb 0.22 0.32 0.00 0.00 0.09 0.00 0.00 40.66 41.30 3dkl h LEU 66 CO -0.06 -0.21 -0.18 0.78 0.09 0.00 0.00 178.44 178.86 3dkl h ASN 67 N -0.12 0.28 -0.02 -0.43 2.35 -1.10 -0.83 115.58 115.71 3dkl h ASN 67 Ca 0.18 -0.60 -0.20 0.00 -0.55 0.00 0.00 56.30 55.13 3dkl h ASN 67 Cb 0.39 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.68 3dkl h ASN 67 CO -0.43 0.83 -0.70 0.50 -1.65 0.00 0.00 177.43 175.99 3dkl h LYS 68 N -0.25 0.66 0.00 0.81 3.64 -0.34 -3.40 116.57 117.68 3dkl h LYS 68 Ca -0.00 -0.50 -0.05 0.00 -1.27 0.00 0.00 60.65 58.82 3dkl h LYS 68 Cb 0.79 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.70 3dkl h LYS 68 CO 0.04 1.12 -1.20 0.66 -2.27 0.00 0.00 179.45 177.80 3dkl n TYR 69 N -3.92 0.00 -0.04 1.91 0.53 -0.09 -4.88 117.16 110.68 3dkl n TYR 69 Ca -0.05 0.00 -0.00 0.00 -1.02 0.00 0.00 57.90 56.82 3dkl n TYR 69 Cb 0.70 -0.14 -0.11 0.00 -1.03 0.00 0.00 39.34 38.76 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 -2.13 0.00 -4.86 7.72 4.77 -0.94 -4.91 117.00 116.65 3dkl n LEU 70 Ca -0.05 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.62 3dkl n LEU 70 Cb 0.59 0.18 -0.04 0.00 -2.33 0.00 0.00 43.42 41.83 3dkl n LEU 70 CO 0.06 0.18 0.52 -1.59 -1.33 0.00 0.00 177.39 175.23 3dkl s LYS 71 N -2.61 3.86 1.87 3.23 -2.85 -0.36 -4.67 119.74 118.22 3dkl s LYS 71 Ca -0.06 0.66 0.00 0.00 -1.00 0.00 0.00 55.97 55.57 3dkl s LYS 71 Cb 0.06 -2.31 0.00 0.00 -2.06 0.00 0.00 37.83 33.52 3dkl s LYS 71 CO 0.56 -0.10 0.00 0.41 0.10 0.00 0.00 175.35 176.32 3dkl n GLY 72 N -1.30 -1.53 3.49 0.59 0.00 0.28 -4.63 105.19 102.09 3dkl n GLY 72 Ca 0.04 -1.36 -0.43 0.00 0.00 0.00 0.00 46.02 44.28 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 3.21 0.00 1.61 2.20 -1.26 -4.11 119.74 121.39 3dkl s LYS 73 Ca 0.00 -0.56 0.14 0.00 -0.36 0.00 0.00 55.97 55.19 3dkl s LYS 73 Cb 0.00 -4.15 0.12 0.00 -1.51 0.00 0.00 37.83 32.29 3dkl s LYS 73 CO 0.00 -1.69 0.96 1.33 -0.36 0.00 0.00 175.35 175.58 3dkl n VAL 74 N 6.06 0.04 -4.64 4.02 0.24 0.28 -4.89 118.33 119.43 3dkl n VAL 74 Ca -0.01 -0.52 -0.27 0.00 -2.04 0.00 0.00 64.34 61.50 3dkl n VAL 74 Cb 0.46 1.26 -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 -1.16 1.41 0.21 3.34 1.01 -1.12 -4.52 120.40 119.57 3dkl s VAL 75 Ca 0.17 -0.62 0.04 0.00 0.00 0.00 0.00 61.98 61.57 3dkl s VAL 75 Cb 0.12 -1.27 -0.05 0.00 0.00 0.00 0.00 36.38 35.18 3dkl s VAL 75 CO 0.18 0.42 -0.04 0.42 0.00 0.00 0.00 175.10 176.08 3dkl s THR 76 N 0.73 1.10 0.42 3.92 -4.23 -1.26 -4.33 115.64 111.99 3dkl s THR 76 Ca -0.12 -2.05 0.14 0.00 -1.18 0.00 0.00 61.69 58.48 3dkl s THR 76 Cb -0.16 -2.20 0.35 0.00 1.34 0.00 0.00 72.50 71.83 3dkl s THR 76 CO 0.03 -0.45 1.92 0.50 -0.54 0.00 0.00 174.62 176.08 3dkl h LYS 77 N 2.56 0.44 0.01 3.99 1.63 -2.00 -2.04 116.57 121.16 3dkl h LYS 77 Ca -0.38 -0.03 -0.26 0.00 -0.85 0.00 0.00 60.65 59.13 3dkl h LYS 77 Cb 1.21 -0.10 0.02 0.00 -0.60 0.00 0.00 32.23 32.76 3dkl h LYS 77 CO 0.64 0.29 -1.03 0.93 -3.45 0.00 0.00 179.45 176.83 3dkl h GLU 78 N 0.46 0.69 -0.36 1.90 3.07 -1.99 -2.36 114.58 115.99 3dkl h GLU 78 Ca 0.37 -0.75 -0.02 0.00 -0.50 0.00 0.00 59.36 58.46 3dkl h GLU 78 Cb 0.78 0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 28.89 3dkl h GLU 78 CO -0.12 1.32 0.14 0.87 -1.40 0.00 0.00 179.01 179.82 3dkl h LYS 79 N 0.36 0.51 -0.21 2.33 1.57 -1.89 0.15 116.57 119.39 3dkl h LYS 79 Ca -0.13 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 58.53 3dkl h LYS 79 Cb 1.69 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.90 3dkl h LYS 79 CO 0.20 0.43 -0.11 0.82 -0.57 0.00 0.00 179.45 180.22 3dkl h ILE 80 N 0.51 1.31 -0.34 1.86 2.04 -1.30 -1.50 117.51 120.09 3dkl h ILE 80 Ca 0.13 -1.18 -0.05 0.00 1.00 0.00 0.00 64.86 64.76 3dkl h ILE 80 Cb 0.11 1.65 -0.01 0.00 -0.74 0.00 0.00 36.82 37.82 3dkl h ILE 80 CO -0.01 0.36 0.04 -0.61 0.00 0.00 0.00 178.15 177.92 3dkl h GLN 81 N 0.13 0.58 0.15 2.37 5.75 -1.19 0.17 115.11 123.08 3dkl h GLN 81 Ca 0.04 -0.17 0.01 0.00 -0.15 0.00 0.00 58.65 58.39 3dkl h GLN 81 Cb 0.60 -0.06 -0.05 0.00 1.07 0.00 0.00 27.48 29.05 3dkl h GLN 81 CO 0.03 0.67 -0.48 1.49 -2.65 0.00 0.00 178.83 177.89 3dkl h GLU 82 N 0.41 -0.71 -0.77 1.69 4.81 -0.68 -2.28 114.58 117.04 3dkl h GLU 82 Ca 0.10 0.05 0.10 0.00 -0.13 0.00 0.00 59.36 59.48 3dkl h GLU 82 Cb 0.39 0.16 -0.07 0.00 0.63 0.00 0.00 28.75 29.85 3dkl h GLU 82 CO 0.01 -0.47 0.41 0.00 -0.73 0.00 0.00 179.01 178.23 3dkl h ALA 83 N -0.40 1.09 -0.52 2.92 0.00 -1.15 -1.47 119.26 119.72 3dkl h ALA 83 Ca 0.00 0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.03 3dkl h ALA 83 Cb 0.74 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.40 3dkl h ALA 83 CO -0.25 0.01 0.20 -0.22 0.00 0.00 0.00 179.25 178.99 3dkl h LYS 84 N 0.68 0.38 -0.17 0.00 3.64 -0.73 -0.83 116.57 119.54 3dkl h LYS 84 Ca 0.38 -0.02 -0.20 0.00 -1.27 0.00 0.00 60.65 59.53 3dkl h LYS 84 Cb 0.40 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.13 3dkl h LYS 84 CO -0.27 0.25 -0.70 -0.44 -2.27 0.00 0.00 179.45 176.02 3dkl h ASP 85 N 0.40 0.83 0.45 4.20 3.32 -0.97 -1.79 116.42 122.86 3dkl h ASP 85 Ca 0.25 -0.52 -0.02 0.00 0.02 0.00 0.00 57.03 56.76 3dkl h ASP 85 Cb 0.25 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3dkl h ASP 85 CO -0.23 1.30 -0.22 0.58 -1.72 0.00 0.00 179.24 178.95 3dkl h VAL 86 N 0.51 0.52 -0.36 -1.35 2.07 -1.10 -3.14 116.25 113.41 3dkl h VAL 86 Ca -0.03 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.21 3dkl h VAL 86 Cb 1.31 0.65 -0.02 0.00 -1.52 0.00 0.00 31.29 31.71 3dkl h VAL 86 CO 0.14 0.05 0.23 1.88 0.02 0.00 0.00 177.57 179.89 3dkl h TYR 87 N -0.79 0.45 -0.80 1.57 0.99 -1.18 0.65 116.97 117.86 3dkl h TYR 87 Ca -0.06 0.01 0.08 0.00 2.00 0.00 0.00 58.73 60.76 3dkl h TYR 87 Cb 0.55 -0.15 -0.07 0.00 1.00 0.00 0.00 36.73 38.06 3dkl h TYR 87 CO -0.01 0.29 0.47 -0.22 -0.00 0.00 0.00 178.16 178.69 3dkl h LYS 88 N 0.48 0.79 0.14 4.88 1.63 -1.32 -0.55 116.57 122.63 3dkl h LYS 88 Ca 0.13 -0.05 -0.30 0.00 -0.85 0.00 0.00 60.65 59.58 3dkl h LYS 88 Cb -0.05 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 31.40 3dkl h LYS 88 CO -0.03 0.52 -1.47 0.93 -3.45 0.00 0.00 179.45 175.95 3dkl h GLU 89 N 0.82 0.29 -0.31 1.90 4.39 -1.27 -0.72 114.58 119.68 3dkl h GLU 89 Ca 0.37 -0.49 -0.15 0.00 0.34 0.00 0.00 59.36 59.43 3dkl h GLU 89 Cb 0.27 0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 29.10 3dkl h GLU 89 CO -0.21 1.18 -0.42 1.25 -1.16 0.00 0.00 179.01 179.65 3dkl h HIS 90 N 0.08 0.91 0.00 4.33 2.76 -0.61 -2.96 115.15 119.66 3dkl h HIS 90 Ca -0.22 -0.28 0.00 0.00 -2.20 0.00 0.00 60.37 57.67 3dkl h HIS 90 Cb 2.02 -0.19 0.00 0.00 1.55 0.00 0.00 27.41 30.79 3dkl h HIS 90 CO 0.07 1.04 -0.73 1.19 -1.30 0.00 0.00 177.93 178.20 3dkl n PHE 91 N -4.03 0.00 -3.67 5.26 3.01 -0.24 -4.98 117.46 112.81 3dkl n PHE 91 Ca -0.02 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.21 3dkl n PHE 91 Cb 0.55 -0.13 0.03 0.00 -0.01 0.00 0.00 39.48 39.92 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 -1.50 -3.93 0.00 -1.08 1.13 -0.38 -4.92 117.38 106.70 3dkl n GLN 92 Ca 0.05 0.60 0.00 0.00 -1.94 0.00 0.00 57.00 55.71 3dkl n GLN 92 Cb 0.33 -5.02 0.00 0.00 0.11 0.00 0.00 30.24 25.67 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 -3.00 0.00 -4.30 1.08 4.64 -0.59 -5.03 116.55 109.34 3dkl n ASP 93 Ca -0.25 0.00 -0.46 0.00 -1.38 0.00 0.00 54.79 52.71 3dkl n ASP 93 Cb 0.66 0.00 -0.05 0.00 -1.04 0.00 0.00 41.12 40.69 3dkl n ASP 93 CO 0.00 0.00 0.00 -1.81 -0.82 0.00 0.00 177.20 174.57 3dkl s ASP 94 N 0.00 6.28 -0.03 1.67 1.01 -1.26 -4.00 116.67 120.34 3dkl s ASP 94 Ca 0.00 -2.06 0.02 0.00 0.71 0.00 0.00 52.55 51.22 3dkl s ASP 94 Cb 0.00 -2.18 -0.03 0.00 1.01 0.00 0.00 42.92 41.71 3dkl s ASP 94 CO 0.00 -0.76 -0.00 1.33 0.21 0.00 0.00 175.17 175.95 3dkl n VAL 95 N 4.84 0.20 -1.65 -1.27 0.24 -1.26 -5.06 118.33 114.37 3dkl n VAL 95 Ca -0.06 -0.11 -0.48 0.00 -2.04 0.00 0.00 64.34 61.65 3dkl n VAL 95 Cb 0.42 -0.85 -0.05 0.00 -1.47 0.00 0.00 33.84 31.89 3dkl n VAL 95 CO 0.00 0.00 0.00 0.33 -2.14 0.00 0.00 176.83 175.02 3dkl n PHE 96 N -2.22 2.06 -1.58 6.34 7.35 -1.26 -4.85 117.46 123.29 3dkl n PHE 96 Ca -0.05 0.36 -0.41 0.00 -0.76 0.00 0.00 57.45 56.58 3dkl n PHE 96 Cb 0.59 -2.49 -0.03 0.00 0.35 0.00 0.00 39.48 37.89 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 3.52 3.30 -0.26 -2.13 5.15 -1.26 -4.73 115.26 118.86 3dkl n ASN 97 Ca 0.18 -2.76 -0.05 0.00 -0.60 0.00 0.00 54.58 51.34 3dkl n ASN 97 Cb 0.26 -1.43 0.06 0.00 -0.53 0.00 0.00 39.78 38.13 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 7.31 0.98 -0.26 1.20 4.81 -1.97 -2.53 114.58 124.11 3dkl h GLU 98 Ca 0.46 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.59 3dkl h GLU 98 Cb 0.70 -0.20 -0.01 0.00 0.63 0.00 0.00 28.75 29.87 3dkl h GLU 98 CO 1.82 0.71 0.13 0.87 -0.73 0.00 0.00 179.01 181.81 3dkl h LYS 99 N 0.98 0.38 -0.76 1.92 1.57 -1.99 0.36 116.57 119.04 3dkl h LYS 99 Ca 0.26 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.97 3dkl h LYS 99 Cb -0.01 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.19 3dkl h LYS 99 CO -0.05 0.37 0.42 0.78 -0.57 0.00 0.00 179.45 180.41 3dkl h GLY 100 N 0.30 1.13 1.20 3.86 0.00 -1.92 -0.01 103.07 107.63 3dkl h GLY 100 Ca 0.09 -0.51 -0.16 0.00 0.00 0.00 0.00 47.33 46.75 3dkl h GLY 100 CO -0.01 0.49 -0.43 1.49 0.00 0.00 0.00 176.54 178.07 3dkl h TRP 101 N 1.05 1.05 -0.99 5.60 4.06 -1.31 -2.81 115.95 122.59 3dkl h TRP 101 Ca 0.27 -0.33 0.07 0.00 2.06 0.00 0.00 58.89 60.96 3dkl h TRP 101 Cb 0.03 -0.21 -0.07 0.00 -1.00 0.00 0.00 29.16 27.90 3dkl h TRP 101 CO -0.00 1.14 0.63 -0.91 -3.56 0.00 0.00 178.44 175.74 3dkl h ASN 102 N 0.69 1.00 -0.32 -3.49 4.21 -0.61 -2.02 115.58 115.04 3dkl h ASN 102 Ca 0.05 0.02 0.06 0.00 1.21 0.00 0.00 56.30 57.63 3dkl h ASN 102 Cb 1.02 -0.19 -0.06 0.00 -1.12 0.00 0.00 38.32 37.97 3dkl h ASN 102 CO 0.10 0.62 -0.04 0.22 -1.29 0.00 0.00 177.43 177.04 3dkl h TYR 103 N 1.13 -0.10 -0.28 1.19 3.20 -0.77 0.96 116.97 122.30 3dkl h TYR 103 Ca 0.44 0.03 0.00 0.00 3.14 0.00 0.00 58.73 62.34 3dkl h TYR 103 Cb 0.22 0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 3dkl h TYR 103 CO -0.01 -0.10 0.18 0.82 -1.64 0.00 0.00 178.16 177.41 3dkl h ILE 104 N 0.04 1.09 -0.11 1.81 2.04 -1.22 0.52 117.51 121.68 3dkl h ILE 104 Ca 0.16 -0.19 0.04 0.00 1.00 0.00 0.00 64.86 65.87 3dkl h ILE 104 Cb 0.23 0.71 -0.05 0.00 -0.74 0.00 0.00 36.82 36.96 3dkl h ILE 104 CO -0.30 0.09 -0.21 0.25 0.00 0.00 0.00 178.15 177.98 3dkl h LEU 105 N 0.37 -0.63 -0.18 1.44 5.85 -1.19 -1.49 115.31 119.47 3dkl h LEU 105 Ca 0.10 0.10 -0.12 0.00 0.84 0.00 0.00 57.88 58.80 3dkl h LEU 105 Cb -0.01 0.28 0.00 0.00 0.37 0.00 0.00 40.66 41.30 3dkl h LEU 105 CO -0.02 -0.26 -0.37 -0.33 -0.34 0.00 0.00 178.44 177.12 3dkl h GLU 106 N -0.28 0.57 0.06 1.25 5.08 -0.33 -1.55 114.58 119.39 3dkl h GLU 106 Ca 0.09 -0.37 -0.26 0.00 -1.00 0.00 0.00 59.36 57.82 3dkl h GLU 106 Cb 0.41 0.05 0.01 0.00 0.50 0.00 0.00 28.75 29.72 3dkl h GLU 106 CO -0.27 0.98 -1.10 -0.22 -1.00 0.00 0.00 179.01 177.41 3dkl h LYS 107 N 0.24 0.47 0.00 2.33 1.63 -0.04 -3.38 116.57 117.81 3dkl h LYS 107 Ca 0.01 -0.59 0.00 0.00 -0.85 0.00 0.00 60.65 59.22 3dkl h LYS 107 Cb 0.96 0.19 0.00 0.00 -0.60 0.00 0.00 32.23 32.78 3dkl h LYS 107 CO 0.08 1.23 -0.09 0.66 -3.45 0.00 0.00 179.45 177.88 3dkl n TYR 108 N -3.72 0.00 -3.82 1.91 4.02 -0.62 -4.99 117.16 109.94 3dkl n TYR 108 Ca -0.09 -0.56 -0.27 0.00 -0.01 0.00 0.00 57.90 56.97 3dkl n TYR 108 Cb 0.92 -0.08 0.03 0.00 -0.02 0.00 0.00 39.34 40.19 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 -0.73 -3.80 -0.09 7.72 2.03 -0.59 -2.03 116.55 119.05 3dkl n ASP 109 Ca 0.07 -0.77 -0.01 0.00 0.52 0.00 0.00 54.79 54.59 3dkl n ASP 109 Cb 0.52 -4.05 -0.01 0.00 -0.72 0.00 0.00 41.12 36.86 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 -1.68 0.43 3.76 0.27 0.00 -0.84 -4.62 105.19 102.51 3dkl n GLY 110 Ca -0.07 -0.12 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.76 3.67 -0.18 1.61 3.76 -0.86 -0.55 115.29 120.98 3dkl s HIS 111 Ca 0.00 1.20 -0.29 0.00 -0.15 0.00 0.00 55.06 55.82 3dkl s HIS 111 Cb 0.00 -2.63 -0.02 0.00 1.11 0.00 0.00 32.58 31.04 3dkl s HIS 111 CO 0.00 0.32 1.46 -0.51 -0.85 0.00 0.00 174.74 175.16 3dkl s LEU 112 N -0.09 4.09 -1.07 0.89 1.43 -1.26 -4.78 118.68 117.89 3dkl s LEU 112 Ca 0.32 1.72 -0.20 0.00 -1.03 0.00 0.00 54.13 54.93 3dkl s LEU 112 Cb -0.18 -3.54 -0.07 0.00 0.03 0.00 0.00 46.19 42.43 3dkl s LEU 112 CO 0.17 -0.99 1.98 -0.81 0.23 0.00 0.00 176.35 176.93 3dkl n PRO 113 N 7.14 2.02 -3.97 1.29 -0.04 -1.26 -2.20 135.00 137.97 3dkl n PRO 113 Ca 0.16 -2.30 -0.14 0.00 -0.04 0.00 0.00 63.50 61.19 3dkl n PRO 113 Cb 0.45 -3.22 -0.14 0.00 -0.04 0.00 0.00 33.50 30.54 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 5.65 0.15 -0.14 0.52 -1.09 -1.26 -1.26 121.20 123.78 3dkl s ILE 114 Ca 0.57 -0.07 0.00 0.00 -2.23 0.00 0.00 60.65 58.92 3dkl s ILE 114 Cb 0.10 -0.14 -0.01 0.00 -1.58 0.00 0.00 42.46 40.83 3dkl s ILE 114 CO 0.07 0.05 -0.14 -0.70 -1.23 0.00 0.00 174.94 172.99 3dkl s GLU 115 N 0.02 3.31 -0.12 2.79 2.12 0.11 -1.23 118.70 125.70 3dkl s GLU 115 Ca 0.00 -0.72 0.03 0.00 0.36 0.00 0.00 54.97 54.64 3dkl s GLU 115 Cb -0.02 -2.62 0.00 0.00 0.26 0.00 0.00 34.13 31.76 3dkl s GLU 115 CO -0.00 0.13 -0.21 0.42 -0.54 0.00 0.00 175.26 175.06 3dkl s ILE 116 N 0.54 2.23 -0.08 -3.70 1.01 0.34 -1.59 121.20 119.95 3dkl s ILE 116 Ca -0.09 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.63 3dkl s ILE 116 Cb -0.16 -1.88 -0.03 0.00 0.01 0.00 0.00 42.46 40.40 3dkl s ILE 116 CO 0.04 0.55 -0.10 -0.54 0.00 0.00 0.00 174.94 174.88 3dkl s LYS 117 N 0.56 2.84 0.00 2.79 1.02 -0.70 -0.27 119.74 125.98 3dkl s LYS 117 Ca -0.13 -0.62 -0.07 0.00 0.02 0.00 0.00 55.97 55.17 3dkl s LYS 117 Cb -0.17 -2.54 0.00 0.00 -0.52 0.00 0.00 37.83 34.60 3dkl s LYS 117 CO 0.04 0.54 0.14 0.00 -0.92 0.00 0.00 175.35 175.15 3dkl s ALA 118 N -0.49 -0.34 0.54 5.17 0.00 0.07 -0.54 121.76 126.17 3dkl