#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k5f h PHE 47 N 0.00 0.00 -0.68 0.66 0.04 -1.98 -3.02 116.94 111.96 3k5f h PHE 47 Ca 0.00 0.00 0.16 0.00 2.80 0.00 0.00 57.97 60.93 3k5f h PHE 47 Cb 0.00 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.11 3k5f h PHE 47 CO 0.00 0.24 0.47 -0.24 -0.60 0.00 0.00 178.31 178.18 3k5f h VAL 48 N 0.00 0.75 0.00 -0.55 3.04 -2.01 0.33 116.25 117.80 3k5f h VAL 48 Ca -0.00 -0.07 0.00 0.00 -1.01 0.00 0.00 66.70 65.61 3k5f h VAL 48 Cb 0.84 0.51 0.00 0.00 -2.01 0.00 0.00 31.29 30.63 3k5f h VAL 48 CO 0.03 0.04 0.00 -0.33 -1.01 0.00 0.00 177.57 176.30 3k5f h GLU 1 N 0.21 0.00 0.00 4.17 5.08 -1.92 -2.79 114.58 119.33 3k5f h GLU 1 Ca 0.33 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.69 3k5f h GLU 1 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 3k5f h GLU 1 CO -0.06 0.00 -1.03 -1.33 -1.00 0.00 0.00 179.01 175.59 3k5f n MET 2 N -2.46 0.12 -1.77 2.33 2.81 0.11 -4.64 117.12 113.63 3k5f n MET 2 Ca 0.02 -0.01 -0.41 0.00 -1.81 0.00 0.00 57.70 55.48 3k5f n MET 2 Cb 0.25 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.26 3k5f n MET 2 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 3k5f s VAL 3 N -3.00 2.02 -1.73 2.03 1.01 -1.06 -1.84 120.40 117.84 3k5f s VAL 3 Ca 0.07 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.07 3k5f s VAL 3 Cb 0.16 -3.01 0.00 0.00 0.00 0.00 0.00 36.38 33.52 3k5f s VAL 3 CO 0.86 0.00 0.00 0.47 0.00 0.00 0.00 175.10 176.43 3k5f n ASP 4 N 1.84 -5.68 -0.14 3.32 8.00 -1.20 -4.87 116.55 117.82 3k5f n ASP 4 Ca 0.07 0.03 0.06 0.00 0.71 0.00 0.00 54.79 55.66 3k5f n ASP 4 Cb 0.38 -4.76 0.28 0.00 -0.02 0.00 0.00 41.12 37.00 3k5f n ASP 4 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 3k5f n ASN 5 N -1.95 0.43 -4.43 -2.24 0.23 -0.77 -4.78 115.26 101.75 3k5f n ASN 5 Ca -0.24 -1.74 -0.31 0.00 -0.53 0.00 0.00 54.58 51.76 3k5f n ASN 5 Cb 0.68 -0.04 -0.13 0.00 -2.08 0.00 0.00 39.78 38.20 3k5f n ASN 5 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3k5f s LEU 6 N -1.29 2.50 0.00 -4.53 1.43 -0.31 -4.38 118.68 112.09 3k5f s LEU 6 Ca 0.17 -0.43 0.06 0.00 -1.03 0.00 0.00 54.13 52.91 3k5f s LEU 6 Cb 0.08 -1.47 -0.02 0.00 0.03 0.00 0.00 46.19 44.81 3k5f s LEU 6 CO 0.13 0.27 0.23 0.54 0.23 0.00 0.00 176.35 177.76 3k5f n ARG 7 N 1.77 0.48 0.00 1.70 1.74 -0.77 -2.13 116.66 119.45 3k5f n ARG 7 Ca -0.16 -3.44 0.00 0.00 -0.77 0.00 0.00 57.85 53.47 3k5f n ARG 7 Cb 0.52 2.43 0.00 0.00 -1.02 0.00 0.00 32.46 34.39 3k5f n ARG 7 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3k5f n GLY 8 N -0.75 2.12 3.59 -0.13 0.00 -1.12 -0.63 105.19 108.26 3k5f n GLY 8 Ca 0.02 -1.32 -0.33 0.00 0.00 0.00 0.00 46.02 44.40 3k5f n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k5f s LYS 9 N -1.97 2.59 -0.02 1.61 1.02 -1.26 -1.94 119.74 119.78 3k5f s LYS 9 Ca 0.00 -0.69 -0.38 0.00 0.02 0.00 0.00 55.97 54.93 3k5f s LYS 9 Cb 0.00 -2.51 -0.16 0.00 -0.52 0.00 0.00 37.83 34.63 3k5f s LYS 9 CO 0.00 0.62 1.47 0.45 -0.92 0.00 0.00 175.35 176.97 3k5f n SER 10 N 1.73 1.93 0.00 2.83 2.88 -1.26 -0.31 113.62 121.41 3k5f n SER 10 Ca -0.16 1.10 0.00 0.00 -1.33 0.00 0.00 58.87 58.48 3k5f n SER 10 Cb 0.53 -1.19 0.00 0.00 -0.75 0.00 0.00 64.21 62.80 3k5f n SER 10 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3k5f n GLY 11 N 3.05 0.93 0.27 0.46 0.00 -1.26 -4.86 105.19 103.78 3k5f n GLY 11 Ca 0.21 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.30 3k5f n GLY 11 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k5f n GLN 12 N -2.04 2.07 0.00 1.61 6.02 0.57 -4.91 117.38 120.71 3k5f n GLN 12 Ca 0.00 -2.39 0.00 0.00 -0.01 0.00 0.00 57.00 54.60 3k5f n GLN 12 Cb 0.00 -1.46 0.00 0.00 1.02 0.00 0.00 30.24 29.80 3k5f n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3k5f n GLY 13 N -0.92 -1.81 3.71 1.08 0.00 -1.25 -4.78 105.19 101.22 3k5f n GLY 13 Ca 0.14 -1.53 -0.35 0.00 0.00 0.00 0.00 46.02 44.28 3k5f n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k5f s TYR 14 N -2.56 3.23 0.11 1.61 1.51 -1.26 -4.02 117.35 115.98 3k5f s TYR 14 Ca 0.00 0.23 0.06 0.00 -1.01 0.00 0.00 57.07 56.35 3k5f s TYR 14 Cb 0.00 -1.83 -0.04 0.00 -0.11 0.00 0.00 41.96 39.99 3k5f s TYR 14 CO 0.00 0.49 -0.14 1.52 -1.11 0.00 0.00 175.55 176.31 3k5f s TYR 15 N -0.83 1.35 0.22 2.71 -0.85 0.20 -0.41 117.35 119.73 3k5f s TYR 15 Ca 0.13 -0.55 0.11 0.00 -0.52 0.00 0.00 57.07 56.24 3k5f s TYR 15 Cb -0.12 -0.71 -0.05 0.00 0.38 0.00 0.00 41.96 41.46 3k5f s TYR 15 CO 0.02 0.12 -0.23 0.54 -1.52 0.00 0.00 175.55 174.49 3k5f s VAL 16 N -2.03 2.36 0.06 -3.49 0.11 0.98 -1.85 120.40 116.55 3k5f s VAL 16 Ca 0.07 -2.14 -0.22 0.00 -2.93 0.00 0.00 61.98 56.76 3k5f s VAL 16 Cb -0.06 -2.16 -0.06 0.00 -1.53 0.00 0.00 36.38 32.57 3k5f s VAL 16 CO 0.03 -0.21 0.67 -0.70 -3.33 0.00 0.00 175.10 171.55 3k5f s GLU 17 N -2.93 4.39 0.23 1.54 2.12 -1.26 0.35 118.70 123.14 3k5f s GLU 17 Ca 0.23 0.91 0.01 0.00 0.36 0.00 0.00 54.97 56.48 3k5f s GLU 17 Cb -0.07 -3.30 -0.04 0.00 0.26 0.00 0.00 34.13 30.98 3k5f s GLU 17 CO 0.11 0.46 0.18 -1.64 -0.54 0.00 0.00 175.26 173.83 3k5f s MET 18 N -0.60 1.35 0.01 4.30 -1.94 -0.11 -4.14 119.30 118.16 3k5f s MET 18 Ca 0.33 -1.71 0.01 0.00 -1.71 0.00 0.00 55.69 52.61 3k5f s MET 18 Cb -0.20 0.29 -0.01 0.00 2.01 0.00 0.00 34.83 36.92 3k5f s MET 18 CO 0.21 -0.46 -0.02 0.95 -0.01 0.00 0.00 175.02 175.68 3k5f s THR 19 N -3.98 0.17 0.04 2.05 -4.23 -0.32 -1.40 115.64 107.98 3k5f s THR 19 Ca 0.39 -0.29 0.02 0.00 -1.18 0.00 0.00 61.69 60.63 3k5f s THR 19 Cb 0.06 -0.18 -0.02 0.00 1.34 0.00 0.00 72.50 73.69 3k5f s THR 19 CO 0.16 -0.08 -0.08 0.68 -0.54 0.00 0.00 174.62 174.75 3k5f s VAL 20 N -0.38 0.57 0.09 2.29 -7.23 -0.85 -0.98 120.40 113.90 3k5f s VAL 20 Ca -0.03 -1.05 0.00 0.00 -1.81 0.00 0.00 61.98 59.09 3k5f s VAL 20 Cb -0.03 -0.62 0.00 0.00 0.56 0.00 0.00 36.38 36.29 3k5f s VAL 20 CO -0.00 -0.34 0.00 0.61 -0.31 0.00 0.00 175.10 175.05 3k5f n GLY 21 N 1.54 -1.82 2.82 2.32 0.00 -0.20 -1.23 105.19 108.62 3k5f n GLY 21 Ca -0.22 -1.44 -0.25 0.00 0.00 0.00 0.00 46.02 44.12 3k5f n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k5f s SER 22 N -4.53 1.85 0.75 1.61 0.01 -1.26 -2.44 113.70 109.69 3k5f s SER 22 Ca 0.00 -0.19 -0.13 0.00 1.31 0.00 0.00 55.95 56.94 3k5f s SER 22 Cb 0.00 -0.60 0.05 0.00 0.21 0.00 0.00 66.02 65.68 3k5f s SER 22 CO 0.00 -0.17 1.14 -2.16 0.41 0.00 0.00 173.24 172.46 3k5f s PRO 23 N 1.87 2.19 -0.01 12.44 0.04 -1.26 -1.41 135.00 148.86 3k5f s PRO 23 Ca 0.05 1.46 -0.35 0.00 0.04 0.00 0.00 61.00 62.20 3k5f s PRO 23 Cb -0.12 -1.87 -0.13 0.00 0.04 0.00 0.00 34.50 32.42 3k5f s PRO 23 CO -0.06 -1.74 1.73 -2.30 0.04 0.00 0.00 177.00 174.66 3k5f n PRO 24 N -3.08 2.00 -3.72 0.56 -0.02 -1.02 -4.90 135.00 124.82 3k5f n PRO 24 Ca 0.11 0.73 -0.37 0.00 -2.02 0.00 0.00 63.50 61.95 3k5f n PRO 24 Cb 0.52 -2.52 -0.12 0.00 -0.02 0.00 0.00 33.50 31.36 3k5f n PRO 24 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3k5f s GLN 25 N 2.70 3.54 0.12 -0.52 -0.21 -0.37 -4.88 119.66 120.05 3k5f s GLN 25 Ca 0.88 -0.56 -0.30 0.00 0.02 0.00 0.00 55.36 55.40 3k5f s GLN 25 Cb -0.74 -3.41 -0.06 0.00 1.00 0.00 0.00 33.01 29.80 3k5f s GLN 25 CO 0.48 -0.27 1.00 0.99 -2.12 0.00 0.00 175.29 175.37 3k5f s THR 26 N 1.61 4.35 -0.05 -0.19 2.01 -1.26 -2.01 115.64 120.11 3k5f s THR 26 Ca 0.06 1.96 -0.20 0.00 0.31 0.00 0.00 61.69 63.82 3k5f s THR 26 Cb -0.16 -4.25 0.04 0.00 0.01 0.00 0.00 72.50 68.14 3k5f s THR 26 CO 0.05 0.30 0.44 -0.76 -0.69 0.00 0.00 174.62 173.96 3k5f s LEU 27 N -0.05 0.31 -0.23 4.42 1.43 -0.49 -4.99 118.68 119.07 3k5f s LEU 27 Ca 0.48 0.39 -0.16 0.00 -1.03 0.00 0.00 54.13 53.80 3k5f s LEU 27 Cb -0.25 1.70 -0.04 0.00 0.03 0.00 0.00 46.19 47.64 3k5f s LEU 27 CO 0.31 -0.46 0.43 0.20 0.23 0.00 0.00 176.35 177.06 3k5f s ASN 28 N -1.08 6.42 -0.18 2.29 0.01 -1.26 -0.94 114.94 120.19 3k5f s ASN 28 Ca -0.11 0.49 -0.02 0.00 -0.71 0.00 0.00 52.86 52.52 3k5f s ASN 28 Cb -0.03 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.37 3k5f s ASN 28 CO 0.06 -0.16 -0.11 -0.63 -1.51 0.00 0.00 177.10 174.75 3k5f s ILE 29 N 1.71 3.00 0.20 0.60 -1.09 0.16 -0.59 121.20 125.19 3k5f s ILE 29 Ca 0.19 -0.64 -0.30 0.00 -2.23 0.00 0.00 60.65 57.67 3k5f s ILE 29 Cb -0.15 -2.31 -0.09 0.00 -1.58 0.00 0.00 42.46 38.33 3k5f s ILE 29 CO 0.09 0.48 1.40 -0.22 -1.23 0.00 0.00 174.94 175.46 3k5f s LEU 30 N 1.04 4.39 -0.42 2.97 0.20 -0.57 -0.01 118.68 126.27 3k5f s LEU 30 Ca -0.00 2.51 -0.25 0.00 0.69 0.00 0.00 54.13 57.07 3k5f s LEU 30 Cb -0.15 -3.61 0.02 0.00 -0.43 0.00 0.00 46.19 42.03 3k5f s LEU 30 CO -0.02 -0.64 0.91 -0.69 -0.29 0.00 0.00 176.35 175.62 3k5f s VAL 31 N 0.31 4.53 -0.32 1.68 1.01 0.45 0.14 120.40 128.20 3k5f s VAL 31 Ca 0.60 0.90 0.02 0.00 0.00 0.00 0.00 61.98 63.50 3k5f s VAL 31 Cb -0.39 -4.38 0.09 0.00 0.00 0.00 0.00 36.38 31.70 3k5f s VAL 31 CO 0.38 -0.71 0.05 -0.62 0.00 0.00 0.00 175.10 174.20 3k5f s ASP 32 N 2.11 4.48 0.00 3.32 2.15 -0.50 -4.01 116.67 124.22 3k5f s ASP 32 Ca 0.37 -1.90 0.30 0.00 0.43 0.00 0.00 52.55 51.75 3k5f s ASP 32 Cb -0.11 -1.38 1.70 0.00 -0.30 0.00 0.00 42.92 42.83 3k5f s ASP 32 CO 0.23 -0.37 2.10 0.35 -0.17 0.00 0.00 175.17 177.31 3k5f n THR 33 N 4.46 0.02 1.31 1.71 -2.24 -1.26 -0.66 114.28 117.61 3k5f n THR 33 Ca 0.00 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.91 3k5f n THR 33 Cb 0.42 -0.53 0.42 0.00 -2.10 0.00 0.00 70.33 68.54 3k5f n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k5f n GLY 34 N 0.99 0.28 3.36 3.38 0.00 -1.26 -4.15 105.19 107.79 3k5f n GLY 34 Ca 0.20 -0.48 -0.16 0.00 0.00 0.00 0.00 46.02 45.57 3k5f n GLY 34 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k5f s SER 35 N -1.85 1.14 -0.01 1.61 1.04 -1.20 -4.96 113.70 109.46 3k5f s SER 35 Ca 0.35 -1.58 0.01 0.00 0.48 0.00 0.00 55.95 55.21 3k5f s SER 35 Cb 0.20 0.57 0.02 0.00 0.10 0.00 0.00 66.02 66.91 3k5f s SER 35 CO 0.31 -1.12 0.75 -1.20 0.98 0.00 0.00 173.24 172.96 3k5f n SER 36 N -1.29 0.85 -4.71 7.02 7.64 -1.26 0.24 113.62 122.11 3k5f n SER 36 Ca 0.04 -1.54 -0.35 0.00 1.01 0.00 0.00 58.87 58.02 3k5f n SER 36 Cb 0.62 -0.04 -0.09 