s ALA 118 Ca 0.07 -0.11 -0.22 0.00 0.00 0.00 0.00 51.96 51.70 3dkl s ALA 118 Cb -0.12 0.10 -0.05 0.00 0.00 0.00 0.00 23.12 23.05 3dkl s ALA 118 CO 0.02 -0.21 1.31 0.54 0.00 0.00 0.00 175.76 177.42 3dkl s VAL 119 N -1.36 2.30 0.35 0.00 0.11 -0.49 -1.48 120.40 119.84 3dkl s VAL 119 Ca -0.14 0.22 -0.28 0.00 -2.93 0.00 0.00 61.98 58.85 3dkl s VAL 119 Cb -0.07 -3.11 -0.12 0.00 -1.53 0.00 0.00 36.38 31.55 3dkl s VAL 119 CO 0.02 -0.01 1.36 -2.65 -3.33 0.00 0.00 175.10 170.49 3dkl n PRO 120 N -1.00 2.32 -1.75 1.54 -0.02 -1.26 -4.93 135.00 129.90 3dkl n PRO 120 Ca 0.10 0.81 -0.42 0.00 -2.02 0.00 0.00 63.50 61.98 3dkl n PRO 120 Cb 0.46 -2.45 -0.01 0.00 -0.02 0.00 0.00 33.50 31.48 3dkl n PRO 120 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dkl n GLU 121 N 0.54 2.52 0.00 -0.52 1.02 -1.26 -2.32 120.64 120.62 3dkl n GLU 121 Ca 0.04 0.89 0.00 0.00 -0.02 0.00 0.00 57.16 58.06 3dkl n GLU 121 Cb 0.37 -2.59 0.00 0.00 -0.02 0.00 0.00 31.44 29.20 3dkl n GLU 121 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dkl n GLY 122 N 0.90 3.29 3.67 0.62 0.00 0.12 -4.41 105.19 109.38 3dkl n GLY 122 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.62 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 -1.85 2.13 -3.58 1.61 3.01 -0.98 -2.68 117.46 115.11 3dkl n PHE 123 Ca 0.00 0.49 -0.41 0.00 1.01 0.00 0.00 57.45 58.54 3dkl n PHE 123 Cb 0.00 -2.43 -0.11 0.00 -0.01 0.00 0.00 39.48 36.93 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 -0.43 4.70 -0.07 -4.37 1.01 -1.26 -0.88 120.40 119.11 3dkl s VAL 124 Ca 0.64 -0.80 0.05 0.00 0.00 0.00 0.00 61.98 61.87 3dkl s VAL 124 Cb -0.63 -3.61 -0.01 0.00 0.00 0.00 0.00 36.38 32.13 3dkl s VAL 124 CO 0.54 -0.23 -0.24 -0.63 0.00 0.00 0.00 175.10 174.54 3dkl s ILE 125 N 1.58 1.96 0.78 2.22 -1.09 -0.53 -4.87 121.20 121.25 3dkl s ILE 125 Ca 0.03 -1.00 -0.14 0.00 -2.23 0.00 0.00 60.65 57.31 3dkl s ILE 125 Cb -0.19 -1.67 0.06 0.00 -1.58 0.00 0.00 42.46 39.08 3dkl s ILE 125 CO 0.07 0.54 1.22 -2.84 -1.23 0.00 0.00 174.94 172.70 3dkl s PRO 126 N 0.01 1.82 0.57 2.79 0.02 -1.26 -0.29 135.00 138.66 3dkl s PRO 126 Ca -0.08 1.79 -0.20 0.00 0.02 0.00 0.00 61.00 62.53 3dkl s PRO 126 Cb -0.15 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.53 3dkl s PRO 126 CO 0.05 -2.08 1.07 0.54 -0.33 0.00 0.00 177.00 176.25 3dkl n ARG 127 N -3.05 1.12 -0.95 5.54 5.12 -0.10 -3.70 116.66 120.63 3dkl n ARG 127 Ca 0.14 0.42 0.00 0.00 -1.93 0.00 0.00 57.85 56.48 3dkl n ARG 127 Cb 0.50 -2.26 0.00 0.00 -1.16 0.00 0.00 32.46 29.54 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 1.15 0.42 3.63 -0.13 0.00 0.38 -4.85 105.19 105.79 3dkl n GLY 128 Ca 0.13 -0.97 -0.31 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.88 4.78 0.11 1.61 0.01 -1.24 -4.86 114.94 112.46 3dkl s ASN 129 Ca 0.00 -0.16 -0.34 0.00 -0.71 0.00 0.00 52.86 51.65 3dkl s ASN 129 Cb 0.00 -1.12 -0.13 0.00 0.41 0.00 0.00 41.25 40.41 3dkl s ASN 129 CO 0.00 0.24 1.66 0.55 -1.51 0.00 0.00 177.10 178.04 3dkl n VAL 130 N 1.18 0.14 -0.09 1.60 3.14 -1.26 -4.38 118.33 118.66 3dkl n VAL 130 Ca -0.14 -0.03 -0.11 0.00 -2.96 0.00 0.00 64.34 61.11 3dkl n VAL 130 Cb 0.52 -1.65 -0.10 0.00 -1.06 0.00 0.00 33.84 31.54 3dkl n VAL 130 CO 0.00 0.00 0.00 0.18 -6.46 0.00 0.00 176.83 170.55 3dkl n LEU 131 N 4.23 1.59 -3.51 6.55 4.77 -0.22 -4.87 117.00 125.54 3dkl n LEU 131 Ca 0.18 -0.06 -0.15 0.00 -0.03 0.00 0.00 56.01 55.96 3dkl n LEU 131 Cb 0.30 -0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.15 3dkl n LEU 131 CO 0.66 0.62 0.38 0.72 -1.33 0.00 0.00 177.39 178.43 3dkl s PHE 132 N -2.38 -0.55 0.14 -1.77 -0.12 -1.23 -1.39 117.98 110.69 3dkl s PHE 132 Ca -0.18 0.67 0.07 0.00 -0.05 0.00 0.00 56.93 57.44 3dkl s PHE 132 Cb 0.06 0.43 -0.04 0.00 -0.63 0.00 0.00 43.02 42.84 3dkl s PHE 132 CO 0.53 -0.69 -0.16 0.95 -0.05 0.00 0.00 175.22 175.80 3dkl s THR 133 N -2.38 1.54 -0.01 -4.49 -4.23 0.30 -1.28 115.64 105.09 3dkl s THR 133 Ca -0.05 -1.81 0.01 0.00 -1.18 0.00 0.00 61.69 58.65 3dkl s THR 133 Cb -0.01 -1.67 0.01 0.00 1.34 0.00 0.00 72.50 72.17 3dkl s THR 133 CO -0.01 -0.38 -0.02 -0.69 -0.54 0.00 0.00 174.62 172.99 3dkl s VAL 134 N -2.12 0.18 0.05 2.29 1.01 -0.28 -1.72 120.40 119.81 3dkl s VAL 134 Ca 0.12 -0.05 -0.15 0.00 0.00 0.00 0.00 61.98 61.90 3dkl s VAL 134 Cb -0.05 -0.19 0.03 0.00 0.00 0.00 0.00 36.38 36.17 3dkl s VAL 134 CO 0.04 0.08 0.35 -1.83 0.00 0.00 0.00 175.10 173.74 3dkl s GLU 135 N 0.24 0.87 0.34 2.72 -1.05 -0.62 -0.60 118.70 120.61 3dkl s GLU 135 Ca -0.02 -0.47 -0.18 0.00 -0.15 0.00 0.00 54.97 54.15 3dkl s GLU 135 Cb -0.04 0.38 -0.10 0.00 -0.44 0.00 0.00 34.13 33.93 3dkl s GLU 135 CO -0.01 -0.29 0.81 0.54 0.95 0.00 0.00 175.26 177.26 3dkl s ASN 136 N -2.09 6.89 0.00 0.83 4.22 -1.23 -0.71 114.94 122.86 3dkl s ASN 136 Ca -0.04 1.45 0.12 0.00 -2.14 0.00 0.00 52.86 52.24 3dkl s ASN 136 Cb -0.01 -2.44 0.16 0.00 1.28 0.00 0.00 41.25 40.25 3dkl s ASN 136 CO -0.04 -0.21 1.00 0.35 -2.04 0.00 0.00 177.10 176.16 3dkl n THR 137 N -0.24 0.30 -4.56 0.54 -2.24 -0.39 -4.84 114.28 102.85 3dkl n THR 137 Ca 0.04 -0.65 -0.26 0.00 -2.27 0.00 0.00 64.05 60.91 3dkl n THR 137 Cb 0.53 1.03 -0.17 0.00 -2.10 0.00 0.00 70.33 69.62 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 -1.00 2.03 0.45 3.42 3.68 -1.26 -5.02 116.67 118.97 3dkl s ASP 138 Ca 0.17 -0.34 0.16 0.00 2.13 0.00 0.00 52.55 54.67 3dkl s ASP 138 Cb 0.11 -0.92 1.09 0.00 -1.45 0.00 0.00 42.92 41.75 3dkl s ASP 138 CO 0.16 0.03 1.98 -0.65 0.13 0.00 0.00 175.17 176.81 3dkl h PRO 139 N 7.12 0.33 0.00 4.34 0.11 -1.90 0.94 132.00 142.94 3dkl h PRO 139 Ca -0.30 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.79 3dkl h PRO 139 Cb 1.19 -0.07 -0.00 0.00 0.11 0.00 0.00 31.00 32.22 3dkl h PRO 139 CO 0.47 0.22 -0.03 0.93 -0.21 0.00 0.00 178.00 179.38 3dkl h GLU 140 N 0.34 0.00 -0.67 1.05 4.39 -1.90 -3.14 114.58 114.65 3dkl h GLU 140 Ca 0.28 0.00 -0.40 0.00 0.34 0.00 0.00 59.36 59.58 3dkl h GLU 140 Cb 0.63 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 29.05 3dkl h GLU 140 CO -0.07 0.03 0.17 0.00 -1.16 0.00 0.00 179.01 177.98 3dkl h TYR 142 N 1.31 0.23 0.00 0.00 -0.00 -1.65 -0.60 116.97 116.27 3dkl h TYR 142 Ca 0.41 0.01 0.00 0.00 0.00 0.00 0.00 58.73 59.15 3dkl h TYR 142 Cb 1.82 -0.07 0.00 0.00 0.00 0.00 0.00 36.73 38.47 3dkl h TYR 142 CO 1.23 0.06 0.00 -2.67 -0.00 0.00 0.00 178.16 176.79 3dkl n TRP 143 N -4.39 0.95 0.08 0.10 4.27 -1.26 -3.80 117.44 113.39 3dkl n TRP 143 Ca 0.17 0.29 -0.10 0.00 -3.89 0.00 0.00 57.50 53.98 3dkl n TRP 143 Cb 0.78 -0.98 -0.11 0.00 -1.36 0.00 0.00 31.31 29.65 3dkl n TRP 143 CO 0.00 0.00 0.00 1.25 -2.29 0.00 0.00 177.69 176.65 3dkl h LEU 144 N 0.00 0.16 -0.23 5.67 5.85 -1.46 -3.13 115.31 122.17 3dkl h LEU 144 Ca 0.00 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.61 3dkl h LEU 144 Cb 0.68 -0.05 -0.07 0.00 0.37 0.00 0.00 40.66 41.59 3dkl h LEU 144 CO 0.00 1.11 -0.42 0.74 -0.34 0.00 0.00 178.44 179.53 3dkl h THR 145 N 0.03 0.14 0.00 1.05 2.02 -1.69 -2.77 112.91 111.69 3dkl h THR 145 Ca -0.05 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.13 3dkl h THR 145 Cb 1.80 0.14 0.00 0.00 -1.74 0.00 0.00 68.15 68.35 3dkl h THR 145 CO 0.15 0.00 -0.28 0.78 0.37 0.00 0.00 175.52 176.54 3dkl h ASN 146 N -0.43 0.00 -0.90 4.18 4.21 -1.82 -3.18 115.58 117.65 3dkl h ASN 146 Ca 0.10 -0.09 0.25 0.00 1.21 0.00 0.00 56.30 57.77 3dkl h ASN 146 Cb 0.61 0.00 -0.15 0.00 -1.12 0.00 0.00 38.32 37.66 3dkl h ASN 146 CO -0.46 0.04 0.21 -0.25 -1.29 0.00 0.00 177.43 175.68 3dkl h TRP 147 N 0.00 0.29 -0.71 1.19 2.91 -1.43 -2.59 115.95 115.61 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 0.76 0.02 0.00 0.00 -0.51 0.00 0.00 29.16 29.43 3dkl h TRP 147 CO 0.00 -0.26 0.00 0.44 -1.03 0.00 0.00 178.44 177.59 3dkl n ILE 148 N -5.28 0.94 -0.12 2.65 -5.35 -1.17 -4.12 119.36 106.91 3dkl n ILE 148 Ca 0.22 -0.96 -0.05 0.00 -0.27 0.00 0.00 62.75 61.69 3dkl n ILE 148 Cb 0.71 0.54 0.01 0.00 -1.74 0.00 0.00 39.64 39.17 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 4.33 -0.00 -0.23 6.28 4.81 -1.54 -2.38 114.58 125.85 3dkl h GLU 149 Ca 0.00 0.00 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 3dkl h GLU 149 Cb 0.99 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.33 3dkl h GLU 149 CO 0.00 -0.00 -0.04 1.15 -0.73 0.00 0.00 179.01 179.39 3dkl h THR 150 N -0.00 0.80 -0.47 0.32 2.02 -1.79 0.12 112.91 113.91 3dkl h THR 150 Ca 0.19 -0.01 -0.11 0.00 0.77 0.00 0.00 66.41 67.25 3dkl h THR 150 Cb 0.29 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.45 3dkl h THR 150 CO -0.41 0.00 -0.16 -0.29 0.37 0.00 0.00 175.52 175.04 3dkl h ILE 151 N 0.03 1.27 0.00 3.11 2.10 -1.75 -3.02 117.51 119.24 3dkl h ILE 151 Ca 0.11 -1.29 -0.18 0.00 1.08 0.00 0.00 64.86 64.58 3dkl h ILE 151 Cb 0.16 1.08 -0.03 0.00 -1.09 0.00 0.00 36.82 36.94 3dkl h ILE 151 CO -0.22 0.45 -0.85 -0.07 -1.08 0.00 0.00 178.15 176.38 3dkl h LEU 152 N 0.80 0.01 -1.79 2.19 3.38 -0.86 -3.01 115.31 116.02 3dkl h LEU 152 Ca 0.12 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 58.05 3dkl h LEU 152 Cb 0.70 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 3dkl h LEU 152 CO 0.05 0.85 -0.15 0.58 0.09 0.00 0.00 178.44 179.87 3dkl h VAL 153 N 0.00 0.66 0.00 1.22 2.07 -0.65 -1.19 116.25 118.36 3dkl h VAL 153 Ca -0.01 -0.63 0.00 0.00 0.82 0.00 0.00 66.70 66.88 3dkl h VAL 153 Cb 1.50 1.39 0.00 0.00 -1.52 0.00 0.00 31.29 32.67 3dkl h VAL 153 CO 0.11 0.15 0.00 0.00 0.02 0.00 0.00 177.57 177.85 3dkl n GLN 154 N -3.71 0.11 0.32 1.57 6.02 -1.14 -0.75 117.38 119.80 3dkl n GLN 154 Ca -0.02 0.50 0.17 0.00 -0.01 0.00 0.00 57.00 57.64 3dkl n GLN 154 Cb 0.26 -1.79 0.90 0.00 1.02 0.00 0.00 30.24 30.63 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 -1.00 1.08 4.64 -1.39 -1.52 113.55 115.36 3dkl h SER 155 Ca 0.00 0.00 0.24 0.00 -0.47 0.00 0.00 61.79 61.56 3dkl h SER 155 Cb 0.14 0.00 -0.09 0.00 -0.31 0.00 0.00 62.40 62.14 3dkl h SER 155 CO 0.00 0.00 0.65 4.11 -0.87 0.00 0.00 176.83 180.72 3dkl h TRP 156 N 0.00 0.67 0.47 4.77 5.08 -1.17 -2.22 115.95 123.55 3dkl h TRP 156 Ca 0.01 0.02 -0.02 0.00 1.08 0.00 0.00 58.89 59.98 3dkl h TRP 156 Cb 0.55 -0.20 0.00 0.00 -3.00 0.00 0.00 29.16 26.52 3dkl h TRP 156 CO 0.00 0.10 -0.23 -0.92 -1.28 0.00 0.00 178.44 176.11 3dkl h TYR 157 N 0.43 -0.59 -0.58 0.12 3.20 -1.52 0.01 116.97 118.04 3dkl h TYR 157 Ca 0.56 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.44 3dkl h TYR 157 Cb 1.36 0.20 -0.03 0.00 1.54 0.00 0.00 36.73 39.80 3dkl h TYR 157 CO -0.00 -0.31 0.39 -1.00 -1.64 0.00 0.00 178.16 175.60 3dkl h PRO 158 N -1.11 0.72 -0.54 1.82 0.13 -1.73 -0.73 132.00 130.56 3dkl h PRO 158 Ca -0.07 -0.04 0.07 0.00 -0.87 0.00 0.00 66.00 65.09 3dkl h PRO 158 Cb 0.55 -0.16 -0.06 0.00 0.13 0.00 0.00 31.00 31.46 3dkl h PRO 158 CO 0.11 0.48 0.21 0.82 -0.23 0.00 0.00 178.00 179.39 3dkl h ILE 159 N 0.74 0.84 -0.02 -3.56 2.04 -1.21 -1.84 117.51 114.50 3dkl h ILE 159 Ca 0.22 -0.14 -0.24 0.00 1.00 0.00 0.00 64.86 65.70 3dkl h ILE 159 Cb -0.01 0.39 0.01 0.00 -0.74 0.00 0.00 36.82 36.48 3dkl h ILE 159 CO -0.05 0.07 -0.96 0.74 0.00 0.00 0.00 178.15 177.95 3dkl h THR 160 N 0.41 1.33 -0.25 -0.27 2.02 -0.49 0.68 112.91 116.34 3dkl h THR 160 Ca 0.26 -2.29 -0.01 0.00 0.77 0.00 0.00 66.41 65.14 3dkl h THR 160 Cb 0.27 2.33 -0.01 0.00 -1.74 0.00 0.00 68.15 69.00 3dkl h THR 160 CO -0.25 0.70 0.11 0.58 0.37 0.00 0.00 175.52 177.03 3dkl h VAL 161 N 0.34 1.16 -0.59 3.16 2.07 -1.06 -0.18 116.25 121.16 3dkl h VAL 161 Ca -0.10 -0.46 -0.02 0.00 0.82 0.00 0.00 66.70 66.94 3dkl h VAL 161 Cb 1.60 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 32.34 3dkl h VAL 161 CO 0.18 0.16 0.30 0.00 0.02 0.00 0.00 177.57 178.23 3dkl h ALA 162 N 0.96 0.75 0.02 1.67 0.00 -1.26 0.15 119.26 121.56 3dkl h ALA 162 Ca 0.09 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 3dkl h ALA 162 Cb 0.15 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.70 3dkl h ALA 162 CO -0.01 0.29 -0.01 1.15 0.00 0.00 0.00 179.25 180.67 3dkl h THR 163 N 0.79 1.20 -0.33 0.00 2.02 -0.69 -0.94 112.91 114.96 3dkl h THR 163 Ca 0.20 -0.71 -0.12 0.00 0.77 0.00 0.00 66.41 66.56 3dkl h THR 163 Cb 0.08 1.68 -0.01 0.00 -1.74 0.00 0.00 68.15 68.15 3dkl h THR 163 CO -0.03 0.18 -0.28 -1.13 0.37 0.00 0.00 175.52 174.63 3dkl h ASN 164 N -0.34 0.69 -0.71 4.18 -1.24 -0.89 0.15 115.58 117.43 3dkl h ASN 164 Ca -0.00 -0.26 -0.01 0.00 0.71 0.00 0.00 56.30 56.73 3dkl h ASN 164 Cb 0.32 -0.19 -0.03 0.00 0.73 0.00 0.00 38.32 39.15 3dkl h ASN 164 CO 0.01 0.94 0.39 -1.28 -1.29 0.00 0.00 177.43 176.20 3dkl h SER 165 N 0.58 0.88 -0.32 1.15 0.87 -0.74 -1.66 113.55 114.31 3dkl h SER 165 Ca 0.07 -0.09 -0.11 0.00 -1.23 0.00 0.00 61.79 60.43 3dkl h SER 165 Cb 0.77 -0.22 -0.01 0.00 -0.44 0.00 0.00 62.40 62.50 3dkl h SER 165 CO 0.06 0.72 -0.20 -0.09 -0.53 0.00 0.00 176.83 176.79 3dkl h ARG 166 N 0.97 0.80 -0.75 2.24 2.43 -0.58 -1.93 114.38 117.56 3dkl h ARG 166 Ca 0.25 -0.31 0.00 0.00 -0.81 0.00 0.00 59.98 59.11 3dkl h ARG 166 Cb 0.03 -0.04 -0.04 0.00 -0.42 0.00 0.00 29.97 29.50 3dkl h ARG 166 CO -0.04 0.93 0.48 0.93 -1.51 0.00 0.00 179.97 180.75 3dkl h GLU 167 N 0.70 1.00 -0.13 0.20 4.39 -0.55 -1.36 114.58 118.84 3dkl h GLU 167 Ca 0.10 -0.07 -0.11 0.00 0.34 0.00 0.00 59.36 59.62 3dkl h GLU 167 Cb 0.71 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 3dkl h GLU 167 CO 0.05 0.68 -0.39 1.96 -1.16 0.00 0.00 179.01 180.16 3dkl h GLN 168 N 1.03 0.28 -0.45 2.33 4.20 -0.68 -2.84 115.11 118.98 3dkl h GLN 168 Ca 0.27 -0.13 -0.06 0.00 0.06 0.00 0.00 58.65 58.80 3dkl h GLN 168 Cb -0.08 -0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.67 3dkl h GLN 168 CO -0.06 0.63 0.03 -0.22 -0.67 0.00 0.00 178.83 178.55 3dkl h LYS 169 N 0.23 0.72 -0.05 1.46 3.64 -0.61 -0.52 116.57 121.44 3dkl h LYS 169 Ca 0.02 -0.17 -0.00 0.00 -1.27 0.00 0.00 60.65 59.23 3dkl h LYS 169 Cb 0.80 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 32.52 3dkl h LYS 169 CO 0.06 0.71 0.02 0.87 -2.27 0.00 0.00 179.45 178.84 3dkl h LYS 170 N 0.68 0.07 -0.23 1.90 1.57 -1.12 0.36 116.57 119.80 3dkl h LYS 170 Ca 0.14 -0.01 0.04 0.00 -1.87 0.00 0.00 60.65 58.95 3dkl h LYS 170 Cb 0.37 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.63 3dkl h LYS 170 CO 0.01 0.21 -0.02 0.82 -0.57 0.00 0.00 179.45 179.90 3dkl h ILE 171 N -0.08 0.81 -0.57 1.86 2.04 -1.35 -1.42 117.51 118.79 3dkl h ILE 171 Ca 0.02 -0.02 -0.02 0.00 1.00 0.00 0.00 64.86 65.84 3dkl h ILE 171 Cb 0.16 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 3dkl h ILE 171 CO -0.00 0.01 0.30 -0.07 0.00 0.00 0.00 178.15 178.38 3dkl h LEU 172 N 0.05 0.73 -0.15 1.44 3.38 -0.78 -2.81 115.31 117.16 3dkl h LEU 172 Ca 0.11 -0.11 0.03 0.00 0.09 0.00 0.00 57.88 58.00 3dkl h LEU 172 Cb 0.15 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.68 3dkl h LEU 172 CO -0.21 0.63 -0.05 0.00 0.09 0.00 0.00 178.44 178.90 3dkl h ALA 173 N 1.13 0.08 -0.56 1.53 0.00 -0.10 -0.75 119.26 120.58 3dkl h ALA 173 Ca 0.20 0.06 0.06 0.00 0.00 0.00 0.00 54.91 55.23 3dkl h ALA 173 Cb 0.08 0.14 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 3dkl h ALA 173 CO -0.03 -0.50 0.28 -0.22 0.00 0.00 0.00 179.25 178.78 3dkl h LYS 174 N -0.02 0.51 0.09 0.00 3.64 -1.08 -0.13 116.57 119.57 3dkl h LYS 174 Ca 0.08 -0.03 -0.26 0.00 -1.27 0.00 0.00 60.65 59.17 3dkl h LYS 174 Cb 0.14 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 3dkl h LYS 174 CO -0.17 0.34 -1.19 1.88 -2.27 0.00 0.00 179.45 178.03 3dkl h TYR 175 N 0.52 0.33 -0.37 1.91 -1.99 -1.25 -1.64 116.97 114.49 3dkl h TYR 175 Ca 0.26 -0.24 -0.03 0.00 2.00 0.00 0.00 58.73 60.71 3dkl h TYR 175 Cb 0.19 -0.01 -0.02 0.00 2.00 0.00 0.00 36.73 38.89 3dkl h TYR 175 CO -0.11 1.20 0.11 1.25 -0.00 0.00 0.00 178.16 180.61 3dkl h LEU 176 N 0.05 0.54 -0.11 3.88 5.85 -1.06 0.91 115.31 125.36 3dkl h LEU 176 Ca -0.10 -0.21 -0.00 0.00 0.84 0.00 0.00 57.88 58.40 3dkl h LEU 176 Cb 1.91 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 42.80 3dkl h LEU 176 CO 0.18 0.61 0.06 0.25 -0.34 0.00 0.00 178.44 179.19 3dkl h LEU 177 N 0.44 0.14 -0.30 2.25 5.85 -1.03 -1.48 115.31 121.19 3dkl h LEU 177 Ca 0.12 -0.09 0.01 0.00 0.84 0.00 0.00 57.88 58.76 3dkl h LEU 177 Cb 0.27 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 3dkl h LEU 177 CO -0.00 0.19 0.18 -0.08 -0.34 0.00 0.00 178.44 178.38 3dkl h GLU 178 N 0.08 0.35 0.00 1.25 4.81 -1.23 0.13 114.58 119.98 3dkl h GLU 178 Ca 0.04 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.25 3dkl h GLU 178 Cb 0.08 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3dkl h GLU 178 CO -0.01 0.23 -0.28 0.25 -0.73 0.00 0.00 179.01 178.48 3dkl n THR 179 N -4.92 0.07 0.00 0.32 -2.24 0.31 -4.49 114.28 103.34 3dkl n THR 179 Ca -0.01 -0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3dkl n THR 179 Cb 0.05 -0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.13 3dkl n THR 179 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3dkl n SER 180 N -1.61 0.36 0.00 3.42 3.41 -0.56 -4.52 113.62 114.12 3dkl n SER 180 Ca 0.06 -0.01 0.00 0.00 -0.26 0.00 0.00 58.87 58.66 3dkl n SER 180 Cb 0.35 0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.40 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 0.20 1.13 2.94 5.00 0.00 0.46 -4.85 105.19 110.08 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 -1.56 -0.17 1.61 0.23 -1.26 -4.97 115.26 109.14 3dkl n ASN 182 Ca 0.00 -2.41 0.09 0.00 -0.53 0.00 0.00 54.58 51.73 3dkl n ASN 182 Cb 0.00 2.70 0.14 0.00 -2.08 0.00 0.00 39.78 40.54 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 2.26 -4.68 -4.53 4.32 -1.26 -3.41 117.00 109.70 3dkl n LEU 183 Ca -0.04 -3.07 -0.45 0.00 -0.02 0.00 0.00 56.01 52.43 3dkl n LEU 183 Cb 0.48 -0.42 -0.04 0.00 -1.62 0.00 0.00 43.42 41.83 3dkl n LEU 183 CO 0.23 0.77 1.39 0.47 -1.22 0.00 0.00 177.39 179.03 3dkl n ASP 184 N -1.31 3.55 0.00 -1.43 8.00 -1.26 -1.94 116.55 122.15 3dkl n ASP 184 Ca 0.15 1.01 0.00 0.00 0.71 0.00 0.00 54.79 56.67 3dkl n ASP 184 Cb 0.65 -1.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.30 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 4.01 0.91 0.34 0.44 0.00 -1.26 -4.88 105.19 104.74 3dkl n GLY 185 Ca 0.19 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.42 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 0.58 0.00 0.99 5.85 -1.80 -1.08 115.31 119.86 3dkl h LEU 186 Ca 0.00 0.17 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3dkl h LEU 186 Cb 0.00 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.12 3dkl h LEU 186 CO 0.00 -0.03 0.00 -0.62 -0.34 0.00 0.00 178.44 177.45 3dkl n GLU 187 N -4.98 0.04 -0.23 1.25 1.02 -1.26 -1.79 120.64 114.69 3dkl n GLU 187 Ca 0.29 0.26 0.06 0.00 -0.02 0.00 0.00 57.16 57.75 3dkl n GLU 187 Cb 0.87 -1.50 0.17 0.00 -0.02 0.00 0.00 31.44 30.96 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 -1.45 0.55 0.83 -0.32 4.02 -0.41 -0.70 117.16 119.68 3dkl n TYR 188 Ca 0.04 -0.59 0.13 0.00 -0.01 0.00 0.00 57.90 57.46 3dkl n TYR 188 Cb 0.13 -0.09 0.33 0.00 -0.02 0.00 0.00 39.34 39.69 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 0.23 0.12 -3.72 -0.72 4.76 -0.74 -4.61 118.16 113.48 3dkl n LYS 189 Ca 0.13 0.05 -0.28 0.00 -2.87 0.00 0.00 58.31 55.34 3dkl n LYS 189 Cb 0.53 -1.59 -0.16 0.00 -1.84 0.00 0.00 35.03 31.96 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 -3.54 1.30 -0.15 -0.35 2.96 -1.25 -0.24 118.68 117.40 3dkl s LEU 190 Ca 0.10 -0.98 -0.07 0.00 -0.22 0.00 0.00 54.13 52.95 3dkl s LEU 190 Cb 0.16 -0.62 -0.04 0.00 0.50 0.00 0.00 46.19 46.19 3dkl s LEU 190 CO 0.66 -0.33 0.10 -2.28 -1.32 0.00 0.00 176.35 173.17 3dkl s HIS 191 N 1.84 3.40 -0.35 5.38 5.65 0.21 -4.61 115.29 126.81 3dkl s HIS 191 Ca 0.01 0.32 -0.29 0.00 0.25 0.00 0.00 55.06 55.35 3dkl s HIS 191 Cb -0.17 -2.02 0.01 0.00 -1.18 0.00 0.00 32.58 29.23 3dkl s HIS 191 CO -0.13 0.43 1.19 0.34 -0.65 0.00 0.00 174.74 175.92 3dkl s ASP 192 N -0.27 6.74 -0.02 9.88 -1.08 -1.01 -0.78 116.67 130.13 3dkl s ASP 192 Ca 0.10 0.96 0.11 0.00 -0.52 0.00 0.00 52.55 53.20 3dkl s ASP 192 Cb -0.12 -2.54 0.33 0.00 -1.46 0.00 0.00 42.92 39.13 3dkl s ASP 192 CO 0.01 -1.06 1.27 0.49 0.52 0.00 0.00 175.17 176.40 3dkl n PHE 193 N 7.46 0.51 0.50 -5.34 0.99 -0.19 -0.67 117.46 120.72 3dkl n PHE 193 Ca 0.13 -0.53 0.08 0.00 -0.00 0.00 0.00 57.45 57.13 3dkl n PHE 193 Cb 0.47 -0.05 0.21 0.00 -1.00 0.00 0.00 39.48 39.11 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 0.43 1.21 0.19 1.37 0.00 -1.23 -4.40 105.19 102.75 3dkl n GLY 194 Ca 0.12 -0.51 -0.04 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 2.78 0.28 0.00 1.61 5.03 -1.90 -1.50 116.97 123.27 3dkl h TYR 195 Ca 0.00 0.02 -0.02 0.00 2.58 0.00 0.00 58.73 61.31 3dkl h TYR 195 Cb 0.63 -0.06 -0.00 0.00 1.55 0.00 0.00 36.73 38.85 3dkl h TYR 195 CO 0.31 0.10 -0.11 0.07 -1.32 0.00 0.00 178.16 177.21 3dkl h ARG 196 N 0.33 0.00 -0.72 1.82 0.11 -1.99 -3.30 114.38 110.63 3dkl h ARG 196 Ca 0.22 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.30 3dkl h ARG 196 Cb 0.22 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.30 3dkl h ARG 196 CO -0.22 0.11 0.00 0.41 0.10 0.00 0.00 179.97 180.36 3dkl n GLY 197 N 0.53 2.38 4.02 0.08 0.00 -0.60 -4.91 105.19 106.69 3dkl n GLY 197 Ca 0.02 -0.78 -0.19 0.00 0.00 0.00 0.00 46.02 45.06 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 -1.04 2.43 -0.94 1.61 -7.23 -1.02 -4.65 120.40 109.56 3dkl s VAL 198 Ca 0.48 -0.96 0.24 0.00 -1.81 0.00 0.00 61.98 59.94 3dkl s VAL 198 Cb 0.25 -2.47 -0.05 0.00 0.56 0.00 0.00 36.38 34.67 3dkl s VAL 198 CO 0.33 0.00 1.28 -1.54 -0.31 0.00 0.00 175.10 174.86 3dkl n SER 199 N -2.17 0.61 -3.65 4.85 3.41 -1.26 -4.94 113.62 110.46 3dkl n SER 199 Ca 0.13 -0.35 -0.06 0.00 -0.26 0.00 0.00 58.87 58.33 3dkl n SER 199 Cb 0.61 0.44 -0.02 0.00 -0.26 0.00 0.00 64.21 64.98 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 -3.17 -0.26 0.14 4.04 1.04 -1.26 -5.01 113.70 109.21 3dkl s SER 200 Ca 0.09 -0.25 -0.18 0.00 0.48 0.00 0.00 55.95 56.09 3dkl s SER 200 Cb 0.17 0.46 0.02 0.00 0.10 0.00 0.00 66.02 66.76 3dkl s SER 200 CO 0.74 -0.81 1.72 1.56 0.98 0.00 0.00 173.24 177.43 3dkl h GLN 201 N 2.00 0.10 -0.00 4.02 1.08 -1.94 -1.48 115.11 118.90 3dkl h GLN 201 Ca -0.24 -0.01 0.01 0.00 -1.45 0.00 0.00 58.65 56.97 3dkl h GLN 201 Cb 1.24 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.63 3dkl h GLN 201 CO 0.28 0.07 -0.05 1.49 -0.95 0.00 0.00 178.83 179.67 3dkl h GLU 202 N 0.11 -0.08 -0.68 1.46 4.81 -2.01 -1.79 114.58 116.41 3dkl h GLU 202 Ca 0.13 0.01 0.14 0.00 -0.13 0.00 0.00 59.36 59.51 3dkl h GLU 202 Cb 0.16 0.02 -0.11 0.00 0.63 0.00 0.00 28.75 29.45 3dkl h GLU 202 CO -0.20 -0.05 0.10 1.15 -0.73 0.00 0.00 179.01 179.27 3dkl h THR 203 N -0.08 0.51 -0.11 0.32 2.02 -1.94 -1.81 112.91 111.82 3dkl h THR 203 Ca 0.02 -0.07 0.04 0.00 0.77 0.00 0.00 66.41 67.17 3dkl h THR 203 Cb 0.11 0.29 -0.05 0.00 -1.74 0.00 0.00 68.15 66.75 3dkl h THR 203 CO -0.05 0.04 -0.24 0.00 0.37 0.00 0.00 175.52 175.64 3dkl h ALA 204 N 1.58 -0.23 -0.10 6.16 0.00 -0.43 0.44 119.26 126.69 3dkl h ALA 204 Ca 0.37 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.33 3dkl h ALA 204 Cb 0.61 0.45 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 3dkl h ALA 204 CO -0.51 -0.70 -0.03 0.78 0.00 0.00 0.00 179.25 178.78 3dkl h GLY 205 N -0.31 0.06 0.87 0.00 0.00 -1.00 -1.11 103.07 101.58 3dkl h GLY 205 Ca 0.09 0.04 0.01 0.00 0.00 0.00 0.00 47.33 47.48 3dkl h GLY 205 CO -0.29 -0.05 -0.03 -2.22 0.00 0.00 0.00 176.54 173.96 3dkl h ILE 206 N -0.01 0.91 -0.20 2.60 2.04 -1.00 -0.34 117.51 121.51 3dkl h ILE 206 Ca 0.05 0.00 -0.12 0.00 1.00 0.00 0.00 64.86 65.80 3dkl h ILE 206 Cb 0.09 0.91 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 3dkl h ILE 206 CO -0.11 0.00 -0.33 1.23 0.00 0.00 0.00 178.15 178.94 3dkl h GLY 207 N -0.04 0.63 0.88 5.37 0.00 -0.90 -2.14 103.07 106.86 3dkl h GLY 207 Ca 0.03 -0.72 0.04 0.00 0.00 0.00 0.00 47.33 46.68 3dkl h GLY 207 CO -0.06 0.64 0.66 0.00 0.00 0.00 0.00 176.54 177.78 3dkl h ALA 208 N 0.61 1.34 -0.76 3.60 0.00 -1.17 -0.96 119.26 121.91 3dkl h ALA 208 Ca 0.02 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 3dkl h ALA 208 Cb 0.91 -0.36 -0.04 0.00 0.00 0.00 0.00 17.79 18.31 3dkl h ALA 208 CO 0.07 0.56 0.34 0.66 0.00 0.00 0.00 179.25 180.89 3dkl h SER 209 N 1.27 1.01 -0.60 0.00 4.64 -0.85 -2.00 113.55 117.02 3dkl h SER 209 Ca 0.40 -0.13 -0.09 0.00 -0.47 0.00 0.00 61.79 61.51 3dkl h SER 209 Cb 0.00 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 61.81 3dkl h SER 209 CO -0.13 0.87 0.04 0.00 -0.87 0.00 0.00 176.83 176.74 3dkl h ALA 210 N 1.28 0.91 -0.48 5.18 0.00 -0.63 -1.93 119.26 123.60 3dkl h ALA 210 Ca 0.26 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.83 3dkl h ALA 210 Cb 0.14 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 3dkl h ALA 210 CO -0.03 0.66 0.07 1.25 0.00 0.00 0.00 179.25 181.20 3dkl h HIS 211 N 0.97 0.77 0.00 0.00 6.17 -0.93 -2.25 115.15 119.87 3dkl h HIS 211 Ca 0.18 -0.08 0.00 0.00 0.71 0.00 0.00 60.37 61.18 3dkl h HIS 211 Cb 0.50 -0.22 0.00 0.00 2.52 0.00 0.00 27.41 30.21 3dkl h HIS 211 CO 0.03 0.68 0.00 1.28 0.71 0.00 0.00 177.93 180.63 3dkl n LEU 212 N -4.27 0.00 0.22 0.26 4.77 -0.74 -1.40 117.00 115.84 3dkl n LEU 212 Ca 0.03 0.31 0.05 0.00 -0.03 0.00 0.00 56.01 56.37 3dkl n LEU 212 Cb 0.24 -0.31 0.47 0.00 -2.33 0.00 0.00 43.42 41.50 3dkl n LEU 212 CO 0.40 -0.14 0.86 0.58 -1.33 0.00 0.00 177.39 177.76 3dkl h VAL 213 N 0.00 1.15 0.00 4.08 2.07 -1.26 -3.35 116.25 118.95 3dkl h VAL 213 Ca 0.00 -0.76 -0.15 0.00 0.82 0.00 0.00 66.70 66.61 3dkl h VAL 213 Cb 0.17 1.41 -0.03 0.00 -1.52 0.00 0.00 31.29 31.32 3dkl h VAL 213 CO 0.00 0.22 -1.56 0.59 0.02 0.00 0.00 177.57 176.84 3dkl n ASN 214 N -4.27 3.02 -4.35 0.57 3.02 -0.50 -4.67 115.26 108.09 3dkl n ASN 214 Ca -0.02 -0.00 -0.24 0.00 -0.03 0.00 0.00 54.58 54.29 3dkl n ASN 214 Cb 0.28 0.63 -0.10 0.00 -0.61 0.00 0.00 39.78 39.98 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 -2.20 1.89 -0.03 3.10 0.40 -0.90 -4.84 117.98 115.41 3dkl s PHE 215 Ca -0.05 -1.07 0.00 0.00 -0.60 0.00 0.00 56.93 55.21 3dkl s PHE 215 Cb 0.02 -1.26 -0.00 0.00 0.51 0.00 0.00 43.02 42.30 3dkl s PHE 215 CO 0.32 -0.09 0.07 1.63 0.70 0.00 0.00 175.22 177.85 3dkl n LYS 216 N -0.80 6.12 -3.76 0.44 5.02 0.12 -4.35 118.16 120.96 3dkl n LYS 216 Ca -0.04 -0.05 -0.36 0.00 -2.02 0.00 0.00 58.31 55.83 3dkl n LYS 216 Cb 0.66 -0.57 -0.11 0.00 -0.02 0.00 0.00 35.03 35.00 3dkl n LYS 216 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3dkl s GLY 217 N -0.95 1.90 -0.16 0.72 0.00 -1.25 -0.68 107.32 106.90 3dkl s GLY 217 Ca 0.00 -0.96 -0.13 0.00 0.00 0.00 0.00 44.72 43.64 3dkl s GLY 217 CO 0.02 0.40 0.40 -1.08 0.00 0.00 0.00 173.10 172.84 3dkl s THR 218 N 1.17 -0.01 -2.04 0.90 -1.32 -0.85 -2.41 115.64 111.09 3dkl s THR 218 Ca 0.06 0.02 0.20 0.00 -1.21 0.00 0.00 61.69 60.76 3dkl s THR 218 Cb -0.14 -0.57 0.05 0.00 -1.51 0.00 0.00 72.50 70.32 3dkl s THR 218 CO 0.05 0.01 1.03 0.47 -2.21 0.00 0.00 174.62 173.97 3dkl n ASP 219 N 3.22 2.13 -4.46 8.08 9.92 0.15 -4.21 116.55 131.38 3dkl n ASP 219 Ca -0.16 -1.56 -0.44 0.00 -0.53 0.00 0.00 54.79 52.10 3dkl n ASP 219 Cb 0.57 0.32 -0.02 0.00 -0.64 0.00 0.00 41.12 41.34 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 -2.04 4.72 0.38 -3.53 2.01 -1.25 -4.86 115.64 111.07 3dkl s THR 220 Ca 0.19 -1.69 0.11 0.00 0.31 0.00 0.00 61.69 60.61 3dkl s THR 220 Cb 0.16 -4.82 0.33 0.00 0.01 0.00 0.00 72.50 68.19 3dkl s THR 220 CO 0.41 -1.55 1.88 0.58 -0.69 0.00 0.00 174.62 175.26 3dkl h VAL 221 N 5.72 0.82 -0.83 3.82 2.07 -1.96 -2.15 116.25 123.74 3dkl h VAL 221 Ca 0.18 -0.21 0.24 0.00 0.82 0.00 0.00 66.70 67.73 3dkl h VAL 221 Cb 1.00 0.16 -0.03 0.00 -1.52 0.00 0.00 31.29 30.90 3dkl h VAL 221 CO 1.15 0.11 0.64 0.00 0.02 0.00 0.00 177.57 179.49 3dkl h ALA 222 N 1.61 2.74 0.00 1.67 0.00 -1.90 -1.27 119.26 122.11 3dkl h ALA 222 Ca 0.42 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.27 3dkl h ALA 222 Cb 0.76 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 3dkl h ALA 222 CO -0.18 -1.07 -0.18 0.78 0.00 0.00 0.00 179.25 178.60 3dkl h GLY 223 N 0.00 0.00 0.67 0.00 0.00 -1.56 -3.20 103.07 98.98 3dkl h GLY 223 Ca 0.39 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.72 3dkl h GLY 223 CO -0.00 0.00 -0.01 1.41 0.00 0.00 0.00 176.54 177.94 3dkl h LEU 224 N 0.00 -0.02 -0.68 3.11 3.38 -1.44 -2.74 115.31 116.92 3dkl h LEU 224 Ca -0.00 -0.32 -0.14 0.00 0.09 0.00 0.00 57.88 57.51 3dkl h LEU 224 Cb 0.33 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3dkl h LEU 224 CO 0.02 0.31 -0.47 0.00 0.09 0.00 0.00 178.44 178.40 3dkl h ALA 225 N 0.63 0.86 -0.01 1.53 0.00 -1.71 -1.70 119.26 118.85 3dkl h ALA 225 Ca -0.00 -0.47 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 3dkl h ALA 225 Cb 0.34 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.03 3dkl h ALA 225 CO 0.00 0.66 0.01 1.25 0.00 0.00 0.00 179.25 181.17 3dkl h LEU 226 N 0.37 0.02 -0.54 0.00 6.46 -1.56 -1.06 115.31 118.99 3dkl h LEU 226 Ca 0.02 -0.13 0.05 0.00 -0.12 0.00 0.00 57.88 57.70 3dkl h LEU 226 Cb 0.96 -0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.84 3dkl h LEU 226 CO 0.08 0.14 0.28 0.40 -0.62 0.00 0.00 178.44 178.73 3dkl h ILE 227 N -0.11 0.96 -0.21 4.05 2.04 -1.24 -0.21 117.51 122.79 3dkl h ILE 227 Ca 0.00 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.67 3dkl h ILE 227 Cb 0.13 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 36.57 3dkl h ILE 227 CO -0.00 0.10 0.12 0.50 0.00 0.00 0.00 178.15 178.87 3dkl h LYS 228 N 0.54 0.29 -0.20 2.37 3.64 -1.20 0.28 116.57 122.28 3dkl h LYS 228 Ca 0.24 -0.03 -0.20 0.00 -1.27 0.00 0.00 60.65 59.39 3dkl h LYS 228 Cb 0.14 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3dkl h LYS 228 CO -0.16 0.26 -0.66 -0.22 -2.27 0.00 0.00 179.45 176.40 3dkl h LYS 229 N 0.24 0.76 0.00 1.90 3.64 -0.98 -3.35 116.57 118.77 3dkl h LYS 229 Ca 0.07 -0.55 -0.05 0.00 -1.27 0.00 0.00 60.65 58.85 3dkl h LYS 229 Cb 0.06 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3dkl h LYS 229 CO -0.01 1.17 -1.89 0.66 -2.27 0.00 0.00 179.45 177.11 3dkl n TYR 230 N -3.95 0.00 0.05 1.91 4.02 -0.11 -4.86 117.16 114.22 3dkl n TYR 230 Ca -0.05 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.84 3dkl n TYR 230 Cb 0.68 -0.49 0.00 0.00 -0.02 0.00 0.00 39.34 39.52 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 -2.22 -0.46 0.00 -0.72 4.02 -0.06 -4.78 117.16 112.94 3dkl n TYR 231 Ca -0.07 0.08 0.00 0.00 -0.01 0.00 0.00 57.90 57.90 3dkl n TYR 231 Cb 0.57 0.17 0.00 0.00 -0.02 0.00 0.00 39.34 40.06 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 2.73 -0.31 3.27 2.72 0.00 0.78 -3.19 105.19 111.19 3dkl n GLY 232 Ca 0.00 -1.31 -0.22 0.00 0.00 0.00 0.00 46.02 44.49 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 -1.04 1.59 0.14 2.61 -4.23 -1.26 -0.45 115.64 113.00 3dkl s THR 233 Ca 0.00 -1.57 -0.21 0.00 -1.18 0.00 0.00 61.69 58.72 3dkl s THR 233 Cb 0.00 -1.51 0.00 0.00 1.34 0.00 0.00 72.50 72.33 3dkl s THR 233 CO 0.00 -0.16 1.67 0.11 -0.54 0.00 0.00 174.62 175.70 3dkl h LYS 234 N 3.94 -0.15 -7.17 3.99 1.79 -1.98 -3.44 116.57 113.54 3dkl h LYS 234 Ca -0.44 0.01 -0.52 0.00 -2.18 0.00 0.00 60.65 57.52 3dkl h LYS 234 Cb 1.19 0.03 0.12 0.00 -1.58 0.00 0.00 32.23 31.99 3dkl h LYS 234 CO 0.42 -0.10 0.39 -0.51 -1.08 0.00 0.00 179.45 178.58 3dkl s ASP 235 N -5.09 4.91 0.24 0.86 1.01 -1.26 -4.95 116.67 112.39 3dkl s ASP 235 Ca -0.14 2.15 -0.05 0.00 0.71 0.00 0.00 52.55 55.21 3dkl s ASP 235 Cb 0.11 -2.57 0.38 0.00 1.01 0.00 0.00 42.92 41.85 3dkl s ASP 235 CO 0.68 -1.77 1.79 -0.65 0.21 0.00 0.00 175.17 175.44 3dkl h PRO 236 N 0.11 0.68 -5.42 8.23 0.11 -2.03 -3.43 132.00 130.25 3dkl h PRO 236 Ca -0.48 -0.04 -0.42 0.00 0.11 0.00 0.00 66.00 65.17 3dkl h PRO 236 Cb 1.27 -0.15 -0.21 0.00 0.11 0.00 0.00 31.00 32.01 3dkl h PRO 236 CO 0.53 0.45 -0.78 0.14 -0.21 0.00 0.00 178.00 178.13 3dkl s VAL 237 N -6.04 1.18 -0.60 3.15 -7.23 -1.26 -5.01 120.40 104.60 3dkl s VAL 237 Ca -0.12 -1.38 0.25 0.00 -1.81 0.00 0.00 61.98 58.91 3dkl s VAL 237 Cb 0.19 -1.17 0.24 0.00 0.56 0.00 0.00 36.38 36.19 3dkl s VAL 237 CO 0.77 -0.24 1.59 1.55 -0.31 0.00 0.00 175.10 178.46 3dkl h PRO 238 N 4.16 0.00 -4.01 4.82 0.13 -1.90 -3.48 132.00 131.73 3dkl h PRO 238 Ca -0.41 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.61 3dkl h PRO 238 Cb 1.19 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.17 3dkl h PRO 238 CO 0.42 0.00 -0.56 0.20 -0.23 0.00 0.00 178.00 177.83 3dkl s GLY 239 N -3.83 0.28 0.08 1.56 0.00 -1.26 -4.75 107.32 99.41 3dkl s GLY 239 Ca 0.08 -0.87 0.05 0.00 0.00 0.00 0.00 44.72 43.98 3dkl s GLY 239 CO 0.65 -1.00 -0.13 -0.19 0.00 0.00 0.00 173.10 172.43 3dkl s TYR 240 N -3.51 1.18 0.32 1.90 1.51 0.14 -4.93 117.35 113.96 3dkl s TYR 240 Ca 0.03 -0.52 0.04 0.00 -1.01 0.00 0.00 57.07 55.60 3dkl s TYR 240 Cb 0.04 -0.65 -0.04 0.00 -0.11 0.00 0.00 41.96 41.20 3dkl s TYR 240 CO -0.09 0.05 0.16 0.45 -1.11 0.00 0.00 175.55 175.01 3dkl s SER 241 N -2.00 1.77 0.11 2.29 0.15 -1.26 -2.01 113.70 112.74 3dkl s SER 241 Ca 0.01 -1.58 0.04 0.00 0.70 0.00 0.00 55.95 55.12 3dkl s SER 241 Cb -0.08 0.40 -0.04 0.00 -1.71 0.00 0.00 66.02 64.59 3dkl s SER 241 CO 0.02 -0.89 -0.10 0.68 1.20 0.00 0.00 173.24 174.15 3dkl s VAL 242 N -3.52 0.98 0.57 4.45 -7.23 -1.26 -5.10 120.40 109.29 3dkl s VAL 242 Ca 0.34 -1.76 -0.21 0.00 -1.81 0.00 0.00 61.98 58.54 3dkl s VAL 242 Cb 0.05 -1.51 -0.04 0.00 0.56 0.00 0.00 36.38 35.44 3dkl s VAL 242 CO 0.18 -0.62 1.27 -2.65 -0.31 0.00 0.00 175.10 172.96 3dkl n PRO 243 N 0.33 1.44 -3.56 4.82 -0.02 -1.26 -4.90 135.00 131.86 3dkl n PRO 243 Ca -0.14 0.54 -0.16 0.00 -2.02 0.00 0.00 63.50 61.71 3dkl n PRO 243 Cb 0.59 -2.48 -0.06 0.00 -0.02 0.00 0.00 33.50 31.52 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 -1.34 -1.78 0.58 3.55 0.00 -1.26 -1.55 121.76 119.96 3dkl s ALA 244 Ca 0.74 1.58 -0.08 0.00 0.00 0.00 0.00 51.96 54.21 3dkl s ALA 244 Cb -0.42 -0.45 -0.02 0.00 0.00 0.00 0.00 23.12 22.24 3dkl s ALA 244 CO 0.47 -0.36 0.93 0.00 0.00 0.00 0.00 175.76 176.80 3dkl s ALA 245 N -0.61 3.22 0.40 0.00 0.00 -0.22 -4.95 121.76 119.59 3dkl s ALA 245 Ca -0.07 -0.40 0.04 0.00 0.00 0.00 0.00 51.96 51.53 3dkl s ALA 245 Cb -0.02 -2.80 -0.05 0.00 0.00 0.00 0.00 23.12 20.25 3dkl s ALA 245 CO 0.07 -0.66 0.06 -1.83 0.00 0.00 0.00 175.76 173.40 3dkl s GLU 246 N -5.01 1.88 0.31 0.00 -1.05 -1.26 -4.46 118.70 109.10 3dkl s GLU 246 Ca 0.53 -2.11 -0.01 0.00 -0.15 0.00 0.00 54.97 53.22 3dkl s GLU 246 Cb -0.11 -1.05 0.47 0.00 -0.44 0.00 0.00 34.13 33.00 3dkl s GLU 246 CO 0.49 -0.28 1.96 0.45 0.95 0.00 0.00 175.26 178.83 3dkl h HIS 247 N 1.82 0.97 -0.67 4.83 3.86 -2.00 -2.46 115.15 121.51 3dkl h HIS 247 Ca -0.40 0.01 0.07 0.00 -1.16 0.00 0.00 60.37 58.89 3dkl h HIS 247 Cb 1.27 -0.32 -0.04 0.00 1.06 0.00 0.00 27.41 29.37 3dkl h HIS 247 CO 1.04 0.64 0.44 0.66 0.86 0.00 0.00 177.93 181.56 3dkl h SER 248 N 1.03 0.56 1.78 2.45 4.64 -1.97 0.20 113.55 122.23 3dkl h SER 248 Ca 0.27 0.01 -0.00 0.00 -0.47 0.00 0.00 61.79 61.60 3dkl h SER 248 Cb -0.07 -0.11 -0.00 0.00 -0.31 0.00 0.00 62.40 61.90 3dkl h SER 248 CO -0.05 0.35 -0.23 0.71 -0.87 0.00 0.00 176.83 176.74 3dkl h THR 249 N 0.63 0.02 0.00 2.95 1.35 -1.85 -2.37 112.91 113.64 3dkl h THR 249 Ca 0.29 -1.04 -0.05 0.00 -0.55 0.00 0.00 66.41 65.06 3dkl h THR 249 Cb 0.34 1.91 -0.01 0.00 -1.73 0.00 0.00 68.15 68.66 3dkl h THR 249 CO -0.09 0.01 -0.39 0.40 -0.25 0.00 0.00 175.52 175.20 3dkl h ILE 250 N 0.00 0.73 0.00 6.82 1.08 -1.24 -3.41 117.51 121.49 3dkl h ILE 250 Ca -0.00 -1.66 -0.04 0.00 -0.39 0.00 0.00 64.86 62.77 3dkl h ILE 250 Cb 1.01 1.49 -0.01 0.00 -3.07 0.00 0.00 36.82 36.24 3dkl h ILE 250 CO 0.00 0.25 -0.20 0.71 -0.69 0.00 0.00 178.15 178.21 3dkl h THR 251 N -1.00 0.86 -0.11 -0.27 1.35 -0.74 -2.63 112.91 110.36 3dkl h THR 251 Ca -0.08 -0.78 0.03 0.00 -0.55 0.00 0.00 66.41 65.03 3dkl h THR 251 Cb 0.69 1.46 -0.00 0.00 -1.73 0.00 0.00 68.15 68.57 3dkl h THR 251 CO -0.05 0.20 0.16 0.00 -0.25 0.00 0.00 175.52 175.58 3dkl h ALA 252 N 1.80 1.60 0.00 6.62 0.00 -1.61 -1.01 119.26 126.66 3dkl h ALA 252 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dkl h ALA 252 Cb 0.44 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3dkl h ALA 252 CO 0.03 -0.21 0.00 -1.49 0.00 0.00 0.00 179.25 177.57 3dkl h TRP 253 N 0.00 0.00 0.00 0.00 4.06 -1.73 -3.49 115.95 114.79 3dkl h TRP 253 Ca 0.05 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.00 3dkl h TRP 253 Cb 0.37 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.53 3dkl h TRP 253 CO 0.00 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.29 3dkl n GLY 254 N 0.22 0.88 0.32 1.49 0.00 -0.38 -4.37 105.19 103.35 3dkl n GLY 254 Ca 0.02 -1.58 0.08 0.00 0.00 0.00 0.00 46.02 44.55 3dkl n GLY 254 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3dkl h LYS 255 N 0.00 0.38 0.00 1.61 3.64 -1.93 0.10 116.57 120.37 3dkl h LYS 255 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 3dkl h LYS 255 Cb 0.00 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.73 3dkl h LYS 255 CO 0.00 0.25 0.00 -0.25 -2.27 0.00 0.00 179.45 177.18 3dkl n ASP 256 N -4.48 0.00 -0.77 4.20 8.00 -1.26 -3.60 116.55 118.64 3dkl n ASP 256 Ca 0.05 0.23 0.03 0.00 0.71 0.00 0.00 54.79 55.80 3dkl n ASP 256 Cb 0.20 -0.40 0.20 0.00 -0.02 0.00 0.00 41.12 41.11 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 -1.40 0.38 -0.16 1.24 8.25 0.35 -4.71 115.22 119.17 3dkl n HIS 257 Ca 0.08 -1.51 0.08 0.00 -0.26 0.00 0.00 57.72 56.11 3dkl n HIS 257 Cb 0.23 -0.33 0.38 0.00 1.12 0.00 0.00 29.99 31.40 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 0.97 0.66 -0.15 -0.41 4.81 -1.62 -1.89 114.58 116.95 3dkl h GLU 258 Ca 0.08 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.26 3dkl h GLU 258 Cb 1.23 -0.15 -0.01 0.00 0.63 0.00 0.00 28.75 30.45 3dkl h GLU 258 CO 0.13 0.44 0.08 -0.22 -0.73 0.00 0.00 179.01 178.71 3dkl h LYS 259 N 0.68 0.22 -0.83 1.92 3.64 -1.91 -1.86 116.57 118.43 3dkl h LYS 259 Ca 0.30 -0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.67 3dkl h LYS 259 Cb 0.32 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.05 3dkl h LYS 259 CO -0.10 0.24 0.54 -0.44 -2.27 0.00 0.00 179.45 177.43 3dkl h ASP 260 N 0.13 0.93 0.13 4.20 3.32 -1.78 -0.14 116.42 123.20 3dkl h ASP 260 Ca 0.05 -0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.10 3dkl h ASP 260 Cb 0.09 -0.22 -0.02 0.00 0.22 0.00 0.00 39.33 39.40 3dkl h ASP 260 CO -0.01 0.66 -0.19 0.00 -1.72 0.00 0.00 179.24 177.98 3dkl h ALA 261 N 1.32 -0.34 -0.27 3.45 0.00 -1.27 -1.10 119.26 121.05 3dkl h ALA 261 Ca 0.31 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 55.22 3dkl h ALA 261 Cb -0.08 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 17.97 3dkl h ALA 261 CO -0.08 -0.72 0.05 0.74 0.00 0.00 0.00 179.25 179.24 3dkl h PHE 262 N -0.38 0.09 -0.21 0.00 -1.00 -0.85 -0.93 116.94 113.66 3dkl h PHE 262 Ca 0.02 0.02 0.02 0.00 2.81 0.00 0.00 57.97 60.83 3dkl h PHE 262 Cb 0.39 0.00 -0.02 0.00 3.61 0.00 0.00 35.95 39.93 3dkl h PHE 262 CO -0.18 0.02 0.10 1.49 -1.61 0.00 0.00 178.31 178.13 3dkl h GLU 263 N 0.15 0.20 -0.23 1.51 4.81 -0.92 -1.35 114.58 118.76 3dkl h GLU 263 Ca 0.12 -0.01 0.03 0.00 -0.13 0.00 0.00 59.36 59.37 3dkl h GLU 263 Cb 0.13 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 3dkl h GLU 263 CO -0.16 0.13 0.04 1.25 -0.73 0.00 0.00 179.01 179.54 3dkl h HIS 264 N 0.21 0.07 -0.05 0.92 2.76 -1.01 -1.78 115.15 116.27 3dkl h HIS 264 Ca 0.09 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 3dkl h HIS 264 Cb 0.03 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 28.99 3dkl h HIS 264 CO -0.10 0.02 0.01 0.82 -1.30 0.00 0.00 177.93 177.38 3dkl h ILE 265 N 0.13 1.22 0.00 6.26 2.04 -1.01 0.11 117.51 126.27 3dkl h ILE 265 Ca 0.10 -0.68 -0.05 0.00 1.00 0.00 0.00 64.86 65.24 3dkl h ILE 265 Cb 0.10 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 3dkl h ILE 265 CO -0.14 0.19 -0.24 -0.37 0.00 0.00 0.00 178.15 177.59 3dkl h VAL 266 N -0.17 0.94 0.09 1.67 -1.51 -1.24 -1.93 116.25 114.10 3dkl h VAL 266 Ca 0.02 -0.90 -0.27 0.00 -1.23 0.00 0.00 66.70 64.32 3dkl h VAL 266 Cb 0.29 1.52 0.01 0.00 -2.13 0.00 0.00 31.29 30.98 3dkl h VAL 266 CO 0.00 0.23 -1.16 0.74 -1.23 0.00 0.00 177.57 176.16 3dkl h THR 267 N 0.00 1.38 -0.85 7.19 2.02 -1.15 -2.82 112.91 118.69 3dkl h THR 267 Ca -0.00 -2.64 0.04 0.00 0.77 0.00 0.00 66.41 64.58 3dkl h THR 267 Cb 0.50 2.69 -0.05 0.00 -1.74 0.00 0.00 68.15 69.55 3dkl h THR 267 CO 0.03 0.79 0.56 1.56 0.37 0.00 0.00 175.52 178.83 3dkl h GLN 268 N 0.20 1.00 -2.15 6.66 1.08 -0.46 -3.23 115.11 118.21 3dkl h GLN 268 Ca -0.14 -0.06 -0.63 0.00 -1.45 0.00 0.00 58.65 56.37 3dkl h GLN 268 Cb 1.83 -0.23 -0.39 0.00 -0.05 0.00 0.00 27.48 28.65 3dkl h GLN 268 CO 0.21 0.66 -0.32 1.19 -0.95 0.00 0.00 178.83 179.61 3dkl n PHE 269 N -4.46 3.72 0.52 2.96 3.01 -0.75 -4.85 117.46 117.61 3dkl n PHE 269 Ca 0.12 -3.57 0.13 0.00 1.01 0.00 0.00 57.45 55.13 3dkl n PHE 269 Cb 0.14 -0.56 0.42 0.00 -0.01 0.00 0.00 39.48 39.46 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 3.11 0.00 0.00 4.37 4.64 -1.52 -3.30 113.55 120.85 3dkl h SER 270 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 3dkl h SER 270 Cb 0.52 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3dkl h SER 270 CO 0.90 0.00 0.00 -1.54 -0.87 0.00 0.00 176.83 175.32 3dkl n SER 271 N -2.36 1.10 -4.42 4.97 3.41 -1.26 -4.82 113.62 110.25 3dkl n SER 271 Ca 0.04 -1.51 -0.21 0.00 -0.26 0.00 0.00 58.87 56.93 3dkl n SER 271 Cb 0.38 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 64.23 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 -0.51 1.74 0.35 -3.33 -7.23 -1.24 -4.74 120.40 105.44 3dkl s VAL 272 Ca 0.00 -2.17 -0.27 0.00 -1.81 0.00 0.00 61.98 57.73 3dkl s VAL 272 Cb 0.00 -2.36 -0.12 0.00 0.56 0.00 0.00 36.38 34.46 3dkl s VAL 272 CO 0.00 -0.37 1.23 -2.65 -0.31 0.00 0.00 175.10 173.00 3dkl n PRO 273 N -0.55 1.94 -3.93 4.82 -0.02 -1.25 -4.64 135.00 131.37 3dkl n PRO 273 Ca -0.06 0.68 -0.19 0.00 -2.02 0.00 0.00 63.50 61.91 3dkl n PRO 273 Cb 0.62 -2.25 -0.17 0.00 -0.02 0.00 0.00 33.50 31.69 3dkl n PRO 273 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 3dkl s VAL 274 N -1.12 0.27 -0.16 -1.45 0.11 -0.70 -4.04 120.40 113.30 3dkl s VAL 274 Ca 0.57 0.07 -0.18 0.00 -2.93 0.00 0.00 61.98 59.51 3dkl s VAL 274 Cb -0.57 -0.37 -0.04 0.00 -1.53 0.00 0.00 36.38 33.87 3dkl s VAL 274 CO 0.61 0.18 0.50 -0.55 -3.33 0.00 0.00 175.10 172.51 3dkl s SER 275 N 1.24 6.62 -0.23 3.54 0.15 -0.60 -0.28 113.70 124.13 3dkl s SER 275 Ca -0.07 0.73 -0.00 0.00 0.70 0.00 0.00 55.95 57.32 3dkl s SER 275 Cb -0.13 -2.29 0.06 0.00 -1.71 0.00 0.00 66.02 61.95 3dkl s SER 275 CO -0.02 -0.09 -0.03 -0.69 1.20 0.00 0.00 173.24 173.61 3dkl s VAL 276 N 1.16 1.31 0.05 4.45 1.01 0.37 -1.06 120.40 127.69 3dkl s VAL 276 Ca 0.25 -1.11 -0.30 0.00 0.00 0.00 0.00 61.98 60.81 3dkl s VAL 276 Cb -0.15 -1.65 -0.08 0.00 0.00 0.00 0.00 36.38 34.50 3dkl s VAL 276 CO 0.10 -0.15 1.70 0.54 0.00 0.00 0.00 175.10 177.29 3dkl s VAL 277 N 1.49 3.09 -0.23 2.92 0.11 -1.26 -1.76 120.40 124.76 3dkl s VAL 277 Ca -0.04 0.44 0.03 0.00 -2.93 0.00 0.00 61.98 59.48 3dkl s VAL 277 Cb -0.18 -3.28 0.08 0.00 -1.53 0.00 0.00 36.38 31.46 3dkl s VAL 277 CO -0.07 -0.01 1.07 -1.20 -3.33 0.00 0.00 175.10 171.55 3dkl n SER 278 N 6.05 2.24 -1.01 3.54 7.64 -0.10 -4.69 113.62 127.31 3dkl n SER 278 Ca 0.17 -2.03 0.08 0.00 1.01 0.00 0.00 58.87 58.10 3dkl n SER 278 Cb 0.41 -0.07 0.26 0.00 -1.01 0.00 0.00 64.21 63.80 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 -0.28 3.99 -0.32 6.43 3.85 -1.26 -3.78 116.55 125.18 3dkl n ASP 279 Ca 0.03 -2.78 0.16 0.00 -0.71 0.00 0.00 54.79 51.49 3dkl n ASP 279 Cb 0.30 -0.51 0.40 0.00 -1.35 0.00 0.00 41.12 39.97 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 2.26 0.63 0.00 -1.12 0.02 -1.96 -3.37 113.55 110.02 3dkl h SER 280 Ca 0.00 0.08 0.00 0.00 -0.84 0.00 0.00 61.79 61.03 3dkl h SER 280 Cb 1.38 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.89 3dkl h SER 280 CO 0.21 0.21 -0.42 -1.22 -1.14 0.00 0.00 176.83 174.47 3dkl n TYR 281 N -4.69 0.00 -3.17 3.45 4.02 -1.26 -5.04 117.16 110.48 3dkl n TYR 281 Ca 0.23 0.00 0.03 0.00 -0.01 0.00 0.00 57.90 58.15 3dkl n TYR 281 Cb 0.67 0.13 -0.00 0.00 -0.02 0.00 0.00 39.34 40.11 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 -4.15 -1.56 0.27 7.72 -1.08 -1.26 -5.03 116.67 111.58 3dkl s ASP 282 Ca 0.00 -0.10 -0.00 0.00 -0.52 0.00 0.00 52.55 51.93 3dkl s ASP 282 Cb 0.00 2.00 0.51 0.00 -1.46 0.00 0.00 42.92 43.97 3dkl s ASP 282 CO 0.00 -0.26 1.83 -0.29 0.52 0.00 0.00 175.17 176.97 3dkl h ILE 283 N 5.72 0.93 -0.13 4.11 6.09 -1.79 -0.58 117.51 131.86 3dkl h ILE 283 Ca 0.01 -0.33 -0.16 0.00 -1.37 0.00 0.00 64.86 63.00 3dkl h ILE 283 Cb 1.19 -0.13 0.01 0.00 0.47 0.00 0.00 36.82 38.35 3dkl h ILE 283 CO 0.14 0.18 -0.55 1.88 -3.07 0.00 0.00 178.15 176.72 3dkl h TYR 284 N 0.97 0.81 -0.77 2.19 0.99 -1.96 -1.38 116.97 117.83 3dkl h TYR 284 Ca 0.47 -0.35 -0.01 0.00 2.00 0.00 0.00 58.73 60.85 3dkl h TYR 284 Cb 0.44 -0.13 -0.04 0.00 1.00 0.00 0.00 36.73 38.00 3dkl h TYR 284 CO -0.01 1.14 0.44 -0.97 -0.00 0.00 0.00 178.16 178.75 3dkl h ASN 285 N 0.26 0.96 -0.51 3.88 -1.24 -1.93 -1.05 115.58 115.96 3dkl h ASN 285 Ca -0.03 -0.09 -0.03 0.00 0.71 0.00 0.00 56.30 56.86 3dkl h ASN 285 Cb 1.19 -0.24 -0.02 0.00 0.73 0.00 0.00 38.32 39.97 3dkl h ASN 285 CO 0.12 0.77 0.21 0.00 -1.29 0.00 0.00 177.43 177.23 3dkl h ALA 286 N 1.23 0.66 -0.20 1.57 0.00 -0.83 0.88 119.26 122.57 3dkl h ALA 286 Ca 0.27 -0.15 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 3dkl h ALA 286 Cb 0.01 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3dkl h ALA 286 CO -0.05 0.26 -0.09 0.00 0.00 0.00 0.00 179.25 179.37 3dkl h GLU 288 N 0.11 0.17 0.00 0.00 4.81 -1.14 -0.89 114.58 117.64 3dkl h GLU 288 Ca 0.04 -0.26 -0.25 0.00 -0.13 0.00 0.00 59.36 58.77 3dkl h GLU 288 Cb 0.58 0.09 -0.04 0.00 0.63 0.00 0.00 28.75 30.01 3dkl h GLU 288 CO 0.03 1.10 -1.42 1.17 -0.73 0.00 0.00 179.01 179.16 3dkl n LYS 289 N -4.37 0.56 0.02 1.92 3.00 0.28 -3.38 118.16 116.18 3dkl n LYS 289 Ca -0.12 0.51 -0.06 0.00 -0.00 0.00 0.00 58.31 58.64 3dkl n LYS 289 Cb 0.64 -1.69 -0.04 0.00 0.00 0.00 0.00 35.03 33.94 3dkl n LYS 289 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.40 178.22 3dkl h ILE 290 N -1.00 0.38 -0.21 3.15 2.04 -1.19 -0.40 117.51 120.28 3dkl h ILE 290 Ca -0.37 -1.11 -0.18 0.00 1.00 0.00 0.00 64.86 64.19 3dkl h ILE 290 Cb 1.27 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.05 3dkl h ILE 290 CO -0.23 0.12 -0.61 -0.50 0.00 0.00 0.00 178.15 176.93 3dkl h TRP 291 N -1.01 0.91 0.00 1.37 -0.00 -0.65 0.23 115.95 116.80 3dkl h TRP 291 Ca -0.02 -0.35 0.00 0.00 -0.00 0.00 0.00 58.89 58.53 3dkl h TRP 291 Cb 0.32 -0.16 0.00 0.00 -0.00 0.00 0.00 29.16 29.31 3dkl h TRP 291 CO 0.05 1.14 -0.15 0.41 -0.00 0.00 0.00 178.44 179.90 3dkl n GLY 292 N 0.41 -1.60 1.48 1.49 0.00 -0.34 -2.61 105.19 104.03 3dkl n GLY 292 Ca -0.04 -0.10 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 -2.07 0.00 -0.35 1.61 1.02 -0.91 -4.75 120.64 115.20 3dkl n GLU 293 Ca 0.05 0.00 0.05 0.00 -0.02 0.00 0.00 57.16 57.24 3dkl n GLU 293 Cb 0.41 0.00 0.20 0.00 -0.02 0.00 0.00 31.44 32.03 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 0.92 -0.20 1.62 3.32 -0.97 -3.04 116.42 118.08 3dkl h ASP 294 Ca 0.00 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.08 3dkl h ASP 294 Cb 0.00 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.40 3dkl h ASP 294 CO 0.00 0.53 0.00 0.18 -1.72 0.00 0.00 179.24 178.23 3dkl n LEU 295 N -4.60 2.46 -0.27 1.55 4.77 0.79 -4.70 117.00 117.00 3dkl n LEU 295 Ca 0.17 -1.82 0.14 0.00 -0.03 0.00 0.00 56.01 54.47 3dkl n LEU 295 Cb 0.28 -0.13 0.41 0.00 -2.33 0.00 0.00 43.42 41.65 3dkl n LEU 295 CO 0.29 0.60 1.22 -0.09 -1.33 0.00 0.00 177.39 178.08 3dkl h ARG 296 N 1.42 0.59 0.00 3.23 2.43 -1.37 0.03 114.38 120.71 3dkl h ARG 296 Ca 0.00 -0.04 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 3dkl h ARG 296 Cb 0.60 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.01 3dkl h ARG 296 CO 0.00 0.39 -0.08 1.12 -1.51 0.00 0.00 179.97 179.89 3dkl h HIS 297 N 0.61 0.00 0.00 2.20 2.07 -1.84 -1.97 115.15 116.22 3dkl h HIS 297 Ca 0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.99 3dkl h HIS 297 Cb 0.89 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.87 3dkl h HIS 297 CO -0.00 0.08 -0.69 1.28 -3.07 0.00 0.00 177.93 175.52 3dkl n LEU 298 N -3.46 0.61 -0.10 6.12 4.77 -0.01 -4.02 117.00 120.90 3dkl n LEU 298 Ca -0.02 0.05 -0.24 0.00 -0.03 0.00 0.00 56.01 55.78 3dkl n LEU 298 Cb 0.22 -0.18 -0.11 0.00 -2.33 0.00 0.00 43.42 41.02 3dkl n LEU 298 CO 0.28 0.05 -0.82 -0.38 -1.33 0.00 0.00 177.39 175.19 3dkl n ILE 299 N -1.81 1.55 0.30 -0.08 5.41 -0.88 -4.41 119.36 119.43 3dkl n ILE 299 Ca 0.04 -0.19 0.06 0.00 1.00 0.00 0.00 62.75 63.66 3dkl n ILE 299 Cb 0.39 -1.95 0.29 0.00 -0.71 0.00 0.00 39.64 37.66 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 -4.26 1.26 1.03 1.39 0.24 -0.79 -1.58 118.33 115.61 3dkl n VAL 300 Ca -0.38 0.38 0.12 0.00 -2.04 0.00 0.00 64.34 62.41 3dkl n VAL 300 Cb 0.78 -1.26 0.22 0.00 -1.47 0.00 0.00 33.84 32.11 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 -1.73 0.64 -4.80 -1.34 3.41 -1.26 -4.94 113.62 103.60 3dkl n SER 301 Ca 0.02 -0.43 -0.33 0.00 -0.26 0.00 0.00 58.87 57.87 3dkl n SER 301 Cb 0.12 0.32 -0.00 0.00 -0.26 0.00 0.00 64.21 64.39 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 -2.93 3.45 0.49 4.33 0.52 -0.62 -5.04 118.95 119.15 3dkl s ARG 302 Ca 0.12 1.24 -0.17 0.00 -0.52 0.00 0.00 55.73 56.39 3dkl s ARG 302 Cb 0.18 -2.05 -0.09 0.00 0.52 0.00 0.00 34.95 33.51 3dkl s ARG 302 CO 0.70 -0.71 0.97 0.45 0.02 0.00 0.00 175.30 176.73 3dkl s SER 303 N -2.61 6.69 0.51 0.23 0.15 -1.26 -4.64 113.70 112.77 3dkl s SER 303 Ca 0.64 1.59 0.19 0.00 0.70 0.00 0.00 55.95 59.07 3dkl s SER 303 Cb -0.16 -2.51 1.26 0.00 -1.71 0.00 0.00 66.02 62.90 3dkl s SER 303 CO 0.33 -0.53 2.06 0.74 1.20 0.00 0.00 173.24 177.04 3dkl h THR 304 N 1.14 0.89 -0.01 6.45 2.02 -1.96 -0.44 112.91 121.01 3dkl h THR 304 Ca -0.47 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 66.68 3dkl h THR 304 Cb 1.18 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 68.39 3dkl h THR 304 CO 0.61 0.02 -0.11 0.00 0.37 0.00 0.00 175.52 176.41 3dkl n GLN 305 N -4.47 0.84 -2.63 6.66 3.00 -1.26 -4.22 117.38 115.30 3dkl n GLN 305 Ca 0.04 -0.33 -0.13 0.00 -0.01 0.00 0.00 57.00 56.57 3dkl n GLN 305 Cb 0.32 -1.49 0.02 0.00 0.00 0.00 0.00 30.24 29.09 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 -0.80 3.77 -1.48 -1.58 0.00 -0.19 -3.91 120.51 116.34 3dkl n ALA 306 Ca 0.15 -3.42 -0.35 0.00 0.00 0.00 0.00 53.44 49.83 3dkl n ALA 306 Cb 0.28 -0.85 0.07 0.00 0.00 0.00 0.00 19.45 18.96 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 -3.20 2.42 0.08 0.00 0.04 -1.15 -4.33 135.00 128.85 3dkl s PRO 307 Ca 0.32 1.73 -0.31 0.00 0.04 0.00 0.00 61.00 62.79 3dkl s PRO 307 Cb 0.44 -1.87 -0.06 0.00 0.04 0.00 0.00 34.50 33.05 3dkl s PRO 307 CO -0.02 -1.61 1.19 -1.17 0.04 0.00 0.00 177.00 175.44 3dkl s LEU 308 N -4.86 4.38 -0.36 -3.56 2.96 -0.46 -1.73 118.68 115.05 3dkl s LEU 308 Ca 0.74 2.04 0.00 0.00 -0.22 0.00 0.00 54.13 56.69 3dkl s LEU 308 Cb -0.28 -3.58 0.09 0.00 0.50 0.00 0.00 46.19 42.92 3dkl s LEU 308 CO 0.42 -0.45 0.10 -0.63 -1.32 0.00 0.00 176.35 174.47 3dkl s ILE 309 N 0.92 2.81 0.03 6.68 1.01 0.61 -0.50 121.20 132.77 3dkl s ILE 309 Ca 0.58 -2.04 -0.30 0.00 0.00 0.00 0.00 60.65 58.89 3dkl s ILE 309 Cb -0.30 -2.91 -0.07 0.00 0.01 0.00 0.00 42.46 39.19 3dkl s ILE 309 CO 0.30 -0.53 1.52 -0.63 0.00 0.00 0.00 174.94 175.60 3dkl s ILE 310 N 1.07 3.41 -0.40 2.92 1.01 -0.72 -0.48 121.20 128.01 3dkl s ILE 310 Ca 0.06 0.81 -0.03 0.00 0.00 0.00 0.00 60.65 61.49 3dkl s ILE 310 Cb -0.21 -3.52 0.10 0.00 0.01 0.00 0.00 42.46 38.84 3dkl s ILE 310 CO -0.05 -0.00 0.19 -0.60 0.00 0.00 0.00 174.94 174.48 3dkl s ARG 311 N 2.55 2.06 0.78 2.79 3.52 -0.72 -1.66 118.95 128.27 3dkl s ARG 311 Ca 0.68 -1.77 -0.11 0.00 -0.13 0.00 0.00 55.73 54.41 3dkl s ARG 311 Cb -0.35 -3.57 0.06 0.00 -1.56 0.00 0.00 34.95 29.53 3dkl s ARG 311 CO 0.29 -1.04 1.08 -1.25 -0.81 0.00 0.00 175.30 173.58 3dkl s PRO 312 N 1.16 2.19 0.00 5.12 0.04 -1.23 -0.92 135.00 141.36 3dkl s PRO 312 Ca 0.07 0.97 0.04 0.00 0.04 0.00 0.00 61.00 62.12 3dkl s PRO 312 Cb -0.23 -1.90 0.07 0.00 0.04 0.00 0.00 34.50 32.48 3dkl s PRO 312 CO -0.04 -1.63 0.87 -3.47 0.04 0.00 0.00 177.00 172.78 3dkl n ASP 313 N -3.49 -0.20 -3.68 6.66 4.64 -1.26 -4.12 116.55 115.11 3dkl n ASP 313 Ca 0.08 -1.69 -0.04 0.00 -1.38 0.00 0.00 54.79 51.76 3dkl n ASP 313 Cb 0.54 0.03 -0.01 0.00 -1.04 0.00 0.00 41.12 40.64 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 -0.86 -0.21 0.00 1.67 1.04 -1.26 -4.80 113.70 109.28 3dkl s SER 314 Ca 0.06 -0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.21 3dkl s SER 314 Cb 0.07 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.62 3dkl s SER 314 CO -0.03 -0.77 0.00 0.61 0.98 0.00 0.00 173.24 174.03 3dkl n GLY 315 N -0.41 -3.21 3.66 7.32 0.00 -1.26 -4.79 105.19 106.50 3dkl n GLY 315 Ca -0.07 -1.82 -0.42 0.00 0.00 0.00 0.00 46.02 43.71 3dkl n GLY 315 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3dkl s ASN 316 N -1.27 6.69 0.14 1.61 2.47 -1.26 -4.92 114.94 118.40 3dkl s ASN 316 Ca 0.00 2.23 -0.26 0.00 0.42 0.00 0.00 52.86 55.25 3dkl s ASN 316 Cb 0.00 -2.54 -0.01 0.00 -1.45 0.00 0.00 41.25 37.25 3dkl s ASN 316 CO 0.00 -0.90 1.60 -0.65 -3.72 0.00 0.00 177.10 173.43 3dkl h PRO 317 N 9.25 -0.36 -0.30 0.43 0.11 -1.87 0.15 132.00 139.40 3dkl h PRO 317 Ca -0.39 0.02 -0.01 0.00 0.11 0.00 0.00 66.00 65.74 3dkl h PRO 317 Cb 1.18 0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.35 3dkl h PRO 317 CO 0.95 -0.24 0.16 1.25 -0.21 0.00 0.00 178.00 179.91 3dkl h LEU 318 N -0.38 0.38 -0.87 2.35 6.46 -1.92 -1.61 115.31 119.74 3dkl h LEU 318 Ca 0.11 -0.09 -0.09 0.00 -0.12 0.00 0.00 57.88 57.69 3dkl h LEU 318 Cb 0.55 -0.10 -0.02 0.00 -0.73 0.00 0.00 40.66 40.37 3dkl h LEU 318 CO -0.40 0.36 -0.12 0.44 -0.62 0.00 0.00 178.44 178.11 3dkl h ASP 319 N 0.37 0.70 -0.20 1.25 3.32 -1.84 -1.96 116.42 118.06 3dkl h ASP 319 Ca 0.11 -0.21 -0.07 0.00 0.02 0.00 0.00 57.03 56.88 3dkl h ASP 319 Cb 0.07 -0.19 -0.00 0.00 0.22 0.00 0.00 39.33 39.43 3dkl h ASP 319 CO -0.02 0.84 -0.15 0.74 -1.72 0.00 0.00 179.24 178.94 3dkl h THR 320 N 0.65 1.32 -0.11 0.35 2.02 -0.65 -2.05 112.91 114.45 3dkl h THR 320 Ca 0.11 -1.28 0.00 0.00 0.77 0.00 0.00 66.41 66.02 3dkl h THR 320 Cb 0.57 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.70 3dkl h THR 320 CO 0.04 0.39 0.07 0.58 0.37 0.00 0.00 175.52 176.96 3dkl h VAL 321 N 0.13 1.03 -0.86 3.16 2.07 -1.00 0.93 116.25 121.70 3dkl h VAL 321 Ca 0.04 -0.05 0.06 0.00 0.82 0.00 0.00 66.70 67.57 3dkl h VAL 321 Cb 0.67 0.