0.00 -1.01 0.00 0.00 64.21 63.70 3k5f n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3k5f s ASN 37 N -0.59 5.52 -0.30 6.43 -0.87 -1.26 -4.52 114.94 119.35 3k5f s ASN 37 Ca 0.02 0.19 -0.12 0.00 -1.57 0.00 0.00 52.86 51.37 3k5f s ASN 37 Cb 0.01 -1.69 -0.04 0.00 -0.02 0.00 0.00 41.25 39.52 3k5f s ASN 37 CO 0.00 0.34 0.23 0.12 -2.57 0.00 0.00 177.10 175.22 3k5f s PHE 38 N -0.65 3.22 0.00 2.20 5.99 -1.26 -1.33 117.98 126.16 3k5f s PHE 38 Ca 0.11 0.02 -0.02 0.00 0.00 0.00 0.00 56.93 57.04 3k5f s PHE 38 Cb -0.12 -2.44 -0.01 0.00 0.00 0.00 0.00 43.02 40.45 3k5f s PHE 38 CO 0.02 -0.25 0.04 0.00 -0.00 0.00 0.00 175.22 175.04 3k5f s ALA 39 N 1.79 -0.08 0.01 11.12 0.00 -0.70 -1.26 121.76 132.64 3k5f s ALA 39 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.83 3k5f s ALA 39 Cb -0.16 0.05 -0.01 0.00 0.00 0.00 0.00 23.12 22.99 3k5f s ALA 39 CO 0.11 -0.12 -0.02 0.14 0.00 0.00 0.00 175.76 175.86 3k5f s VAL 40 N -0.90 0.08 0.25 0.00 -7.23 -0.49 -0.49 120.40 111.62 3k5f s VAL 40 Ca -0.10 -0.53 -0.31 0.00 -1.81 0.00 0.00 61.98 59.23 3k5f s VAL 40 Cb -0.06 -0.17 -0.12 0.00 0.56 0.00 0.00 36.38 36.59 3k5f s VAL 40 CO -0.00 -0.28 1.56 0.61 -0.31 0.00 0.00 175.10 176.68 3k5f n GLY 41 N 2.22 1.19 0.24 2.32 0.00 0.08 -0.90 105.19 110.35 3k5f n GLY 41 Ca -0.19 0.51 0.04 0.00 0.00 0.00 0.00 46.02 46.39 3k5f n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5f n ALA 42 N 2.46 2.04 -3.41 4.61 0.00 -0.54 -0.07 120.51 125.61 3k5f n ALA 42 Ca 0.11 -1.67 -0.16 0.00 0.00 0.00 0.00 53.44 51.73 3k5f n ALA 42 Cb 0.34 -0.38 -0.06 0.00 0.00 0.00 0.00 19.45 19.35 3k5f n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k5f s ALA 43 N -1.31 -1.47 0.42 0.00 0.00 -1.22 -4.79 121.76 113.39 3k5f s ALA 43 Ca 0.14 0.92 -0.23 0.00 0.00 0.00 0.00 51.96 52.79 3k5f s ALA 43 Cb 0.12 0.15 -0.12 0.00 0.00 0.00 0.00 23.12 23.27 3k5f s ALA 43 CO 0.01 -0.40 0.64 -2.30 0.00 0.00 0.00 175.76 173.72 3k5f n PRO 44 N 0.80 0.71 -3.63 0.00 -0.02 -1.26 -4.96 135.00 126.63 3k5f n PRO 44 Ca -0.19 0.26 -0.11 0.00 -2.02 0.00 0.00 63.50 61.43 3k5f n PRO 44 Cb 0.58 -1.62 -0.07 0.00 -0.02 0.00 0.00 33.50 32.37 3k5f n PRO 44 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3k5f s HIS 45 N -1.43 -0.78 0.58 6.00 2.46 -1.26 -5.03 115.29 115.83 3k5f s HIS 45 Ca 0.64 1.80 0.34 0.00 0.47 0.00 0.00 55.06 58.31 3k5f s HIS 45 Cb -0.59 0.35 1.31 0.00 -0.13 0.00 0.00 32.58 33.52 3k5f s HIS 45 CO 0.57 -0.38 1.56 -1.35 -2.47 0.00 0.00 174.74 172.68 3k5f h PRO 46 N 5.26 0.00 -0.02 2.88 0.11 -2.01 0.75 132.00 138.97 3k5f h PRO 46 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 3k5f h PRO 46 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 3k5f h PRO 46 CO 0.09 0.00 0.00 1.19 -0.21 0.00 0.00 178.00 179.07 3k5f n PHE 47 N -3.63 0.01 -3.30 0.65 0.99 -1.26 -4.97 117.46 105.95 3k5f n PHE 47 Ca 0.25 -0.01 -0.40 0.00 -0.00 0.00 0.00 57.45 57.30 3k5f n PHE 47 Cb 1.42 -0.00 -0.08 0.00 -1.00 0.00 0.00 39.48 39.82 3k5f n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3k5f s LEU 48 N -0.82 4.05 0.17 4.37 1.43 0.26 -4.56 118.68 123.57 3k5f s LEU 48 Ca 0.12 0.43 -0.05 0.00 -1.03 0.00 0.00 54.13 53.59 3k5f s LEU 48 Cb 0.08 -2.56 0.04 0.00 0.03 0.00 0.00 46.19 43.78 3k5f s LEU 48 CO 0.12 -0.24 1.45 0.45 0.23 0.00 0.00 176.35 178.37 3k5f h HIS 49 N 8.06 0.78 -3.49 0.29 3.86 -1.92 -3.43 115.15 119.29 3k5f h HIS 49 Ca -0.30 -0.30 -0.04 0.00 -1.16 0.00 0.00 60.37 58.57 3k5f h HIS 49 Cb 1.15 -0.14 -0.07 0.00 1.06 0.00 0.00 27.41 29.41 3k5f h HIS 49 CO 0.75 1.06 -0.01 -0.98 0.86 0.00 0.00 177.93 179.61 3k5f s ARG 50 N -3.92 1.69 0.23 2.45 1.70 -1.26 -5.14 118.95 114.70 3k5f s ARG 50 Ca -0.08 -1.25 -0.16 0.00 -0.47 0.00 0.00 55.73 53.76 3k5f s ARG 50 Cb 0.11 0.51 0.01 0.00 -0.57 0.00 0.00 34.95 35.01 3k5f s ARG 50 CO 0.86 -0.73 0.55 1.52 -1.08 0.00 0.00 175.30 176.42 3k5f s TYR 51 N -3.77 0.04 -0.07 5.89 -0.85 -1.26 -4.89 117.35 112.45 3k5f s TYR 51 Ca 0.20 -0.42 -0.30 0.00 -0.52 0.00 0.00 57.07 56.03 3k5f s TYR 51 Cb -0.02 0.39 -0.04 0.00 0.38 0.00 0.00 41.96 42.67 3k5f s TYR 51 CO 0.10 -1.01 1.32 -0.47 -1.52 0.00 0.00 175.55 173.97 3k5f s TYR 52 N -3.94 2.88 -0.54 -3.49 5.04 0.90 -4.94 117.35 113.26 3k5f s TYR 52 Ca 0.14 0.94 -0.05 0.00 -2.44 0.00 0.00 57.07 55.66 3k5f s TYR 52 Cb -0.02 -3.57 0.14 0.00 0.35 0.00 0.00 41.96 38.86 3k5f s TYR 52 CO 0.04 -2.02 0.37 -0.65 -1.34 0.00 0.00 175.55 171.95 3k5f s GLN 53 N 2.79 2.45 0.30 4.97 -0.21 -1.26 -4.33 119.66 124.37 3k5f s GLN 53 Ca 0.60 -2.12 0.02 0.00 0.02 0.00 0.00 55.36 53.88 3k5f s GLN 53 Cb -0.27 -3.79 0.57 0.00 1.00 0.00 0.00 33.01 30.53 3k5f s GLN 53 CO 0.22 -1.16 1.89 0.00 -2.12 0.00 0.00 175.29 174.12 3k5f h ARG 54 N 7.76 0.95 -0.30 2.91 3.08 -1.94 -2.22 114.38 124.62 3k5f h ARG 54 Ca -0.09 -0.06 0.04 0.00 0.07 0.00 0.00 59.98 59.94 3k5f h ARG 54 Cb 1.02 -0.21 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 3k5f h ARG 54 CO 0.75 0.63 0.20 -0.56 -1.07 0.00 0.00 179.97 179.92 3k5f h GLN 55 N 0.98 0.24 -0.00 0.04 -0.00 -2.01 -1.67 115.11 112.69 3k5f h GLN 55 Ca 0.43 -0.01 0.00 0.00 -0.00 0.00 0.00 58.65 59.06 3k5f h GLN 55 Cb 0.35 -0.05 0.00 0.00 -0.00 0.00 0.00 27.48 27.77 3k5f h GLN 55 CO -0.18 0.16 -0.02 1.28 -0.00 0.00 0.00 178.83 180.07 3k5f n LEU 56 N -4.49 0.22 -4.49 0.06 4.77 -0.83 -4.77 117.00 107.46 3k5f n LEU 56 Ca 0.03 0.02 -0.35 0.00 -0.03 0.00 0.00 56.01 55.68 3k5f n LEU 56 Cb 0.19 -0.09 -0.12 0.00 -2.33 0.00 0.00 43.42 41.07 3k5f n LEU 56 CO 0.35 0.04 -0.31 -0.55 -1.33 0.00 0.00 177.39 175.58 3k5f s SER 57 N -2.20 5.03 0.31 -1.43 0.15 -0.63 -4.17 113.70 110.77 3k5f s SER 57 Ca 0.40 -0.13 0.24 0.00 0.70 0.00 0.00 55.95 57.16 3k5f s SER 57 Cb 0.21 -1.86 0.49 0.00 -1.71 0.00 0.00 66.02 63.15 3k5f s SER 57 CO 0.40 0.09 1.60 0.77 1.20 0.00 0.00 173.24 177.30 3k5f h SER 58 N 7.31 0.00 -0.13 5.45 4.64 -1.53 -3.18 113.55 126.11 3k5f h SER 58 Ca -0.35 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3k5f h SER 58 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3k5f h SER 58 CO 0.63 0.01 0.00 0.35 -0.87 0.00 0.00 176.83 176.94 3k5f n THR 59 N -2.67 0.15 -2.18 2.95 -2.24 -1.26 -4.95 114.28 104.07 3k5f n THR 59 Ca 0.04 -0.47 -0.40 0.00 -2.27 0.00 0.00 64.05 60.95 3k5f n THR 59 Cb 0.49 0.96 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 3k5f n THR 59 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3k5f s TYR 60 N -1.85 3.10 -0.09 4.78 5.04 -1.20 -4.50 117.35 122.62 3k5f s TYR 60 Ca 0.34 1.48 -0.02 0.00 -2.44 0.00 0.00 57.07 56.42 3k5f s TYR 60 Cb 0.20 -3.58 0.04 0.00 0.35 0.00 0.00 41.96 38.97 3k5f s TYR 60 CO 0.31 -1.62 0.04 1.03 -1.34 0.00 0.00 175.55 173.96 3k5f s ARG 61 N -1.86 0.34 0.01 4.97 0.52 -0.25 -5.00 118.95 117.67 3k5f s ARG 61 Ca 0.50 0.08 -0.30 0.00 -0.52 0.00 0.00 55.73 55.50 3k5f s ARG 61 Cb -0.37 -1.13 -0.04 0.00 0.52 0.00 0.00 34.95 33.93 3k5f s ARG 61 CO 0.49 -0.41 1.05 0.34 0.02 0.00 0.00 175.30 176.79 3k5f s ASP 62 N 2.04 7.27 0.00 0.23 2.15 -1.26 -0.69 116.67 126.40 3k5f s ASP 62 Ca 0.04 1.76 0.28 0.00 0.43 0.00 0.00 52.55 55.05 3k5f s ASP 62 Cb -0.13 -2.57 1.05 0.00 -0.30 0.00 0.00 42.92 40.96 3k5f s ASP 62 CO -0.06 -0.34 1.74 0.18 -0.17 0.00 0.00 175.17 176.52 3k5f n LEU 63 N 4.03 1.02 -3.96 -1.34 4.77 -0.51 -4.94 117.00 116.07 3k5f n LEU 63 Ca 0.07 -0.28 -0.28 0.00 -0.03 0.00 0.00 56.01 55.49 3k5f n LEU 63 Cb 0.49 -0.08 -0.00 0.00 -2.33 0.00 0.00 43.42 41.50 3k5f n LEU 63 CO 0.53 0.18 -0.10 0.54 -1.33 0.00 0.00 177.39 177.21 3k5f n ARG 64 N -0.42 -3.98 -3.79 3.23 1.74 -1.25 -4.97 116.66 107.22 3k5f n ARG 64 Ca 0.16 0.47 -0.13 0.00 -0.77 0.00 0.00 57.85 57.59 3k5f n ARG 64 Cb 0.32 -4.95 -0.12 0.00 -1.02 0.00 0.00 32.46 26.69 3k5f n ARG 64 CO 0.00 0.00 0.00 0.21 -1.52 0.00 0.00 177.63 176.32 3k5f s LYS 65 N -6.54 0.27 0.59 5.56 2.20 -1.26 -5.04 119.74 115.51 3k5f s LYS 65 Ca 0.28 0.34 -0.07 0.00 -0.36 0.00 0.00 55.97 56.16 3k5f s LYS 65 Cb -0.15 0.12 -0.00 0.00 -1.51 0.00 0.00 37.83 36.29 3k5f s LYS 65 CO 0.87 -0.04 0.91 0.20 -0.36 0.00 0.00 175.35 176.94 3k5f s GLY 66 N 0.20 1.59 -0.14 5.54 0.00 -1.26 -0.64 107.32 112.61 3k5f s GLY 66 Ca -0.01 -0.57 -0.14 0.00 0.00 0.00 0.00 44.72 44.00 3k5f s GLY 66 CO -0.00 -0.30 0.39 0.54 0.00 0.00 0.00 173.10 173.72 3k5f s VAL 67 N -3.01 0.00 -0.03 1.40 0.11 -0.01 -4.77 120.40 114.10 3k5f s VAL 67 Ca 0.53 -0.02 0.03 0.00 -2.93 0.00 0.00 61.98 59.59 3k5f s VAL 67 Cb -0.11 -0.55 0.00 0.00 -1.53 0.00 0.00 36.38 34.20 3k5f s VAL 67 CO 0.47 -0.01 -0.10 -0.47 -3.33 0.00 0.00 175.10 171.65 3k5f s TYR 68 N 0.13 1.05 -0.05 1.54 5.04 -1.26 -0.34 117.35 123.45 3k5f s TYR 68 Ca -0.01 -0.27 -0.02 0.00 -2.44 0.00 0.00 57.07 54.34 3k5f s TYR 68 Cb -0.03 -0.74 0.03 0.00 0.35 0.00 0.00 41.96 41.57 3k5f s TYR 68 CO 0.01 -0.11 0.03 0.08 -1.34 0.00 0.00 175.55 174.22 3k5f s VAL 69 N 0.17 0.09 -0.10 3.14 1.01 -0.33 -4.83 120.40 119.56 3k5f s VAL 69 Ca -0.03 0.29 -0.03 0.00 0.00 0.00 0.00 61.98 62.21 3k5f s VAL 69 Cb -0.09 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 35.96 3k5f s VAL 69 CO 0.01 0.21 0.01 -2.16 0.00 0.00 0.00 175.10 173.17 3k5f s PRO 70 N 2.01 3.16 0.45 2.72 0.04 -1.26 -1.77 135.00 140.35 3k5f s PRO 70 Ca 0.04 -0.39 0.05 0.00 0.04 0.00 0.00 61.00 60.74 3k5f s PRO 70 Cb -0.12 -2.87 -0.04 0.00 0.04 0.00 0.00 34.50 31.51 3k5f s PRO 70 CO -0.04 0.63 0.12 0.71 0.04 0.00 0.00 177.00 178.47 3k5f s TYR 71 N -0.68 2.28 0.35 0.56 2.02 -0.09 -4.99 117.35 116.80 3k5f s TYR 71 Ca 0.11 -0.73 0.13 0.00 -0.37 0.00 0.00 57.07 56.21 3k5f s TYR 71 Cb -0.12 -1.82 0.96 0.00 -0.40 0.00 0.00 41.96 40.58 3k5f s TYR 71 CO 0.02 0.19 1.75 1.15 -1.57 0.00 0.00 175.55 177.09 3k5f h THR 72 N 1.42 0.55 -3.40 -0.71 2.02 -2.00 -3.36 112.91 107.44 3k5f h THR 72 Ca -0.43 -0.18 -0.34 0.00 0.77 0.00 0.00 66.41 66.23 3k5f h THR 72 Cb 1.27 -0.02 -0.37 0.00 -1.74 0.00 0.00 68.15 67.29 3k5f h THR 72 CO 0.72 0.10 -0.74 -1.58 0.37 0.00 0.00 175.52 174.39 3k5f s GLN 73 N -5.67 -0.06 0.00 6.66 0.74 -1.26 -5.10 119.66 114.97 3k5f s GLN 73 Ca -0.10 0.30 0.00 0.00 0.05 0.00 0.00 55.36 55.61 3k5f s GLN 73 Cb 0.26 -0.40 0.00 0.00 1.10 0.00 0.00 33.01 33.97 3k5f s GLN 73 CO 0.80 -0.26 0.00 0.41 -0.55 0.00 0.00 175.29 175.69 3k5f n GLY 74 N 4.83 0.80 3.48 2.59 0.00 -1.25 -4.87 105.19 110.77 3k5f n GLY 74 Ca -0.14 -1.76 -0.10 0.00 0.00 0.00 0.00 46.02 44.03 3k5f n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5f s LYS 75 N -3.08 0.98 0.24 1.61 -2.85 -0.85 -0.91 119.74 114.88 3k5f s LYS 75 Ca 0.00 -0.34 -0.15 0.00 -1.00 0.00 0.00 55.97 54.48 3k5f s LYS 75 Cb 0.00 0.45 0.01 0.00 -2.06 0.00 0.00 37.83 36.23 3k5f s LYS 75 CO 0.00 -0.42 0.54 1.67 0.10 0.00 0.00 175.35 177.23 3k5f s TRP 76 N -3.25 0.16 0.04 1.78 1.48 -0.73 -0.69 118.94 117.73 3k5f s TRP 76 Ca 0.03 -0.54 -0.06 0.00 -1.06 0.00 0.00 56.10 54.48 3k5f s TRP 76 Cb -0.01 0.34 -0.01 0.00 -1.16 0.00 0.00 33.47 32.63 3k5f s TRP 76 CO -0.10 -1.03 0.10 -1.83 -4.06 0.00 0.00 176.95 170.03 3k5f s GLU 77 N -3.97 0.61 0.00 3.25 -1.05 -0.33 -1.18 118.70 116.03 3k5f s GLU 77 Ca 0.17 -0.77 0.00 0.00 -0.15 0.00 0.00 54.97 54.22 3k5f s GLU 77 Cb -0.02 0.24 0.00 0.00 -0.44 0.00 0.00 34.13 33.91 3k5f s GLU 77 CO 0.06 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 176.53 3k5f n GLY 78 N 0.71 1.40 3.43 -3.83 0.00 0.54 -1.73 105.19 105.69 3k5f n GLY 78 Ca -0.19 -0.81 -0.34 0.00 0.00 0.00 0.00 46.02 44.69 3k5f n GLY 78 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3k5f s GLU 79 N -0.78 3.54 0.46 1.61 2.56 -0.68 -0.83 118.70 124.58 3k5f s GLU 79 Ca 0.00 -0.58 -0.21 0.00 0.00 0.00 0.00 54.97 54.18 3k5f s GLU 79 Cb 0.00 -2.86 -0.09 0.00 2.00 0.00 0.00 34.13 33.18 3k5f s GLU 79 CO 0.00 0.14 1.02 -0.51 -0.56 0.00 0.00 175.26 175.35 3k5f s LEU 80 N 0.60 3.89 0.04 2.70 1.43 0.18 -1.32 118.68 126.20 3k5f s LEU 80 Ca -0.04 1.88 -0.28 0.00 -1.03 0.00 0.00 54.13 54.66 3k5f s LEU 80 Cb -0.15 -4.53 0.10 0.00 0.03 0.00 0.00 46.19 41.65 3k5f s LEU 80 CO 0.03 -0.65 1.21 -0.83 0.23 0.00 0.00 176.35 176.33 3k5f s GLY 81 N -2.00 -0.22 0.20 -3.19 0.00 -0.82 -1.42 107.32 99.86 3k5f s GLY 81 Ca 0.65 0.27 0.09 0.00 0.00 0.00 0.00 44.72 45.72 3k5f s GLY 81 CO 0.19 2.10 -0.17 -0.51 0.00 0.00 0.00 173.10 174.71 3k5f s THR 82 N -2.36 1.87 0.14 0.90 -4.23 0.13 0.30 115.64 112.38 3k5f s THR 82 Ca 0.20 -2.12 -0.25 0.00 -1.18 0.00 0.00 61.69 58.34 3k5f s THR 82 Cb 0.01 -1.99 0.07 0.00 1.34 0.00 0.00 72.50 71.93 3k5f s THR 82 CO -0.01 -0.46 1.01 -0.62 -0.54 0.00 0.00 174.62 174.01 3k5f s ASP 83 N -3.07 -0.13 0.08 3.99 -1.08 -1.04 -1.09 116.67 114.32 3k5f s ASP 83 Ca 0.21 -0.42 -0.27 0.00 -0.52 0.00 0.00 52.55 51.54 3k5f s ASP 83 Cb -0.03 0.45 -0.06 0.00 -1.46 0.00 0.00 42.92 41.82 3k5f s ASP 83 CO 0.08 -0.85 0.84 -0.76 0.52 0.00 0.00 175.17 175.00 3k5f s LEU 84 N -3.02 4.48 0.01 -1.34 1.43 -1.26 -1.74 118.68 117.24 3k5f s LEU 84 Ca 0.14 1.60 0.05 0.00 -1.03 0.00 0.00 54.13 54.89 3k5f s LEU 84 Cb -0.01 -3.38 -0.02 0.00 0.03 0.00 0.00 46.19 42.82 3k5f s LEU 84 CO 0.02 0.00 -0.15 -0.69 0.23 0.00 0.00 176.35 175.76 3k5f s VAL 85 N -0.13 1.18 0.12 -1.59 1.01 0.76 -1.03 120.40 120.71 3k5f s VAL 85 Ca 0.41 -0.81 -0.00 0.00 0.00 0.00 0.00 61.98 61.58 3k5f s VAL 85 Cb -0.22 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 3k5f s VAL 85 CO 0.26 0.20 0.01 -0.44 0.00 0.00 0.00 175.10 175.13 3k5f s SER 86 N -0.71 0.67 -0.36 3.32 0.01 -0.16 -2.02 113.70 114.45 3k5f s SER 86 Ca 0.04 -1.13 0.01 0.00 1.31 0.00 0.00 55.95 56.18 3k5f s SER 86 Cb -0.07 0.21 0.11 0.00 0.21 0.00 0.00 66.02 66.48 3k5f s SER 86 CO 0.00 -0.63 0.14 -0.63 0.41 0.00 0.00 173.24 172.53 3k5f s ILE 87 N -3.88 1.29 0.22 1.44 1.01 -1.26 -1.17 121.20 118.85 3k5f s ILE 87 Ca 0.19 -1.96 -0.19 0.00 0.00 0.00 0.00 60.65 58.69 3k5f s ILE 87 Cb 0.07 -1.94 0.21 0.00 0.01 0.00 0.00 42.46 40.80 3k5f s ILE 87 CO -0.01 -0.74 1.56 -0.65 0.00 0.00 0.00 174.94 175.10 3k5f h PRO 88 N 7.53 -0.04 -1.61 2.79 0.11 -1.89 -0.49 132.00 138.39 3k5f h PRO 88 Ca -0.08 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.32 3k5f h PRO 88 Cb 0.98 0.01 -0.27 0.00 0.11 0.00 0.00 31.00 31.83 3k5f h PRO 88 CO 0.49 -0.03 0.95 0.72 -0.21 0.00 0.00 178.00 179.92 3k5f n HIS 89 N -5.46 2.98 -2.11 0.65 8.25 -1.26 -4.89 115.22 113.38 3k5f n HIS 89 Ca 0.08 -2.57 0.00 0.00 -0.26 0.00 0.00 57.72 54.98 3k5f n HIS 89 Cb 0.39 -1.29 0.00 0.00 1.12 0.00 0.00 29.99 30.20 3k5f n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k5f n GLY 90 N -0.60 4.99 3.73 -1.41 0.00 -0.19 -4.29 105.19 107.42 3k5f n GLY 90 Ca 0.57 -1.