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.25 3dkl h VAL 321 CO 0.04 0.03 0.53 -0.07 0.02 0.00 0.00 177.57 178.12 3dkl h LEU 322 N 0.14 0.84 -0.13 2.57 3.38 -1.36 -0.57 115.31 120.19 3dkl h LEU 322 Ca 0.04 0.02 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 3dkl h LEU 322 Cb -0.02 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.58 3dkl h LEU 322 CO -0.01 0.54 -0.41 0.50 0.09 0.00 0.00 178.44 179.15 3dkl h LYS 323 N 0.98 0.50 -0.38 1.13 3.64 -0.88 0.01 116.57 121.56 3dkl h LYS 323 Ca 0.37 -0.37 0.07 0.00 -1.27 0.00 0.00 60.65 59.45 3dkl h LYS 323 Cb 0.16 0.06 -0.06 0.00 -0.41 0.00 0.00 32.23 31.98 3dkl h LYS 323 CO -0.17 0.99 0.00 0.28 -2.27 0.00 0.00 179.45 178.29 3dkl h VAL 324 N 0.11 0.72 -0.75 2.00 2.07 -0.58 0.13 116.25 119.94 3dkl h VAL 324 Ca -0.02 -0.04 -0.06 0.00 0.82 0.00 0.00 66.70 67.41 3dkl h VAL 324 Cb 1.04 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 31.37 3dkl h VAL 324 CO 0.09 0.02 0.23 -0.07 0.02 0.00 0.00 177.57 177.86 3dkl h LEU 325 N 0.11 1.09 -0.85 2.57 3.38 -0.90 -1.35 115.31 119.35 3dkl h LEU 325 Ca 0.19 -0.21 -0.00 0.00 0.09 0.00 0.00 57.88 57.95 3dkl h LEU 325 Cb 0.26 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 3dkl h LEU 325 CO -0.31 1.01 0.51 -0.08 0.09 0.00 0.00 178.44 179.66 3dkl h GLU 326 N 1.11 1.16 -0.19 1.13 4.57 -0.49 -0.36 114.58 121.51 3dkl h GLU 326 Ca 0.24 -0.10 -0.02 0.00 -1.18 0.00 0.00 59.36 58.30 3dkl h GLU 326 Cb 0.31 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.65 3dkl h GLU 326 CO -0.01 0.81 0.06 0.82 -1.18 0.00 0.00 179.01 179.51 3dkl h ILE 327 N 1.17 1.19 -0.16 2.32 2.04 -0.41 -3.00 117.51 120.66 3dkl h ILE 327 Ca 0.31 -0.59 -0.11 0.00 1.00 0.00 0.00 64.86 65.47 3dkl h ILE 327 Cb -0.05 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.25 3dkl h ILE 327 CO -0.06 0.18 -0.37 -0.07 0.00 0.00 0.00 178.15 177.83 3dkl h LEU 328 N 0.13 0.36 -2.02 1.44 3.38 -1.00 -2.21 115.31 115.39 3dkl h LEU 328 Ca 0.06 -0.15 -0.02 0.00 0.09 0.00 0.00 57.88 57.87 3dkl h LEU 328 Cb 0.23 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 3dkl h LEU 328 CO -0.00 0.71 -0.08 1.23 0.09 0.00 0.00 178.44 180.39 3dkl h GLY 329 N 1.13 0.00 0.61 0.83 0.00 -0.94 0.38 103.07 105.08 3dkl h GLY 329 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3dkl h GLY 329 CO 0.06 0.00 -1.10 0.28 0.00 0.00 0.00 176.54 175.78 3dkl n LYS 330 N -3.43 0.37 -0.01 4.80 5.02 -0.85 -4.30 118.16 119.76 3dkl n LYS 330 Ca -0.02 -0.00 0.09 0.00 -2.02 0.00 0.00 58.31 56.37 3dkl n LYS 330 Cb 0.22 -1.62 -0.14 0.00 -0.02 0.00 0.00 35.03 33.47 3dkl n LYS 330 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3dkl n LYS 331 N -2.10 0.65 -4.25 1.97 4.76 -0.75 -5.01 118.16 113.43 3dkl n LYS 331 Ca 0.01 -0.14 -0.17 0.00 -2.87 0.00 0.00 58.31 55.14 3dkl n LYS 331 Cb 0.46 -1.42 -0.11 0.00 -1.84 0.00 0.00 35.03 32.13 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 -3.17 1.40 -0.63 2.13 0.40 0.05 -5.01 117.98 113.15 3dkl s PHE 332 Ca -0.04 -0.60 -0.27 0.00 -0.60 0.00 0.00 56.93 55.41 3dkl s PHE 332 Cb 0.12 -0.72 0.01 0.00 0.51 0.00 0.00 43.02 42.95 3dkl s PHE 332 CO 0.76 0.16 1.46 -1.25 0.70 0.00 0.00 175.22 177.05 3dkl s PRO 333 N -3.01 3.12 0.14 0.24 0.05 -1.26 -4.67 135.00 129.61 3dkl s PRO 333 Ca 0.12 0.25 -0.24 0.00 0.05 0.00 0.00 61.00 61.18 3dkl s PRO 333 Cb -0.03 -4.20 -0.08 0.00 0.05 0.00 0.00 34.50 30.25 3dkl s PRO 333 CO 0.03 -2.18 0.72 0.08 0.05 0.00 0.00 177.00 175.69 3dkl s VAL 334 N 6.59 4.47 0.48 -0.36 1.01 -1.26 -3.87 120.40 127.47 3dkl s VAL 334 Ca 0.49 1.56 0.06 0.00 0.00 0.00 0.00 61.98 64.10 3dkl s VAL 334 Cb -0.10 -4.07 -0.00 0.00 0.00 0.00 0.00 36.38 32.20 3dkl s VAL 334 CO 0.21 0.53 0.28 0.42 0.00 0.00 0.00 175.10 176.54 3dkl s THR 335 N -1.14 1.95 -0.15 3.92 -4.23 -0.24 -4.93 115.64 110.82 3dkl s THR 335 Ca 0.34 -1.59 0.01 0.00 -1.18 0.00 0.00 61.69 59.27 3dkl s THR 335 Cb -0.22 -2.54 0.01 0.00 1.34 0.00 0.00 72.50 71.09 3dkl s THR 335 CO 0.24 0.00 -0.19 -0.70 -0.54 0.00 0.00 174.62 173.43 3dkl s GLU 336 N -4.09 3.08 0.87 3.99 2.12 -1.26 -0.19 118.70 123.22 3dkl s GLU 336 Ca 0.35 -0.82 -0.15 0.00 0.36 0.00 0.00 54.97 54.72 3dkl s GLU 336 Cb 0.00 -2.53 0.20 0.00 0.26 0.00 0.00 34.13 32.07 3dkl s GLU 336 CO 0.21 -0.04 1.08 0.27 -0.54 0.00 0.00 175.26 176.23 3dkl n ASN 337 N 4.18 -0.36 0.00 -1.70 0.23 0.02 -4.88 115.26 112.75 3dkl n ASN 337 Ca -0.20 -1.33 0.06 0.00 -0.53 0.00 0.00 54.58 52.58 3dkl n ASN 337 Cb 0.51 -0.86 0.27 0.00 -2.08 0.00 0.00 39.78 37.63 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 -3.92 0.01 -0.92 0.53 3.41 -1.26 -1.66 113.62 109.81 3dkl n SER 338 Ca 0.14 0.50 0.12 0.00 -0.26 0.00 0.00 58.87 59.37 3dkl n SER 338 Cb 0.49 -0.50 0.20 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 -1.51 2.26 -0.41 4.33 4.76 -1.26 -4.95 118.16 121.37 3dkl n LYS 339 Ca 0.03 -1.85 0.00 0.00 -2.87 0.00 0.00 58.31 53.62 3dkl n LYS 339 Cb 0.15 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 31.86 3dkl n LYS 339 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 3dkl n GLY 340 N 1.35 0.75 3.89 0.72 0.00 -0.66 -5.03 105.19 106.20 3dkl n GLY 340 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 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 -2.45 3.56 0.24 1.61 1.51 -1.26 -4.81 117.35 115.76 3dkl s TYR 341 Ca 0.00 0.58 -0.30 0.00 -1.01 0.00 0.00 57.07 56.35 3dkl s TYR 341 Cb 0.00 -2.00 -0.09 0.00 -0.11 0.00 0.00 41.96 39.76 3dkl s TYR 341 CO 0.00 0.58 1.21 0.15 -1.11 0.00 0.00 175.55 176.37 3dkl s LYS 342 N -1.93 4.49 -0.06 -0.62 1.02 0.13 -0.80 119.74 121.96 3dkl s LYS 342 Ca 0.30 1.95 0.02 0.00 0.02 0.00 0.00 55.97 58.26 3dkl s LYS 342 Cb -0.13 -3.18 0.02 0.00 -0.52 0.00 0.00 37.83 34.01 3dkl s LYS 342 CO 0.18 -0.04 -0.10 -1.17 -0.92 0.00 0.00 175.35 173.30 3dkl s LEU 343 N -0.89 1.53 0.71 3.17 2.96 0.74 -1.94 118.68 124.95 3dkl s LEU 343 Ca 0.50 -0.25 -0.13 0.00 -0.22 0.00 0.00 54.13 54.03 3dkl s LEU 343 Cb -0.34 -0.72 0.02 0.00 0.50 0.00 0.00 46.19 45.65 3dkl s LEU 343 CO 0.41 -0.00 1.09 -0.76 -1.32 0.00 0.00 176.35 175.78 3dkl s LEU 344 N 0.80 3.22 0.79 -0.68 1.43 -1.26 -1.07 118.68 121.91 3dkl s LEU 344 Ca -0.12 1.88 -0.14 0.00 -1.03 0.00 0.00 54.13 54.72 3dkl s LEU 344 Cb -0.15 -4.53 0.07 0.00 0.03 0.00 0.00 46.19 41.61 3dkl s LEU 344 CO 0.02 -1.77 1.21 -2.16 0.23 0.00 0.00 176.35 173.88 3dkl s PRO 345 N -4.53 1.72 0.62 1.29 0.04 -1.25 -4.87 135.00 128.02 3dkl s PRO 345 Ca 0.63 1.77 0.41 0.00 0.04 0.00 0.00 61.00 63.85 3dkl s PRO 345 Cb -0.18 -1.78 2.06 0.00 0.04 0.00 0.00 34.50 34.64 3dkl s PRO 345 CO 0.49 -2.16 2.23 -1.00 0.04 0.00 0.00 177.00 176.60 3dkl h PRO 346 N -0.78 0.00 -0.07 0.56 0.13 -1.94 -1.62 132.00 128.28 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 0.47 0.00 0.00 2.48 -0.23 0.00 0.00 178.00 180.72 3dkl n TYR 347 N -3.04 0.09 -3.70 1.56 0.18 -1.26 -4.61 117.16 106.37 3dkl n TYR 347 Ca -0.02 -0.05 -0.16 0.00 1.88 0.00 0.00 57.90 59.56 3dkl n TYR 347 Cb 0.14 0.00 -0.16 0.00 -0.38 0.00 0.00 39.34 38.95 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 -1.19 0.28 0.36 -3.48 2.96 -0.61 -1.36 118.68 115.64 3dkl s LEU 348 Ca 0.13 0.27 0.06 0.00 -0.22 0.00 0.00 54.13 54.37 3dkl s LEU 348 Cb 0.06 0.22 -0.03 0.00 0.50 0.00 0.00 46.19 46.95 3dkl s LEU 348 CO 0.10 -0.21 0.23 -0.13 -1.32 0.00 0.00 176.35 175.02 3dkl s ARG 349 N 1.84 1.82 0.02 1.98 1.81 0.35 -4.55 118.95 122.22 3dkl s ARG 349 Ca -0.01 -2.08 0.02 0.00 -1.72 0.00 0.00 55.73 51.94 3dkl s ARG 349 Cb -0.12 0.02 -0.01 0.00 -0.45 0.00 0.00 34.95 34.39 3dkl s ARG 349 CO -0.05 -0.60 -0.07 0.08 -0.68 0.00 0.00 175.30 173.98 3dkl s VAL 350 N -3.37 0.51 -0.06 3.52 1.01 -0.95 -1.75 120.40 119.31 3dkl s VAL 350 Ca 0.35 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.75 3dkl s VAL 350 Cb 0.02 -0.49 0.02 0.00 0.00 0.00 0.00 36.38 35.93 3dkl s VAL 350 CO 0.23 -0.07 -0.07 -0.51 0.00 0.00 0.00 175.10 174.68 3dkl s ILE 351 N -0.63 0.76 -0.33 2.22 2.07 -0.66 -1.45 121.20 123.17 3dkl s ILE 351 Ca -0.02 -0.23 -0.09 0.00 -1.41 0.00 0.00 60.65 58.89 3dkl s ILE 351 Cb -0.05 -0.75 0.02 0.00 0.13 0.00 0.00 42.46 41.80 3dkl s ILE 351 CO 0.00 0.28 0.14 -1.58 -1.91 0.00 0.00 174.94 171.87 3dkl s GLN 352 N 0.96 2.99 -0.09 3.50 2.00 -0.62 -3.56 119.66 124.83 3dkl s GLN 352 Ca -0.10 -0.95 0.14 0.00 -2.00 0.00 0.00 55.36 52.45 3dkl s GLN 352 Cb -0.15 -3.54 0.21 0.00 0.80 0.00 0.00 33.01 30.33 3dkl s GLN 352 CO 0.00 -0.55 1.10 0.41 -0.50 0.00 0.00 175.29 175.74 3dkl n GLY 353 N 4.92 4.01 3.50 2.59 0.00 -1.26 -1.55 105.19 117.40 3dkl n GLY 353 Ca -0.13 -0.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.74 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 -2.32 4.56 -1.59 1.61 2.15 -1.26 -4.68 116.67 115.14 3dkl s ASP 354 Ca 0.23 -0.14 0.00 0.00 0.43 0.00 0.00 52.55 53.07 3dkl s ASP 354 Cb 0.20 -1.53 0.00 0.00 -0.30 0.00 0.00 42.92 41.29 3dkl s ASP 354 CO 0.02 0.23 0.00 0.61 -0.17 0.00 0.00 175.17 175.87 3dkl n GLY 355 N 3.08 -0.31 3.62 2.66 0.00 -1.26 -4.82 105.19 108.16 3dkl n GLY 355 Ca -0.18 -0.11 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 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 -2.91 4.92 0.12 1.61 1.01 -1.26 -4.77 120.40 119.13 3dkl s VAL 356 Ca 0.00 1.14 0.03 0.00 0.00 0.00 0.00 61.98 63.15 3dkl s VAL 356 Cb 0.00 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 3dkl s VAL 356 CO 0.00 -0.07 0.11 -0.90 0.00 0.00 0.00 175.10 174.24 3dkl n ASP 357 N 5.88 -0.28 0.16 3.32 5.68 -1.26 -4.22 116.55 125.83 3dkl n ASP 357 Ca 0.01 -1.82 0.04 0.00 -0.50 0.00 0.00 54.79 52.52 3dkl n ASP 357 Cb 0.49 0.64 0.47 0.00 -1.14 0.00 0.00 41.12 41.58 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 1.40 1.12 0.03 2.12 2.10 -1.95 0.13 117.51 122.47 3dkl h ILE 358 Ca -0.09 -0.51 -0.00 0.00 1.08 0.00 0.00 64.86 65.34 3dkl h ILE 358 Cb 0.45 1.11 0.00 0.00 -1.09 0.00 0.00 36.82 37.29 3dkl h ILE 358 CO 0.13 0.16 -0.01 0.78 -1.08 0.00 0.00 178.15 178.13 3dkl h ASN 359 N 0.17 -0.03 0.05 2.19 2.35 -1.97 -2.69 115.58 115.65 3dkl h ASN 359 Ca 0.04 -0.55 -0.11 0.00 -0.55 0.00 0.00 56.30 55.13 3dkl h ASN 359 Cb 0.23 0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 3dkl h ASN 359 CO 0.01 0.55 -0.35 0.71 -1.65 0.00 0.00 177.43 176.70 3dkl h THR 360 N -0.63 1.29 -0.45 2.81 1.35 -1.81 -1.67 112.91 113.80 3dkl h THR 360 Ca -0.00 -1.43 0.07 0.00 -0.55 0.00 0.00 66.41 64.49 3dkl h THR 360 Cb 0.58 1.52 -0.06 0.00 -1.73 0.00 0.00 68.15 68.47 3dkl h THR 360 CO 0.01 0.44 0.11 0.25 -0.25 0.00 0.00 175.52 176.08 3dkl h LEU 361 N 0.35 0.06 -0.37 3.87 6.46 -0.80 -0.68 115.31 124.20 3dkl h LEU 361 Ca 0.04 0.07 0.03 0.00 -0.12 0.00 0.00 57.88 57.90 3dkl h LEU 361 Cb 0.78 0.08 -0.03 0.00 -0.73 0.00 0.00 40.66 40.76 3dkl h LEU 361 CO 0.06 0.06 0.18 -0.61 -0.62 0.00 0.00 178.44 177.51 3dkl h GLN 362 N 0.26 0.36 -0.20 1.25 5.75 -1.11 -2.37 115.11 119.04 3dkl h GLN 362 Ca 0.22 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.73 3dkl h GLN 362 Cb 0.26 -0.08 -0.03 0.00 1.07 0.00 0.00 27.48 28.70 3dkl h GLN 362 CO -0.27 0.23 -0.01 1.49 -2.65 0.00 0.00 178.83 177.63 3dkl h GLU 363 N 0.37 0.05 -0.17 1.69 4.81 -0.89 -2.28 114.58 118.16 3dkl h GLU 363 Ca 0.16 -0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3dkl h GLU 363 Cb 0.07 -0.01 -0.01 0.00 0.63 0.00 0.00 28.75 29.43 3dkl h GLU 363 CO -0.12 0.03 0.09 0.82 -0.73 0.00 0.00 179.01 179.11 3dkl h ILE 364 N 0.05 1.10 -0.31 2.32 2.04 -1.04 0.07 117.51 121.74 3dkl h ILE 364 Ca 0.09 -0.27 -0.11 0.00 1.00 0.00 0.00 64.86 65.57 3dkl h ILE 364 Cb 0.12 0.98 -0.01 0.00 -0.74 0.00 0.00 36.82 37.17 3dkl h ILE 364 CO -0.16 0.09 -0.26 -0.37 0.00 0.00 0.00 178.15 177.45 3dkl h VAL 365 N 0.17 1.27 -0.20 1.67 -1.51 -1.37 0.25 116.25 116.52 3dkl h VAL 365 Ca 0.06 -1.34 -0.05 0.00 -1.23 0.00 0.00 66.70 64.13 3dkl h VAL 365 Cb 0.07 1.32 -0.01 0.00 -2.13 0.00 0.00 31.29 30.54 3dkl h VAL 365 CO -0.01 0.44 -0.08 -0.08 -1.23 0.00 0.00 177.57 176.61 3dkl h GLU 366 N 0.54 0.41 -0.76 5.19 4.57 -1.35 -0.53 114.58 122.64 3dkl h GLU 366 Ca 0.07 -0.17 -0.02 0.00 -1.18 0.00 0.00 59.36 58.06 3dkl h GLU 366 Cb 0.73 -0.02 -0.03 0.00 -0.16 0.00 0.00 28.75 29.27 3dkl h GLU 366 CO 0.06 0.68 0.38 0.78 -1.18 0.00 0.00 179.01 179.73 3dkl h GLY 367 N 0.11 1.16 0.58 1.92 0.00 -0.69 -0.31 103.07 105.85 3dkl h GLY 367 Ca 0.05 -0.56 0.04 0.00 0.00 0.00 0.00 47.33 46.85 3dkl h GLY 367 CO 0.03 0.54 -0.07 -0.33 0.00 0.00 0.00 176.54 176.70 3dkl h MET 368 N 1.06 -0.05 -0.66 4.80 2.86 -0.42 -1.71 114.93 120.81 3dkl h MET 368 Ca 0.26 0.00 0.05 0.00 -2.06 0.00 0.00 59.70 57.96 3dkl h MET 368 Cb 0.10 0.01 -0.05 0.00 0.06 0.00 0.00 31.60 31.72 3dkl h MET 368 CO -0.04 -0.03 0.37 -0.22 1.06 0.00 0.00 176.91 178.05 3dkl h LYS 369 N -0.05 0.68 -0.92 1.72 3.64 -0.74 -0.67 116.57 120.22 3dkl h LYS 369 Ca 0.09 -0.04 0.02 0.00 -1.27 0.00 0.00 60.65 59.45 3dkl h LYS 369 Cb 0.19 -0.15 -0.05 0.00 -0.41 0.00 0.00 32.23 31.81 3dkl h LYS 369 CO -0.21 0.45 0.61 0.37 -2.27 0.00 0.00 179.45 178.40 3dkl h GLN 370 N 0.70 1.18 -0.47 1.90 5.75 -0.90 -0.67 115.11 122.61 3dkl h GLN 370 Ca 0.29 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.72 3dkl h GLN 370 Cb 0.15 -0.27 0.00 0.00 1.07 0.00 0.00 27.48 28.43 3dkl h GLN 370 CO -0.16 0.78 0.00 1.63 -2.65 0.00 0.00 178.83 178.43 3dkl n LYS 371 N -4.41 2.12 -2.06 1.69 4.76 -0.55 -4.93 118.16 114.77 3dkl n LYS 371 Ca 0.11 -1.38 -0.10 0.00 -2.87 0.00 0.00 58.31 54.07 3dkl n LYS 371 Cb 0.04 -1.43 -0.01 0.00 -1.84 0.00 0.00 35.03 31.79 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 0.51 -0.79 -3.73 1.97 2.81 -0.26 -4.96 117.12 112.67 3dkl n MET 372 Ca 0.13 0.54 -0.36 0.00 -1.81 0.00 0.00 57.70 56.20 3dkl n MET 372 Cb 0.41 -4.58 -0.10 0.00 -0.71 0.00 0.00 33.22 28.24 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 -2.49 3.27 0.37 2.03 0.52 -0.37 0.19 118.94 122.47 3dkl s TRP 373 Ca 0.00 0.12 -0.28 0.00 0.02 0.00 0.00 56.10 55.96 3dkl s TRP 373 Cb 0.00 -2.24 -0.10 0.00 -1.15 0.00 0.00 33.47 29.98 3dkl s TRP 373 CO 0.00 0.02 1.37 0.45 0.02 0.00 0.00 176.95 178.80 3dkl s SER 374 N 1.06 6.49 0.11 2.95 0.15 -0.82 -4.00 113.70 119.63 3dkl s SER 374 Ca 0.07 2.80 0.14 0.00 0.70 0.00 0.00 55.95 59.66 3dkl s SER 374 Cb -0.14 -2.65 0.62 0.00 -1.71 0.00 0.00 66.02 62.14 3dkl s SER 374 CO 0.04 -0.75 1.43 -0.38 1.20 0.00 0.00 173.24 174.79 3dkl n ILE 375 N 0.48 1.23 0.17 6.45 2.08 -1.26 -2.25 119.36 126.25 3dkl n ILE 375 Ca 0.01 0.38 0.15 0.00 0.56 0.00 0.00 62.75 63.86 3dkl n ILE 375 Cb 0.41 -1.28 0.74 0.00 -0.75 0.00 0.00 39.64 38.77 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 0.00 0.00 0.38 5.08 -1.91 -2.83 114.58 115.30 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 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3dkl h GLU 376 CO 0.00 0.00 0.00 -0.91 -1.00 0.00 0.00 179.01 177.10 3dkl h ASN 377 N 0.00 0.00 -4.16 1.42 2.35 -1.80 -3.46 115.58 109.93 3dkl h ASN 377 Ca 0.10 0.00 -0.59 0.00 -0.55 0.00 0.00 56.30 55.26 3dkl h ASN 377 Cb 0.47 0.00 -0.23 0.00 0.05 0.00 0.00 38.32 38.61 3dkl h ASN 377 CO -0.00 0.00 -0.84 -0.51 -1.65 0.00 0.00 177.43 174.43 3dkl s ILE 378 N -3.38 1.82 0.20 2.81 1.10 -1.07 -2.24 121.20 120.43 3dkl s ILE 378 Ca 0.05 -1.50 0.01 0.00 -0.51 0.00 0.00 60.65 58.71 3dkl s ILE 378 Cb 0.08 -1.62 -0.05 0.00 0.15 0.00 0.00 42.46 41.02 3dkl s ILE 378 CO 0.57 0.05 0.04 0.00 -2.11 0.00 0.00 174.94 173.49 3dkl s ALA 379 N -1.05 1.43 0.05 1.50 0.00 -0.53 -4.97 121.76 118.20 3dkl s ALA 379 Ca 0.08 -1.68 0.07 0.00 0.00 0.00 0.00 51.96 50.43 3dkl s ALA 379 Cb -0.10 0.77 -0.03 0.00 0.00 0.00 0.00 23.12 23.76 3dkl s ALA 379 CO 0.04 -0.39 -0.18 -0.06 0.00 0.00 0.00 175.76 175.17 3dkl s PHE 380 N -3.74 1.60 -0.00 0.00 0.40 0.67 -1.58 117.98 115.32 3dkl s PHE 380 Ca 0.29 -0.38 0.05 0.00 -0.60 0.00 0.00 56.93 56.29 3dkl s PHE 380 Cb 0.07 -0.93 -0.03 0.00 0.51 0.00 0.00 43.02 42.63 3dkl s PHE 380 CO 0.07 0.09 -0.15 0.20 0.70 0.00 0.00 175.22 176.14 3dkl s GLY 381 N -1.34 1.58 -0.09 4.36 0.00 -0.60 0.65 107.32 111.89 3dkl s GLY 381 Ca 0.05 -1.08 -0.04 0.00 0.00 0.00 0.00 44.72 43.65 3dkl s GLY 381 CO 0.02 -0.92 0.20 -0.45 0.00 0.00 0.00 173.10 171.95 3dkl s SER 382 N -1.15 -0.19 0.00 1.64 0.15 0.04 -4.26 113.70 109.93 3dkl s SER 382 Ca 0.14 0.42 0.00 0.00 0.70 0.00 0.00 55.95 57.21 3dkl s SER 382 Cb -0.11 0.31 0.00 0.00 -1.71 0.00 0.00 66.02 64.52 3dkl s SER 382 CO 0.04 -0.15 0.00 0.61 1.20 0.00 0.00 173.24 174.93 3dkl n GLY 383 N 4.15 -0.09 0.28 9.45 0.00 -1.26 -1.02 105.19 116.70 3dkl n GLY 383 Ca -0.25 0.00 0.03 0.00 0.00 0.00 0.00 46.02 45.80 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 1.15 2.00 -0.02 0.00 -1.86 -0.66 103.07 103.68 3dkl h GLY 384 Ca 0.00 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.09 3dkl h GLY 384 CO 0.00 0.01 -0.13 -1.33 0.00 0.00 0.00 176.54 175.09 3dkl h GLY 385 N 0.58 0.00 0.73 4.60 0.00 -1.89 0.46 103.07 107.55 3dkl h GLY 385 Ca 0.39 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.44 3dkl h GLY 385 CO -0.32 0.00 -1.36 -2.00 0.00 0.00 0.00 176.54 172.87 3dkl h LEU 386 N 0.00 0.50 0.00 3.11 5.85 -1.49 -3.42 115.31 119.86 3dkl h LEU 386 Ca -0.00 -0.90 0.00 0.00 0.84 0.00 0.00 57.88 57.82 3dkl h LEU 386 Cb 0.23 -0.16 0.00 0.00 0.37 0.00 0.00 40.66 41.10 3dkl h LEU 386 CO 0.02 1.61 -0.83 0.18 -0.34 0.00 0.00 178.44 179.08 3dkl n LEU 387 N -3.88 0.03 0.00 2.25 4.77 -0.36 -4.86 117.00 114.95 3dkl n LEU 387 Ca -0.22 -0.14 0.00 0.00 -0.03 0.00 0.00 56.01 55.62 3dkl n LEU 387 Cb 0.94 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.03 3dkl n LEU 387 CO 0.47 0.01 -0.44 1.67 -1.33 0.00 0.00 177.39 177.77 3dkl n GLN 388 N -1.44 1.29 -1.61 3.23 -0.06 0.13 -4.82 117.38 114.10 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 0.06 -0.94 -0.02 0.00 -4.06 0.00 0.00 30.24 25.28 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 -2.17 4.00 -3.78 3.69 4.81 0.14 -4.77 118.16 120.07 3dkl n LYS 389 Ca 0.00 -2.73 -0.13 0.00 -0.87 0.00 0.00 58.31 54.59 3dkl n LYS 389 Cb 0.44 -2.76 -0.11 0.00 0.02 0.00 0.00 35.03 32.62 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 -0.60 0.98 0.27 3.14 1.43 -1.26 -4.93 118.68 117.71 3dkl s LEU 390 Ca 0.62 0.41 0.05 0.00 -1.03 0.00 0.00 54.13 54.19 3dkl s LEU 390 Cb 0.18 0.97 -0.06 0.00 0.03 0.00 0.00 46.19 47.32 3dkl s LEU 390 CO -0.07 -0.18 -0.02 0.42 0.23 0.00 0.00 176.35 176.74 3dkl s THR 391 N -0.22 1.34 -0.69 5.49 -4.23 -1.26 -5.02 115.64 111.05 3dkl s THR 391 Ca -0.03 -2.07 0.12 0.00 -1.18 0.00 0.00 61.69 58.53 3dkl s THR 391 Cb -0.03 -2.47 0.12 0.00 1.34 0.00 0.00 72.50 71.46 3dkl s THR 391 CO 0.01 -0.26 1.38 -1.14 -0.54 0.00 0.00 174.62 174.08 3dkl n ARG 392 N -0.54 0.07 0.02 3.99 0.63 -1.26 -2.29 116.66 117.28 3dkl n ARG 392 Ca -0.05 0.48 0.12 0.00 -0.92 0.00 0.00 57.85 57.48 3dkl n ARG 392 Cb 0.64 -1.69 0.12 0.00 0.45 0.00 0.00 32.46 31.98 3dkl n ARG 392 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3dkl n ASP 393 N -1.83 0.62 -0.21 6.15 8.00 -1.26 -1.79 116.55 126.24 3dkl n ASP 393 Ca 0.01 -0.24 -0.07 0.00 0.71 0.00 0.00 54.79 55.19 3dkl n ASP 393 Cb 0.07 0.50 0.03 0.00 -0.02 0.00 0.00 41.12 41.70 3dkl n ASP 393 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3dkl h LEU 394 N 0.00 0.78 -2.88 0.64 5.85 -1.87 -2.46 115.31 115.37 3dkl h LEU 394 Ca 0.00 -0.14 0.00 0.00 0.84 0.00 0.00 57.88 58.58 3dkl h LEU 394 Cb 0.63 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.45 3dkl h LEU 394 CO 0.00 0.71 0.00 0.18 -0.34 0.00 0.00 178.44 178.99 3dkl n LEU 395 N -4.51 3.48 -3.29 2.25 4.77 -1.26 -4.99 117.00 113.45 3dkl n LEU 395 Ca 0.03 -2.08 -0.21 0.00 -0.03 0.00 0.00 56.01 53.72 3dkl n LEU 395 Cb 0.14 -0.36 0.07 0.00 -2.33 0.00 0.00 43.42 40.94 3dkl n LEU 395 CO 0.38 0.83 0.20 -3.20 -1.33 0.00 0.00 177.39 174.27 3dkl n ASN 396 N 0.91 -5.22 -4.70 -1.43 5.15 -0.93 -3.02 115.26 106.02 3dkl n ASN 396 Ca 0.18 -0.50 -0.42 0.00 -0.60 0.00 0.00 54.58 53.23 3dkl n ASN 396 Cb 0.55 -4.63 -0.03 0.00 -0.53 0.00 0.00 39.78 35.14 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 1.48 -0.25 -0.07 0.00 0.01 -0.48 -4.89 113.70 109.50 3dkl s SER 398 Ca 0.63 0.24 0.02 0.00 1.31 0.00 0.00 55.95 58.14 3dkl s SER 398 Cb -0.32 0.41 0.02 0.00 0.21 0.00 0.00 66.02 66.33 3dkl s SER 398 CO 0.28 -0.39 -0.11 0.12 0.41 0.00 0.00 173.24 173.55 3dkl s PHE 399 N -1.02 1.35 -0.04 2.43 5.36 -1.26 -1.60 117.98 123.20 3dkl s PHE 399 Ca -0.11 -0.50 -0.06 0.00 -0.96 0.00 0.00 56.93 55.30 3dkl s PHE 399 Cb -0.04 -1.02 0.01 0.00 -0.34 0.00 0.00 43.02 41.63 3dkl s PHE 399 CO 0.04 -0.28 0.15 0.15 -1.46 0.00 0.00 175.22 173.81 3dkl s LYS 400 N 0.78 0.27 0.02 10.12 -0.14 -0.52 -4.95 119.74 125.33 3dkl s LYS 400 Ca -0.13 0.03 -0.30 0.00 -1.36 0.00 0.00 55.97 54.22 3dkl s LYS 400 Cb -0.15 0.12 -0.06 0.00 -1.68 0.00 0.00 37.83 36.06 3dkl s LYS 400 CO 0.02 -0.05 1.37 0.00 -0.76 0.00 0.00 175.35 175.94 3dkl n SER 402 N 5.04 0.27 -3.67 0.00 3.41 -0.52 -4.34 113.62 113.81 3dkl n SER 402 Ca 0.12 -0.63 -0.12 0.00 -0.26 0.00 0.00 58.87 57.98 3dkl n SER 402 Cb 0.44 0.91 -0.09 0.00 -0.26 0.00 0.00 64.21 65.21 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 -1.23 -0.72 0.06 7.33 5.04 -1.06 0.01 117.35 126.78 3dkl s TYR 403 Ca 0.02 1.62 0.02 0.00 -2.44 0.00 0.00 57.07 56.29 3dkl s TYR 403 Cb 0.03 0.31 -0.03 0.00 0.35 0.00 0.00 41.96 42.62 3dkl s TYR 403 CO 0.13 -0.36 -0.07 0.14 -1.34 0.00 0.00 175.55 174.06 3dkl s VAL 404 N 0.79 0.52 -0.18 3.14 -7.23 -0.90 -0.74 120.40 115.80 3dkl s VAL 404 Ca -0.04 -1.33 -0.02 0.00 -1.81 0.00 0.00 61.98 58.78 3dkl s VAL 404 Cb -0.05 -0.91 -0.01 0.00 0.56 0.00 0.00 36.38 35.97 3dkl s VAL 404 CO -0.06 -0.56 -0.08 -0.69 -0.31 0.00 0.00 175.10 173.40 3dkl s VAL 405 N -2.12 3.21 -0.05 1.32 1.01 -0.64 -0.69 120.40 122.44 3dkl s VAL 405 Ca -0.04 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.39 3dkl s VAL 405 Cb -0.05 -2.41 0.02 0.00 0.00 0.00 0.00 36.38 33.93 3dkl s VAL 405 CO -0.02 0.47 -0.08 -0.89 0.00 0.00 0.00 175.10 174.59 3dkl s THR 406 N 0.98 0.78 -1.52 3.92 2.01 -0.52 -1.27 115.64 120.01 3dkl s THR 406 Ca -0.01 -0.28 -0.14 0.00 0.31 0.00 0.00 61.69 61.57 3dkl s THR 406 Cb -0.15 -0.74 0.08 0.00 0.01 0.00 0.00 72.50 71.70 3dkl s THR 406 CO -0.00 0.27 1.00 0.59 -0.69 0.00 0.00 174.62 175.78 3dkl n ASN 407 N 3.83 -4.98 0.00 3.53 3.02 -0.28 -1.56 115.26 118.82 3dkl n ASN 407 Ca -0.24 -0.75 0.00 0.00 -0.03 0.00 0.00 54.58 53.56 3dkl n ASN 407 Cb 0.52 -3.96 0.00 0.00 -0.61 0.00 0.00 39.78 35.72 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 -1.71 0.55 3.48 7.41 0.00 -1.26 -4.98 105.19 108.67 3dkl n GLY 408 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 3dkl n GLY 408 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3dkl s LEU 409 N 0.00 3.71 0.26 0.99 1.98 -0.60 -5.07 118.68 119.94 3dkl s LEU 409 Ca 0.00 -0.23 -0.30 0.00 -2.89 0.00 0.00 54.13 50.72 3dkl s LEU 409 Cb 0.00 -1.98 -0.09 0.00 0.66 0.00 0.00 46.19 44.77 3dkl s LEU 409 CO 0.00 -0.07 1.08 -0.83 -1.89 0.00 0.00 176.35 174.64 3dkl s GLY 410 N 1.65 3.03 -0.01 7.98 0.00 -1.26 -1.43 107.32 117.28 3dkl s GLY 410 Ca 0.06 0.85 0.02 0.00 0.00 0.00 0.00 44.72 45.64 3dkl s GLY 410 CO 0.06 1.49 -0.05 -0.26 0.00 0.00 0.00 173.10 174.34 3dkl s ILE 411 N -1.00 0.42 -0.36 0.90 -4.36 0.13 -4.97 121.20 111.96 3dkl s ILE 411 Ca 0.45 -0.22 -0.24 0.00 -0.26 0.00 0.00 60.65 60.38 3dkl s ILE 411 Cb -0.31 -0.36 0.01 0.00 1.25 0.00 0.00 42.46 43.06 3dkl s ILE 411 CO 0.39 0.12 0.83 0.20 0.24 0.00 0.00 174.94 176.72 3dkl s ASN 412 N -0.08 6.60 0.20 4.36 0.01 -1.26 -2.11 114.94 122.66 3dkl s ASN 412 Ca 0.02 0.44 0.08 0.00 -0.71 0.00 0.00 52.86 52.69 3dkl s ASN 412 Cb -0.03 -2.42 -0.04 0.00 0.41 0.00 0.00 41.25 39.18 3dkl s ASN 412 CO -0.00 -0.76 -0.00 0.68 -1.51 0.00 0.00 177.10 175.50 3dkl s VAL 413 N 3.21 3.65 0.15 1.60 -7.23 0.38 -4.73 120.40 117.42 3dkl s VAL 413 Ca 0.33 -1.56 -0.25 0.00 -1.81 0.00 0.00 61.98 58.70 3dkl s VAL 413 Cb -0.13 -2.86 0.07 0.00 0.56 0.00 0.00 36.38 34.01 3dkl s VAL 413 CO 0.17 -0.18 0.97 0.72 -0.31 0.00 0.00 175.10 176.47 3dkl s PHE 414 N -1.88 -0.11 0.26 2.82 -0.12 -1.26 -4.13 117.98 113.55 3dkl s PHE 414 Ca 0.28 -0.19 0.12 0.00 -0.05 0.00 0.00 56.93 57.09 3dkl s PHE 414 Cb -0.08 0.64 -0.05 0.00 -0.63 0.00 0.00 43.02 42.90 3dkl s PHE 414 CO 0.19 -0.82 -0.19 -1.59 -0.05 0.00 0.00 175.22 172.75 3dkl s LYS 415 N -3.21 1.69 -0.48 1.99 -2.85 -1.26 -4.98 119.74 110.64 3dkl s LYS 415 Ca 0.13 -1.67 0.06 0.00 -1.00 0.00 0.00 55.97 53.49 3dkl s LYS 415 Cb -0.01 -1.82 0.24 0.00 -2.06 0.00 0.00 37.83 34.17 3dkl s LYS 415 CO 0.02 0.35 0.81 -3.47 0.10 0.00 0.00 175.35 173.17 3dkl n ASP 416 N -0.40 -2.45 -4.71 0.03 2.03 -1.26 -1.68 116.55 108.10 3dkl n ASP 416 Ca -0.07 -3.17 -0.43 0.00 0.52 0.00 0.00 54.79 51.64 3dkl n ASP 416 Cb 0.59 1.42 -0.03 0.00 -0.72 0.00 0.00 41.12 42.38 3dkl n ASP 416 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 3dkl n PRO 417 N 1.74 2.71 -0.34 -0.67 -0.02 -1.26 -4.90 135.00 132.26 3dkl n PRO 417 Ca 0.12 0.98 0.16 0.00 -2.02 0.00 0.00 63.50 62.73 3dkl n PRO 417 Cb 0.61 -2.82 0.36 0.00 -0.02 0.00 0.00 33.50 31.62 3dkl n PRO 417 CO 0.00 0.00 0.00 -0.24 1.98 0.00 0.00 175.50 177.24 3dkl h VAL 418 N 3.86 0.58 -0.06 -1.45 3.04 -2.02 -1.96 116.25 118.25 3dkl h VAL 418 Ca -0.44 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.04 3dkl h VAL 418 Cb 1.21 -0.09 0.00 0.00 -2.01 0.00 0.00 31.29 30.40 3dkl h VAL 418 CO 0.95 0.11 0.00 0.00 -1.01 0.00 0.00 177.57 177.62 3dkl n ALA 419 N -2.33 2.50 -3.27 3.17 0.00 -1.26 -4.59 120.51 114.73 3dkl n ALA 419 Ca 0.25 -0.62 -0.17 0.00 0.00 0.00 0.00 53.44 52.91 3dkl n ALA 419 Cb 0.68 -0.96 -0.07 0.00 0.00 0.00 0.00 19.45 19.11 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 -1.94 0.75 0.54 0.00 -1.08 -0.74 -4.98 116.67 109.22 3dkl s ASP 420 Ca 0.33 -1.95 0.35 0.00 -0.52 0.00 0.00 52.55 50.76 3dkl s ASP 420 Cb 0.20 0.57 1.93 0.00 -1.46 0.00 0.00 42.92 44.17 3dkl s ASP 420 CO 0.31 -0.20 2.09 1.55 0.52 0.00 0.00 175.17 179.44 3dkl h PRO 421 N 6.38 0.00 0.00 4.34 0.13 -1.81 -0.39 132.00 140.66 3dkl h PRO 421 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3dkl h PRO 421 Cb 1.03 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.16 3dkl h PRO 421 CO 0.20 0.00 0.00 -0.91 -0.23 0.00 0.00 178.00 177.06 3dkl h ASN 422 N 0.00 0.00 -0.08 1.44 2.35 -1.93 -2.45 115.58 114.91 3dkl h ASN 422 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 3dkl h ASN 422 Cb 0.03 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.40 3dkl h ASN 422 CO 0.00 0.00 0.00 0.29 -1.65 0.00 0.00 177.43 176.07 3dkl n LYS 423 N -2.60 1.45 -1.74 0.81 5.02 -0.16 -4.83 118.16 116.12 3dkl n LYS 423 Ca 0.03 -0.67 -0.42 0.00 -2.02 0.00 0.00 58.31 55.23 3dkl n LYS 423 Cb 0.37 -1.40 -0.02 0.00 -0.02 0.00 0.00 35.03 33.96 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 -0.14 2.68 -3.95 1.97 0.63 -0.93 -4.66 116.66 112.27 3dkl n ARG 424 Ca 0.17 0.95 -0.22 0.00 -0.92 0.00 0.00 57.85 57.84 3dkl n ARG 424 Cb 0.24 -2.74 -0.04 0.00 0.45 0.00 0.00 32.46 30.37 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 0.60 5.22 0.55 6.15 1.04 -0.68 -4.99 113.70 121.59 3dkl s SER 425 Ca 0.66 -0.48 -0.15 0.00 0.48 0.00 0.00 55.95 56.45 3dkl s SER 425 Cb -0.51 -1.03 -0.06 0.00 0.10 0.00 0.00 66.02 64.52 3dkl s SER 425 CO 0.46 -0.25 1.01 -0.54 0.98 0.00 0.00 173.24 174.89 3dkl s LYS 426 N -3.92 3.75 -0.17 4.02 1.02 -1.26 -4.59 119.74 118.58 3dkl s LYS 426 Ca 0.38 0.98 -0.04 0.00 0.02 0.00 0.00 55.97 57.31 3dkl s LYS 426 Cb -0.06 -2.10 -0.02 0.00 -0.52 0.00 0.00 37.83 35.12 3dkl s LYS 426 CO 0.25 -0.44 -0.04 0.15 -0.92 0.00 0.00 175.35 174.36 3dkl s LYS 427 N -4.25 3.62 1.40 1.68 1.02 -1.26 -4.57 119.74 117.39 3dkl s LYS 427 Ca 0.59 -0.54 0.00 0.00 0.02 0.00 0.00 55.97 56.05 3dkl s LYS 427 Cb -0.11 -2.93 0.00 0.00 -0.52 0.00 0.00 37.83 34.26 3dkl s LYS 427 CO 0.36 0.17 0.00 0.41 -0.92 0.00 0.00 175.35 175.37 3dkl n GLY 428 N 3.75 -1.85 3.72 -3.33 0.00 0.10 -0.59 105.19 106.98 3dkl n GLY 428 Ca -0.17 -1.39 -0.42 0.00 0.00 0.00 0.00 46.02 44.04 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 4.43 0.18 1.61 0.52 -1.26 -4.50 118.95 119.93 3dkl s ARG 429 Ca 0.00 1.84 0.09 0.00 -0.52 0.00 0.00 55.73 57.13 3dkl s ARG 429 Cb 0.00 -3.31 -0.04 0.00 0.52 0.00 0.00 34.95 32.12 3dkl s ARG 429 CO 0.00 -0.24 -0.09 -0.51 0.02 0.00 0.00 175.30 174.48 3dkl s LEU 430 N 0.78 3.01 0.04 2.53 1.43 -1.26 -0.38 118.68 124.82 3dkl s LEU 430 Ca 0.58 -0.55 -0.08 0.00 -1.03 0.00 0.00 54.13 53.05 3dkl s LEU 430 Cb -0.31 -1.70 -0.00 0.00 0.03 0.00 0.00 46.19 44.21 3dkl s LEU 430 CO 0.31 0.11 0.16 -0.94 0.23 0.00 0.00 176.35 176.22 3dkl s SER 431 N -2.80 0.07 -0.12 2.29 1.04 -0.90 -4.99 113.70 108.29 3dkl s SER 431 Ca 0.25 -0.40 -0.03 0.00 0.48 0.00 0.00 55.95 56.25 3dkl s SER 431 Cb -0.09 0.27 -0.03 0.00 0.10 0.00 0.00 66.02 