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.07 3k5f n GLY 90 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3k5f n PRO 91 N 0.00 2.29 -2.07 1.61 -0.02 -1.26 -4.85 135.00 130.70 3k5f n PRO 91 Ca 0.00 0.81 -0.42 0.00 -2.02 0.00 0.00 63.50 61.86 3k5f n PRO 91 Cb 0.00 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 30.98 3k5f n PRO 91 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3k5f n ASN 92 N 0.40 4.39 -4.07 2.55 5.15 -1.26 -4.59 115.26 117.83 3k5f n ASN 92 Ca 0.04 -2.92 -0.10 0.00 -0.60 0.00 0.00 54.58 51.00 3k5f n ASN 92 Cb 0.38 -1.63 -0.07 0.00 -0.53 0.00 0.00 39.78 37.93 3k5f n ASN 92 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 3k5f s VAL 93 N 2.67 0.01 -0.01 3.44 -7.23 -1.26 -5.16 120.40 112.85 3k5f s VAL 93 Ca 0.46 -1.63 0.00 0.00 -1.81 0.00 0.00 61.98 59.01 3k5f s VAL 93 Cb 0.10 -2.28 0.01 0.00 0.56 0.00 0.00 36.38 34.78 3k5f s VAL 93 CO -0.04 -0.04 -0.01 -0.89 -0.31 0.00 0.00 175.10 173.82 3k5f s THR 94 N -4.07 0.13 0.04 5.32 2.01 -1.26 -4.46 115.64 113.36 3k5f s THR 94 Ca 0.28 0.01 -0.03 0.00 0.31 0.00 0.00 61.69 62.26 3k5f s THR 94 Cb 0.03 -0.17 -0.02 0.00 0.01 0.00 0.00 72.50 72.34 3k5f s THR 94 CO 0.09 0.08 0.03 0.68 -0.69 0.00 0.00 174.62 174.82 3k5f s VAL 95 N 0.45 0.17 -0.20 3.82 -7.23 -0.86 -4.95 120.40 111.60 3k5f s VAL 95 Ca -0.04 -1.36 -0.18 0.00 -1.81 0.00 0.00 61.98 58.59 3k5f s VAL 95 Cb -0.07 -1.08 -0.03 0.00 0.56 0.00 0.00 36.38 35.76 3k5f s VAL 95 CO -0.01 -0.75 0.48 -0.60 -0.31 0.00 0.00 175.10 173.91 3k5f s ARG 96 N -3.06 4.18 0.16 4.82 3.52 -1.26 -0.17 118.95 127.14 3k5f s ARG 96 Ca -0.01 0.34 0.01 0.00 -0.13 0.00 0.00 55.73 55.94 3k5f s ARG 96 Cb 0.02 -3.56 -0.04 0.00 -1.56 0.00 0.00 34.95 29.81 3k5f s ARG 96 CO -0.07 -0.11 0.01 0.00 -0.81 0.00 0.00 175.30 174.32 3k5f s ALA 97 N 1.53 1.21 0.39 6.12 0.00 -0.71 -4.93 121.76 125.38 3k5f s ALA 97 Ca 0.22 -1.55 -0.25 0.00 0.00 0.00 0.00 51.96 50.38 3k5f s ALA 97 Cb -0.15 0.61 -0.09 0.00 0.00 0.00 0.00 23.12 23.49 3k5f s ALA 97 CO 0.09 -0.36 1.13 -0.80 0.00 0.00 0.00 175.76 175.82 3k5f s ASN 98 N -3.14 6.62 -0.04 0.00 0.01 -1.26 -2.50 114.94 114.63 3k5f s ASN 98 Ca 0.23 2.26 -0.02 0.00 -0.71 0.00 0.00 52.86 54.63 3k5f s ASN 98 Cb 0.06 -2.61 0.03 0.00 0.41 0.00 0.00 41.25 39.15 3k5f s ASN 98 CO 0.03 -0.60 0.09 -0.63 -1.51 0.00 0.00 177.10 174.48 3k5f s ILE 99 N -1.46 -0.09 -0.35 0.60 1.01 0.15 -4.69 121.20 116.36 3k5f s ILE 99 Ca 0.57 0.25 -0.17 0.00 0.00 0.00 0.00 60.65 61.30 3k5f s ILE 99 Cb -0.28 -0.16 -0.00 0.00 0.01 0.00 0.00 42.46 42.02 3k5f s ILE 99 CO 0.36 0.10 0.47 0.00 0.00 0.00 0.00 174.94 175.87 3k5f s ALA 100 N 1.40 3.48 -0.59 9.38 0.00 -0.39 -1.95 121.76 133.09 3k5f s ALA 100 Ca -0.06 -1.10 -0.25 0.00 0.00 0.00 0.00 51.96 50.55 3k5f s ALA 100 Cb -0.12 -2.97 0.04 0.00 0.00 0.00 0.00 23.12 20.07 3k5f s ALA 100 CO -0.04 -1.21 1.05 0.00 0.00 0.00 0.00 175.76 175.56 3k5f s ALA 101 N 2.28 3.06 -0.28 0.00 0.00 -0.43 -1.39 121.76 125.00 3k5f s ALA 101 Ca 0.16 -1.21 -0.29 0.00 0.00 0.00 0.00 51.96 50.63 3k5f s ALA 101 Cb -0.16 -3.89 -0.02 0.00 0.00 0.00 0.00 23.12 19.05 3k5f s ALA 101 CO 0.13 -2.61 1.67 0.42 0.00 0.00 0.00 175.76 175.38 3k5f s ILE 102 N 4.44 3.62 -0.11 0.00 1.01 -0.08 -1.68 121.20 128.40 3k5f s ILE 102 Ca 0.33 0.66 0.20 0.00 0.00 0.00 0.00 60.65 61.85 3k5f s ILE 102 Cb -0.11 -3.73 -0.28 0.00 0.01 0.00 0.00 42.46 38.35 3k5f s ILE 102 CO 0.19 -0.39 0.38 0.35 0.00 0.00 0.00 174.94 175.48 3k5f n THR 103 N 6.92 0.63 -3.78 2.92 -2.24 -0.71 -1.47 114.28 116.55 3k5f n THR 103 Ca 0.20 -0.65 -0.13 0.00 -2.27 0.00 0.00 64.05 61.21 3k5f n THR 103 Cb 0.46 -0.25 -0.09 0.00 -2.10 0.00 0.00 70.33 68.35 3k5f n THR 103 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3k5f s GLU 104 N -3.09 0.58 0.19 -0.78 2.02 -1.11 -4.86 118.70 111.65 3k5f s GLU 104 Ca -0.08 -0.15 -0.17 0.00 0.02 0.00 0.00 54.97 54.59 3k5f s GLU 104 Cb 0.10 0.26 0.03 0.00 0.10 0.00 0.00 34.13 34.62 3k5f s GLU 104 CO 0.87 -0.15 0.52 -1.54 0.02 0.00 0.00 175.26 174.98 3k5f s SER 105 N -1.12 -0.26 -0.10 -0.19 1.04 -1.26 -1.18 113.70 110.62 3k5f s SER 105 Ca -0.12 -0.46 -0.04 0.00 0.48 0.00 0.00 55.95 55.81 3k5f s SER 105 Cb -0.05 0.57 0.05 0.00 0.10 0.00 0.00 66.02 66.69 3k5f s SER 105 CO 0.03 -1.04 0.20 -0.62 0.98 0.00 0.00 173.24 172.80 3k5f s ASP 106 N -2.87 0.42 -1.23 7.02 3.68 0.14 -4.87 116.67 118.97 3k5f s ASP 106 Ca 0.09 0.44 -0.03 0.00 2.13 0.00 0.00 52.55 55.18 3k5f s ASP 106 Cb -0.01 0.44 0.02 0.00 -1.45 0.00 0.00 42.92 41.92 3k5f s ASP 106 CO -0.04 -0.23 0.22 0.29 0.13 0.00 0.00 175.17 175.55 3k5f n LYS 107 N 5.12 -2.89 0.00 4.34 5.02 -1.26 -2.01 118.16 126.48 3k5f n LYS 107 Ca -0.09 0.62 0.00 0.00 -2.02 0.00 0.00 58.31 56.82 3k5f n LYS 107 Cb 0.50 -5.29 0.00 0.00 -0.02 0.00 0.00 35.03 30.22 3k5f n LYS 107 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3k5f n PHE 108 N -3.73 0.00 -1.91 2.13 7.35 -1.26 -3.91 117.46 116.13 3k5f n PHE 108 Ca -0.11 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.17 3k5f n PHE 108 Cb 0.60 0.00 -0.02 0.00 0.35 0.00 0.00 39.48 40.40 3k5f n PHE 108 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 3k5f s PHE 109 N -0.96 2.95 -0.16 -5.13 0.40 -1.26 -4.99 117.98 108.82 3k5f s PHE 109 Ca 0.00 0.81 -0.11 0.00 -0.60 0.00 0.00 56.93 57.02 3k5f s PHE 109 Cb 0.00 -3.94 -0.05 0.00 0.51 0.00 0.00 43.02 39.54 3k5f s PHE 109 CO 0.00 -3.24 0.21 0.42 0.70 0.00 0.00 175.22 173.31 3k5f s ILE 110 N 0.37 5.36 -0.20 0.64 1.01 -1.26 -4.96 121.20 122.16 3k5f s ILE 110 Ca 0.64 0.37 -0.28 0.00 0.00 0.00 0.00 60.65 61.38 3k5f s ILE 110 Cb -0.45 -3.54 -0.05 0.00 0.01 0.00 0.00 42.46 38.43 3k5f s ILE 110 CO 0.41 0.45 2.12 0.21 0.00 0.00 0.00 174.94 178.13 3k5f s ASN 111 N 0.16 5.65 0.00 3.58 2.47 -1.26 -2.21 114.94 123.33 3k5f s ASN 111 Ca 0.13 1.91 0.00 0.00 0.42 0.00 0.00 52.86 55.33 3k5f s ASN 111 Cb -0.12 -2.52 0.00 0.00 -1.45 0.00 0.00 41.25 37.16 3k5f s ASN 111 CO 0.02 -1.80 0.00 0.61 -3.72 0.00 0.00 177.10 172.21 3k5f n GLY 112 N 5.53 0.75 0.08 1.21 0.00 -1.26 -4.98 105.19 106.53 3k5f n GLY 112 Ca 0.27 -0.69 -0.07 0.00 0.00 0.00 0.00 46.02 45.53 3k5f n GLY 112 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k5f n SER 113 N 1.54 0.82 0.00 1.61 3.41 -0.94 -4.98 113.62 115.08 3k5f n SER 113 Ca 0.00 0.39 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 3k5f n SER 113 Cb 0.43 0.04 0.00 0.00 -0.26 0.00 0.00 64.21 64.43 3k5f n SER 113 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 3k5f n ASN 114 N -3.00 0.00 -4.68 4.04 4.05 -1.26 -4.63 115.26 109.78 3k5f n ASN 114 Ca -0.16 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.56 3k5f n ASN 114 Cb 1.02 0.00 -0.08 0.00 1.23 0.00 0.00 39.78 41.94 3k5f n ASN 114 CO 0.00 0.00 0.00 -1.66 -3.05 0.00 0.00 177.26 172.55 3k5f s TRP 115 N -3.12 2.98 -0.01 1.20 1.48 -1.26 -4.57 118.94 115.64 3k5f s TRP 115 Ca 0.00 -0.02 0.02 0.00 -1.06 0.00 0.00 56.10 55.03 3k5f s TRP 115 Cb 0.00 -1.55 0.03 0.00 -1.16 0.00 0.00 33.47 30.79 3k5f s TRP 115 CO 0.00 0.47 0.97 0.39 -4.06 0.00 0.00 176.95 174.72 3k5f n GLU 116 N 0.69 2.59 -3.13 3.25 4.71 0.25 -4.90 120.64 124.09 3k5f n GLU 116 Ca -0.11 -1.51 -0.06 0.00 -0.01 0.00 0.00 57.16 55.46 3k5f n GLU 116 Cb 0.52 -1.00 0.02 0.00 -1.01 0.00 0.00 31.44 29.97 3k5f n GLU 116 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3k5f n GLY 117 N -0.54 1.18 2.97 0.62 0.00 -1.14 -0.74 105.19 107.53 3k5f n GLY 117 Ca 0.01 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.73 3k5f n GLY 117 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3k5f s ILE 118 N -2.30 0.01 -0.36 -0.61 2.07 0.35 -1.52 121.20 118.84 3k5f s ILE 118 Ca 0.13 -0.09 -0.01 0.00 -1.41 0.00 0.00 60.65 59.26 3k5f s ILE 118 Cb -0.04 -0.15 0.09 0.00 0.13 0.00 0.00 42.46 42.49 3k5f s ILE 118 CO 0.09 -0.05 0.11 -0.22 -1.91 0.00 0.00 174.94 172.96 3k5f s LEU 119 N -0.13 4.79 -0.26 8.50 2.96 0.12 -1.72 118.68 132.94 3k5f s LEU 119 Ca -0.02 -1.87 -0.29 0.00 -0.22 0.00 0.00 54.13 51.73 3k5f s LEU 119 Cb -0.02 -1.75 -0.00 0.00 0.50 0.00 0.00 46.19 44.92 3k5f s LEU 119 CO 0.00 -0.43 1.30 -0.83 -1.32 0.00 0.00 176.35 175.07 3k5f s GLY 120 N 1.46 1.45 0.00 7.98 0.00 -0.44 -1.40 107.32 116.37 3k5f s GLY 120 Ca 0.05 0.21 0.24 0.00 0.00 0.00 0.00 44.72 45.22 3k5f s GLY 120 CO -0.04 2.57 1.34 1.04 0.00 0.00 0.00 173.10 178.01 3k5f n LEU 121 N 7.36 3.10 0.00 0.66 4.77 0.17 -4.28 117.00 128.78 3k5f n LEU 121 Ca 0.15 -1.16 -0.10 0.00 -0.03 0.00 0.00 56.01 54.86 3k5f n LEU 121 Cb 0.46 -0.10 0.07 0.00 -2.33 0.00 0.00 43.42 41.52 3k5f n LEU 121 CO 0.61 0.58 0.29 0.00 -1.33 0.00 0.00 177.39 177.54 3k5f n ALA 122 N 1.34 -0.58 -2.04 -1.18 0.00 0.14 -4.95 120.51 113.24 3k5f n ALA 122 Ca 0.16 -0.59 -0.29 0.00 0.00 0.00 0.00 53.44 52.73 3k5f n ALA 122 Cb 0.59 -0.03 0.02 0.00 0.00 0.00 0.00 19.45 20.03 3k5f n ALA 122 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3k5f s TYR 123 N -1.96 3.45 0.48 0.00 1.51 -0.54 -4.64 117.35 115.65 3k5f s TYR 123 Ca 0.26 0.93 0.22 0.00 -1.01 0.00 0.00 57.07 57.47 3k5f s TYR 123 Cb -0.01 -2.68 1.26 0.00 -0.11 0.00 0.00 41.96 40.42 3k5f s TYR 123 CO 0.18 -0.71 1.93 0.00 -1.11 0.00 0.00 175.55 175.84 3k5f h ALA 124 N -0.19 2.41 -1.12 3.71 0.00 -1.87 -2.75 119.26 119.44 3k5f h ALA 124 Ca -0.45 -0.01 0.32 0.00 0.00 0.00 0.00 54.91 54.77 3k5f h ALA 124 Cb 1.22 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.91 3k5f h ALA 124 CO 0.62 -0.62 0.72 0.93 0.00 0.00 0.00 179.25 180.89 3k5f h GLU 125 N 0.20 0.29 -0.36 0.00 5.08 -1.86 -0.06 114.58 117.86 3k5f h GLU 125 Ca 0.36 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.71 3k5f h GLU 125 Cb 1.14 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.33 3k5f h GLU 125 CO -0.07 0.19 0.00 0.44 -1.00 0.00 0.00 179.01 178.57 3k5f n ILE 126 N -4.67 2.01 -2.67 3.13 -5.35 -1.04 -4.62 119.36 106.15 3k5f n ILE 126 Ca 0.29 -1.55 -0.33 0.00 -0.27 0.00 0.00 62.75 60.89 3k5f n ILE 126 Cb 1.05 -0.04 -0.05 0.00 -1.74 0.00 0.00 39.64 38.85 3k5f n ILE 126 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3k5f s ALA 127 N -2.30 2.99 0.07 -1.28 0.00 -0.04 -4.62 121.76 116.58 3k5f s ALA 127 Ca 0.41 0.43 0.04 0.00 0.00 0.00 0.00 51.96 52.84 3k5f s ALA 127 Cb 0.30 -3.18 -0.04 0.00 0.00 0.00 0.00 23.12 20.20 3k5f s ALA 127 CO 0.13 -0.06 0.01 1.03 0.00 0.00 0.00 175.76 176.86 3k5f s ARG 128 N -3.33 2.64 0.41 0.00 1.81 -1.26 -2.91 118.95 116.31 3k5f s ARG 128 Ca 0.63 -0.77 0.21 0.00 -1.72 0.00 0.00 55.73 54.08 3k5f s ARG 128 Cb -0.11 -2.59 0.80 0.00 -0.45 0.00 0.00 34.95 32.60 3k5f s ARG 128 CO 0.18 0.56 1.78 -1.00 -0.68 0.00 0.00 175.30 176.14 3k5f h PRO 129 N 3.63 0.00 -3.57 3.54 0.13 -1.88 -3.47 132.00 130.39 3k5f h PRO 