66.27 3dkl s SER 431 CO 0.15 -0.53 -0.01 -0.22 0.98 0.00 0.00 173.24 173.61 3dkl s LEU 432 N -2.06 3.44 0.05 2.42 2.96 -1.26 -0.29 118.68 123.93 3dkl s LEU 432 Ca -0.06 0.01 0.00 0.00 -0.22 0.00 0.00 54.13 53.87 3dkl s LEU 432 Cb -0.01 -1.81 -0.03 0.00 0.50 0.00 0.00 46.19 44.83 3dkl s LEU 432 CO -0.04 0.27 -0.04 -1.00 -1.32 0.00 0.00 176.35 174.22 3dkl s HIS 433 N -0.25 0.53 0.19 5.38 3.76 0.33 0.15 115.29 125.38 3dkl s HIS 433 Ca 0.05 -0.81 -0.30 0.00 -0.15 0.00 0.00 55.06 53.85 3dkl s HIS 433 Cb -0.12 -0.36 -0.08 0.00 1.11 0.00 0.00 32.58 33.13 3dkl s HIS 433 CO 0.02 -0.25 0.94 1.03 -0.85 0.00 0.00 174.74 175.64 3dkl s ARG 434 N -2.88 4.80 0.68 1.40 1.81 -1.26 -0.38 118.95 123.11 3dkl s ARG 434 Ca -0.01 1.47 -0.08 0.00 -1.72 0.00 0.00 55.73 55.39 3dkl s ARG 434 Cb -0.00 -3.32 0.04 0.00 -0.45 0.00 0.00 34.95 31.22 3dkl s ARG 434 CO -0.05 0.41 1.02 0.95 -0.68 0.00 0.00 175.30 176.95 3dkl s THR 435 N -0.74 2.97 0.51 0.02 -4.23 0.13 -4.84 115.64 109.46 3dkl s THR 435 Ca 0.43 0.03 0.21 0.00 -1.18 0.00 0.00 61.69 61.18 3dkl s THR 435 Cb -0.25 -3.26 0.36 0.00 1.34 0.00 0.00 72.50 70.69 3dkl s THR 435 CO 0.31 -0.30 2.03 -0.65 -0.54 0.00 0.00 174.62 175.47 3dkl h PRO 436 N -0.54 0.06 -0.01 3.99 0.11 -1.97 0.32 132.00 133.97 3dkl h PRO 436 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 3dkl h PRO 436 Cb 1.28 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.38 3dkl h PRO 436 CO 0.62 0.04 0.00 0.00 -0.21 0.00 0.00 178.00 178.45 3dkl n ALA 437 N -2.60 2.65 -1.09 -0.75 0.00 -1.26 -4.89 120.51 112.58 3dkl n ALA 437 Ca 0.07 -0.21 0.00 0.00 0.00 0.00 0.00 53.44 53.29 3dkl n ALA 437 Cb 0.45 -1.41 0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 0.97 0.44 0.54 0.00 0.00 0.11 -5.05 105.19 102.20 3dkl n GLY 438 Ca 0.21 -0.98 -0.03 0.00 0.00 0.00 0.00 46.02 45.22 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 1.84 0.23 -4.60 1.61 5.03 -1.26 -4.77 115.26 113.35 3dkl n ASN 439 Ca 0.00 -1.18 -0.32 0.00 0.87 0.00 0.00 54.58 53.95 3dkl n ASN 439 Cb 0.08 -0.08 -0.10 0.00 -1.02 0.00 0.00 39.78 38.67 3dkl n ASN 439 CO 0.00 0.00 0.00 -0.36 -1.83 0.00 0.00 177.26 175.07 3dkl s PHE 440 N 0.11 2.88 -0.03 3.10 0.40 -1.26 0.19 117.98 123.37 3dkl s PHE 440 Ca 0.09 -0.05 -0.03 0.00 -0.60 0.00 0.00 56.93 56.34 3dkl s PHE 440 Cb -0.01 -1.59 0.01 0.00 0.51 0.00 0.00 43.02 41.94 3dkl s PHE 440 CO 0.06 0.38 0.08 0.54 0.70 0.00 0.00 175.22 176.98 3dkl s VAL 441 N -1.03 -0.00 -0.28 -0.44 0.11 0.48 -4.82 120.40 114.42 3dkl s VAL 441 Ca 0.18 0.01 -0.11 0.00 -2.93 0.00 0.00 61.98 59.13 3dkl s VAL 441 Cb -0.11 -0.13 -0.05 0.00 -1.53 0.00 0.00 36.38 34.56 3dkl s VAL 441 CO 0.09 0.00 0.20 -0.89 -3.33 0.00 0.00 175.10 171.17 3dkl s THR 442 N 0.11 5.30 -0.09 5.04 2.01 -1.26 -0.51 115.64 126.24 3dkl s THR 442 Ca -0.01 0.21 -0.14 0.00 0.31 0.00 0.00 61.69 62.06 3dkl s THR 442 Cb -0.01 -3.54 -0.05 0.00 0.01 0.00 0.00 72.50 68.91 3dkl s THR 442 CO -0.00 0.25 0.34 -0.76 -0.69 0.00 0.00 174.62 173.76 3dkl s LEU 443 N 1.76 4.35 0.46 4.42 1.43 0.60 -4.94 118.68 126.76 3dkl s LEU 443 Ca 0.08 0.71 0.08 0.00 -1.03 0.00 0.00 54.13 53.97 3dkl s LEU 443 Cb -0.16 -2.46 0.00 0.00 0.03 0.00 0.00 46.19 43.61 3dkl s LEU 443 CO 0.11 0.21 0.44 -1.61 0.23 0.00 0.00 176.35 175.72 3dkl s GLU 444 N -0.27 2.48 -1.46 1.70 2.02 -1.26 -2.11 118.70 119.80 3dkl s GLU 444 Ca 0.20 -1.61 -0.04 0.00 0.02 0.00 0.00 54.97 53.54 3dkl s GLU 444 Cb -0.15 -2.38 0.02 0.00 0.10 0.00 0.00 34.13 31.72 3dkl s GLU 444 CO 0.08 -0.34 0.38 0.39 0.02 0.00 0.00 175.26 175.79 3dkl n GLU 445 N -1.68 -3.61 -0.95 1.61 1.02 0.24 -0.87 120.64 116.40 3dkl n GLU 445 Ca 0.04 0.78 0.00 0.00 -0.02 0.00 0.00 57.16 57.96 3dkl n GLU 445 Cb 0.62 -5.54 0.00 0.00 -0.02 0.00 0.00 31.44 26.50 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 -1.25 0.59 0.31 0.62 0.00 0.48 -4.78 105.19 101.16 3dkl n GLY 446 Ca -0.12 0.00 0.19 0.00 0.00 0.00 0.00 46.02 46.09 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 1.56 0.00 -1.03 1.61 1.57 -1.22 -1.28 116.57 117.78 3dkl h LYS 447 Ca 0.00 0.00 0.28 0.00 -1.87 0.00 0.00 60.65 59.06 3dkl h LYS 447 Cb 0.11 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 32.36 3dkl h LYS 447 CO 0.00 0.02 0.71 0.78 -0.57 0.00 0.00 179.45 180.40 3dkl h GLY 448 N 0.62 0.46 2.00 3.86 0.00 -1.84 -1.92 103.07 106.25 3dkl h GLY 448 Ca -0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 47.33 47.23 3dkl h GLY 448 CO 0.00 -0.04 -0.09 -0.55 0.00 0.00 0.00 176.54 175.87 3dkl h ASP 449 N 0.16 0.00 0.34 0.19 3.32 -1.63 -1.87 116.42 116.93 3dkl h ASP 449 Ca 0.52 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.57 3dkl h ASP 449 Cb 1.76 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.31 3dkl h ASP 449 CO -0.11 0.09 0.00 0.18 -1.72 0.00 0.00 179.24 177.67 3dkl n LEU 450 N -3.65 0.20 0.00 1.55 4.77 -0.72 -4.89 117.00 114.26 3dkl n LEU 450 Ca -0.02 0.57 0.00 0.00 -0.03 0.00 0.00 56.01 56.53 3dkl n LEU 450 Cb 0.20 -0.56 0.00 0.00 -2.33 0.00 0.00 43.42 40.73 3dkl n LEU 450 CO 0.29 -0.47 0.00 -0.62 -1.33 0.00 0.00 177.39 175.26 3dkl n GLU 451 N -1.74 -0.67 0.07 3.23 -0.58 -0.70 -4.84 120.64 115.40 3dkl n GLU 451 Ca 0.02 0.17 0.11 0.00 -0.42 0.00 0.00 57.16 57.03 3dkl n GLU 451 Cb 0.12 -3.92 0.44 0.00 -0.57 0.00 0.00 31.44 27.50 3dkl n GLU 451 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 3dkl n GLU 452 N -1.26 0.12 -0.79 3.49 1.02 -1.26 -3.18 120.64 118.78 3dkl n GLU 452 Ca 0.00 0.29 0.06 0.00 -0.02 0.00 0.00 57.16 57.49 3dkl n GLU 452 Cb 0.17 -1.70 0.14 0.00 -0.02 0.00 0.00 31.44 30.03 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 -1.93 0.00 -4.56 -0.32 4.01 -1.26 -5.07 117.16 108.03 3dkl n TYR 453 Ca 0.04 -1.12 0.00 0.00 -0.16 0.00 0.00 57.90 56.66 3dkl n TYR 453 Cb 0.25 -0.20 0.00 0.00 -0.31 0.00 0.00 39.34 39.07 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 -0.67 0.61 3.87 2.72 0.00 -1.19 -4.39 105.19 106.15 3dkl n GLY 454 Ca 0.14 -0.80 -0.35 0.00 0.00 0.00 0.00 46.02 45.01 3dkl n GLY 454 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dkl s GLN 455 N 0.00 3.65 0.13 1.61 2.00 -1.26 -4.77 119.66 121.03 3dkl s GLN 455 Ca 0.00 0.04 -0.35 0.00 -2.00 0.00 0.00 55.36 53.05 3dkl s GLN 455 Cb 0.00 -3.08 -0.15 0.00 0.80 0.00 0.00 33.01 30.57 3dkl s GLN 455 CO 0.00 0.64 1.41 -3.47 -0.50 0.00 0.00 175.29 173.37 3dkl n ASP 456 N 1.22 2.17 0.00 6.67 4.64 -1.26 -4.67 116.55 125.32 3dkl n ASP 456 Ca -0.11 1.11 0.13 0.00 -1.38 0.00 0.00 54.79 54.53 3dkl n ASP 456 Cb 0.53 -1.29 0.41 0.00 -1.04 0.00 0.00 41.12 39.73 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 2.75 0.30 -4.78 -2.67 4.77 0.12 -4.86 117.00 112.63 3dkl n LEU 457 Ca 0.17 0.22 -0.37 0.00 -0.03 0.00 0.00 56.01 56.00 3dkl n LEU 457 Cb 0.24 -0.35 -0.04 0.00 -2.33 0.00 0.00 43.42 40.93 3dkl n LEU 457 CO 0.62 0.07 0.73 -0.76 -1.33 0.00 0.00 177.39 176.72 3dkl s LEU 458 N -3.04 4.22 0.05 2.23 1.43 -1.26 -4.54 118.68 117.77 3dkl s LEU 458 Ca 0.12 2.03 0.08 0.00 -1.03 0.00 0.00 54.13 55.34 3dkl s LEU 458 Cb 0.18 -4.09 -0.03 0.00 0.03 0.00 0.00 46.19 42.28 3dkl s LEU 458 CO 0.63 -0.38 -0.21 -1.00 0.23 0.00 0.00 176.35 175.61 3dkl s HIS 459 N -1.59 2.46 -0.10 0.29 3.76 -0.55 -4.83 115.29 114.72 3dkl s HIS 459 Ca 0.55 -0.32 -0.29 0.00 -0.15 0.00 0.00 55.06 54.85 3dkl s HIS 459 Cb -0.23 -1.42 -0.06 0.00 1.11 0.00 0.00 32.58 31.99 3dkl s HIS 459 CO 0.29 0.22 1.86 0.99 -0.85 0.00 0.00 174.74 177.25 3dkl s THR 460 N -0.91 3.32 -0.17 1.30 2.01 -1.26 -0.75 115.64 119.18 3dkl s THR 460 Ca 0.14 0.37 0.16 0.00 0.31 0.00 0.00 61.69 62.67 3dkl s THR 460 Cb -0.10 -3.29 -0.24 0.00 0.01 0.00 0.00 72.50 68.87 3dkl s THR 460 CO 0.04 -0.10 0.42 1.33 -0.69 0.00 0.00 174.62 175.63 3dkl n VAL 461 N 6.20 0.00 -3.79 3.82 0.24 0.62 -4.07 118.33 121.35 3dkl n VAL 461 Ca 0.21 -0.32 -0.13 0.00 -2.04 0.00 0.00 64.34 62.06 3dkl n VAL 461 Cb 0.43 0.30 -0.12 0.00 -1.47 0.00 0.00 33.84 32.98 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 -3.01 -0.22 -0.22 6.34 5.36 -1.07 0.05 117.98 125.21 3dkl s PHE 462 Ca -0.04 0.55 -0.11 0.00 -0.96 0.00 0.00 56.93 56.38 3dkl s PHE 462 Cb 0.11 0.06 0.08 0.00 -0.34 0.00 0.00 43.02 42.92 3dkl s PHE 462 CO 0.67 -0.13 0.51 0.21 -1.46 0.00 0.00 175.22 175.03 3dkl s LYS 463 N 0.35 0.48 -1.47 10.12 2.20 -0.24 -0.51 119.74 130.67 3dkl s LYS 463 Ca -0.02 1.02 -0.04 0.00 -0.36 0.00 0.00 55.97 56.57 3dkl s LYS 463 Cb -0.03 0.18 0.03 0.00 -1.51 0.00 0.00 37.83 36.50 3dkl s LYS 463 CO -0.01 -0.18 0.48 0.09 -0.36 0.00 0.00 175.35 175.37 3dkl n ASN 464 N 4.63 -0.92 0.00 1.43 5.03 -0.37 -1.63 115.26 123.43 3dkl n ASN 464 Ca -0.18 -1.01 0.00 0.00 0.87 0.00 0.00 54.58 54.25 3dkl n ASN 464 Cb 0.54 -2.96 0.00 0.00 -1.02 0.00 0.00 39.78 36.34 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 -1.90 0.85 3.38 7.41 0.00 -0.93 -4.67 105.19 109.33 3dkl n GLY 465 Ca -0.23 0.00 -0.31 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 -0.57 2.09 -0.17 1.61 1.02 -0.65 -0.55 119.74 122.52 3dkl s LYS 466 Ca 0.00 -0.95 -0.28 0.00 0.02 0.00 0.00 55.97 54.77 3dkl s LYS 466 Cb 0.00 -2.12 -0.01 0.00 -0.52 0.00 0.00 37.83 35.19 3dkl s LYS 466 CO 0.00 0.55 0.94 0.08 -0.92 0.00 0.00 175.35 176.01 3dkl s VAL 467 N -0.76 4.79 -0.69 3.17 1.01 -1.26 -1.08 120.40 125.59 3dkl s VAL 467 Ca 0.12 1.87 0.15 0.00 0.00 0.00 0.00 61.98 64.12 3dkl s VAL 467 Cb -0.10 -4.24 -0.16 0.00 0.00 0.00 0.00 36.38 31.87 3dkl s VAL 467 CO 0.01 -0.04 0.63 0.35 0.00 0.00 0.00 175.10 176.05 3dkl n THR 468 N 4.86 0.00 -3.60 3.92 -2.24 0.11 -4.95 114.28 112.38 3dkl n THR 468 Ca 0.08 -0.15 -0.15 0.00 -2.27 0.00 0.00 64.05 61.56 3dkl n THR 468 Cb 0.48 0.98 -0.07 0.00 -2.10 0.00 0.00 70.33 69.62 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 -2.43 0.88 0.03 -0.78 2.20 -1.23 -4.92 119.74 113.49 3dkl s LYS 469 Ca 0.05 0.82 -0.10 0.00 -0.36 0.00 0.00 55.97 56.39 3dkl s LYS 469 Cb 0.11 0.43 0.00 0.00 -1.51 0.00 0.00 37.83 36.86 3dkl s LYS 469 CO 0.62 -0.15 0.20 -1.12 -0.36 0.00 0.00 175.35 174.53 3dkl s SER 470 N 0.01 0.02 0.01 1.43 0.01 -1.26 -4.78 113.70 109.14 3dkl s SER 470 Ca -0.02 -0.32 0.04 0.00 1.31 0.00 0.00 55.95 56.95 3dkl s SER 470 Cb -0.04 0.28 -0.01 0.00 0.21 0.00 0.00 66.02 66.46 3dkl s SER 470 CO 0.03 -0.54 -0.12 -0.31 0.41 0.00 0.00 173.24 172.71 3dkl s TYR 471 N -2.40 1.10 0.68 2.43 1.51 -1.26 -5.10 117.35 114.31 3dkl s TYR 471 Ca -0.06 -0.25 -0.11 0.00 -1.01 0.00 0.00 57.07 55.63 3dkl s TYR 471 Cb -0.02 -0.69 -0.00 0.00 -0.11 0.00 0.00 41.96 41.14 3dkl s TYR 471 CO -0.03 -0.00 1.06 -1.54 -1.11 0.00 0.00 175.55 173.92 3dkl s SER 472 N -0.56 5.63 0.49 2.29 1.04 -1.26 -4.76 113.70 116.58 3dkl s SER 472 Ca 0.03 1.46 0.15 0.00 0.48 0.00 0.00 55.95 58.08 3dkl s SER 472 Cb -0.06 -2.38 1.17 0.00 0.10 0.00 0.00 66.02 64.86 3dkl s SER 472 CO 0.00 -1.27 2.09 0.15 0.98 0.00 0.00 173.24 175.20 3dkl h PHE 473 N -0.60 0.00 -0.54 5.02 3.57 -0.72 -2.02 116.94 121.65 3dkl h PHE 473 Ca -0.44 -0.00 -0.10 0.00 3.53 0.00 0.00 57.97 60.96 3dkl h PHE 473 Cb 1.21 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.93 3dkl h PHE 473 CO 0.61 0.07 -0.05 -0.44 -2.23 0.00 0.00 178.31 176.26 3dkl h ASP 474 N 0.00 0.96 -0.53 0.41 3.32 -1.90 -1.21 116.42 117.47 3dkl h ASP 474 Ca -0.00 -0.28 -0.12 0.00 0.02 0.00 0.00 57.03 56.65 3dkl h ASP 474 Cb 0.11 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.39 3dkl h ASP 474 CO 0.01 1.04 -0.12 -0.33 -1.72 0.00 0.00 179.24 178.12 3dkl h GLU 475 N 0.88 1.03 -0.53 3.56 5.08 -1.75 -2.31 114.58 120.54 3dkl h GLU 475 Ca 0.15 -0.39 0.03 0.00 -1.00 0.00 0.00 59.36 58.15 3dkl h GLU 475 Cb 0.58 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.73 3dkl h GLU 475 CO 0.04 1.07 0.31 0.82 -1.00 0.00 0.00 179.01 180.25 3dkl h ILE 476 N 0.91 1.05 -0.29 3.13 2.04 -1.27 0.13 117.51 123.20 3dkl h ILE 476 Ca 0.14 -0.21 -0.03 0.00 1.00 0.00 0.00 64.86 65.76 3dkl h ILE 476 Cb 0.69 0.37 -0.01 0.00 -0.74 0.00 0.00 36.82 37.13 3dkl h ILE 476 CO 0.05 0.11 0.08 0.03 0.00 0.00 0.00 178.15 178.42 3dkl h ARG 477 N 0.62 0.47 -0.65 2.37 3.08 -1.09 -1.44 114.38 117.74 3dkl h ARG 477 Ca 0.22 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 60.15 3dkl h ARG 477 Cb 0.03 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 29.99 3dkl h ARG 477 CO -0.10 0.54 0.37 -0.22 -1.07 0.00 0.00 179.97 179.49 3dkl h LYS 478 N 0.31 0.89 -0.26 0.04 3.64 -1.16 -1.89 116.57 118.15 3dkl h LYS 478 Ca 0.09 -0.09 0.02 0.00 -1.27 0.00 0.00 60.65 59.40 3dkl h LYS 478 Cb 0.27 -0.18 -0.01 0.00 -0.41 0.00 0.00 32.23 31.90 3dkl h LYS 478 CO -0.00 0.66 0.18 -0.91 -2.27 0.00 0.00 179.45 177.10 3dkl h ASN 479 N 0.88 0.22 -0.19 4.20 2.35 -0.40 -3.02 115.58 119.62 3dkl h ASN 479 Ca 0.23 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.98 3dkl h ASN 479 Cb 0.01 -0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.33 3dkl h ASN 479 CO -0.04 0.15 0.00 0.00 -1.65 0.00 0.00 177.43 175.89 3dkl n ALA 480 N -2.52 2.50 -1.36 -0.83 0.00 -0.57 -4.39 120.51 113.32 3dkl n ALA 480 Ca 0.02 -0.65 -0.36 0.00 0.00 0.00 0.00 53.44 52.45 3dkl n ALA 480 Cb 0.15 -1.02 0.07 0.00 0.00 0.00 0.00 19.45 18.65 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 0.69 0.48 -1.64 0.00 6.02 -1.05 -5.00 117.38 116.88 3dkl n GLN 481 Ca 0.17 0.21 -0.31 0.00 -0.01 0.00 0.00 57.00 57.06 3dkl n GLN 481 Cb 0.42 -2.04 0.05 0.00 1.02 0.00 0.00 30.24 29.69 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 -1.71 3.05 0.23 1.08 1.43 -1.26 -4.96 118.68 116.54 3dkl s LEU 482 Ca 0.71 1.50 -0.06 0.00 -1.03 0.00 0.00 54.13 55.25 3dkl s LEU 482 Cb -0.36 -4.37 0.34 0.00 0.03 0.00 0.00 46.19 41.83 3dkl s LEU 482 CO 0.53 -1.42 1.81 0.78 0.23 0.00 0.00 176.35 178.28 3dkl h ASN 483 N -0.70 0.63 0.00 2.29 2.35 -2.01 -3.54 115.58 114.59 3dkl h ASN 483 Ca -0.44 0.04 0.00 0.00 -0.55 0.00 0.00 56.30 55.35 3dkl h ASN 483 Cb 1.22 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 39.51 3dkl h ASN 483 CO 0.58 0.38 0.00 2.30 -1.65 0.00 0.00 177.43 179.04