129 Ca -0.48 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.51 3k5f h PRO 129 Cb 1.17 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.25 3k5f h PRO 129 CO 0.60 0.30 0.03 0.16 -0.23 0.00 0.00 178.00 178.86 3k5f s ASP 130 N -6.33 0.44 0.00 1.44 1.47 -1.15 -5.03 116.67 107.52 3k5f s ASP 130 Ca 0.00 -1.29 0.07 0.00 1.18 0.00 0.00 52.55 52.51 3k5f s ASP 130 Cb 0.11 0.75 0.40 0.00 -0.34 0.00 0.00 42.92 43.84 3k5f s ASP 130 CO 0.66 -1.47 0.89 -0.90 0.68 0.00 0.00 175.17 175.03 3k5f n ASP 131 N -1.35 0.00 0.08 2.11 5.68 -1.25 -2.25 116.55 119.56 3k5f n ASP 131 Ca -0.04 -0.85 0.12 0.00 -0.50 0.00 0.00 54.79 53.52 3k5f n ASP 131 Cb 0.61 0.00 0.20 0.00 -1.14 0.00 0.00 41.12 40.79 3k5f n ASP 131 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 3k5f h SER 132 N 0.00 0.00 -1.96 -1.12 4.64 -1.91 -3.42 113.55 109.78 3k5f h SER 132 Ca 0.00 -0.16 -0.62 0.00 -0.47 0.00 0.00 61.79 60.54 3k5f h SER 132 Cb 0.00 0.00 -0.13 0.00 -0.31 0.00 0.00 62.40 61.96 3k5f h SER 132 CO 0.00 0.08 1.07 -0.22 -0.87 0.00 0.00 176.83 176.89 3k5f s LEU 133 N -4.39 4.07 -0.01 5.97 2.96 -0.96 -4.98 118.68 121.35 3k5f s LEU 133 Ca 0.07 -1.40 -0.36 0.00 -0.22 0.00 0.00 54.13 52.22 3k5f s LEU 133 Cb 0.13 -2.49 -0.14 0.00 0.50 0.00 0.00 46.19 44.18 3k5f s LEU 133 CO 0.70 -1.41 1.64 1.21 -1.32 0.00 0.00 176.35 177.17 3k5f n GLU 134 N 8.05 1.73 -1.19 1.98 2.13 -1.26 -4.89 120.64 127.18 3k5f n GLU 134 Ca 0.19 0.63 -0.31 0.00 0.66 0.00 0.00 57.16 58.33 3k5f n GLU 134 Cb 0.49 -2.37 0.10 0.00 0.27 0.00 0.00 31.44 29.93 3k5f n GLU 134 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3k5f s PRO 135 N 2.20 2.01 0.16 5.31 0.02 -1.26 -4.52 135.00 138.92 3k5f s PRO 135 Ca 0.88 1.17 -0.18 0.00 0.02 0.00 0.00 61.00 62.89 3k5f s PRO 135 Cb -0.82 -1.87 0.07 0.00 0.02 0.00 0.00 34.50 31.89 3k5f s PRO 135 CO 0.49 -1.82 1.67 0.35 -0.33 0.00 0.00 177.00 177.37 3k5f h PHE 136 N -1.26 -0.20 -0.36 6.54 3.57 -1.81 -2.41 116.94 121.02 3k5f h PHE 136 Ca -0.44 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.06 3k5f h PHE 136 Cb 1.24 0.14 -0.02 0.00 2.79 0.00 0.00 35.95 40.11 3k5f h PHE 136 CO 0.55 -0.16 0.10 0.35 -2.23 0.00 0.00 178.31 176.92 3k5f h PHE 137 N -0.01 0.53 -0.60 0.41 3.57 -1.93 -0.54 116.94 118.37 3k5f h PHE 137 Ca 0.17 -0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.56 3k5f h PHE 137 Cb 0.27 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 3k5f h PHE 137 CO -0.33 0.45 0.05 -0.44 -2.23 0.00 0.00 178.31 175.81 3k5f h ASP 138 N 0.52 1.00 -0.50 0.41 3.32 -1.83 -1.26 116.42 118.08 3k5f h ASP 138 Ca 0.12 -0.28 -0.05 0.00 0.02 0.00 0.00 57.03 56.84 3k5f h ASP 138 Cb 0.18 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 3k5f h ASP 138 CO -0.01 1.04 0.11 0.28 -1.72 0.00 0.00 179.24 178.94 3k5f h SER 139 N 0.93 0.77 0.17 6.45 0.02 -0.87 -1.83 113.55 119.19 3k5f h SER 139 Ca 0.18 -0.24 -0.00 0.00 -0.84 0.00 0.00 61.79 60.88 3k5f h SER 139 Cb 0.49 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 3k5f h SER 139 CO 0.02 0.82 -0.13 0.25 -1.14 0.00 0.00 176.83 176.64 3k5f h LEU 140 N 0.70 -0.34 -0.75 5.07 5.85 -0.91 0.18 115.31 125.09 3k5f h LEU 140 Ca 0.16 0.03 0.01 0.00 0.84 0.00 0.00 57.88 58.91 3k5f h LEU 140 Cb 0.35 0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.46 3k5f h LEU 140 CO 0.00 -0.21 0.50 0.58 -0.34 0.00 0.00 178.44 178.97 3k5f h VAL 141 N -0.31 1.18 -0.11 1.05 2.07 -1.16 -1.10 116.25 117.88 3k5f h VAL 141 Ca -0.01 -0.35 -0.17 0.00 0.82 0.00 0.00 66.70 66.99 3k5f h VAL 141 Cb 0.28 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 3k5f h VAL 141 CO -0.01 0.18 -0.67 0.50 0.02 0.00 0.00 177.57 177.60 3k5f h LYS 142 N 1.01 0.43 0.00 1.57 3.64 -1.17 -3.28 116.57 118.77 3k5f h LYS 142 Ca 0.28 -0.32 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 3k5f h LYS 142 Cb -0.10 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 31.77 3k5f h LYS 142 CO -0.07 0.95 -0.48 1.96 -2.27 0.00 0.00 179.45 179.54 3k5f h GLN 143 N 0.31 0.00 0.00 1.90 4.20 -0.81 -3.48 115.11 117.24 3k5f h GLN 143 Ca -0.02 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.50 3k5f h GLN 143 Cb 1.22 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.96 3k5f h GLN 143 CO 0.12 0.00 -0.16 0.25 -0.67 0.00 0.00 178.83 178.37 3k5f n THR 144 N -2.32 0.00 -0.26 -0.54 -2.24 -0.43 -5.05 114.28 103.45 3k5f n THR 144 Ca 0.03 -0.81 0.12 0.00 -2.27 0.00 0.00 64.05 61.12 3k5f n THR 144 Cb 0.46 0.27 0.31 0.00 -2.10 0.00 0.00 70.33 69.28 3k5f n THR 144 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3k5f n HIS 145 N -0.33 0.94 -1.80 4.78 8.25 -1.26 -4.77 115.22 121.03 3k5f n HIS 145 Ca -0.03 -0.47 -0.42 0.00 -0.26 0.00 0.00 57.72 56.54 3k5f n HIS 145 Cb 0.21 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.29 3k5f n HIS 145 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3k5f s VAL 146 N -1.06 2.95 0.65 1.59 1.01 -1.26 -4.94 120.40 119.33 3k5f s VAL 146 Ca 0.48 0.25 -0.17 0.00 0.00 0.00 0.00 61.98 62.53 3k5f s VAL 146 Cb 0.25 -3.16 -0.03 0.00 0.00 0.00 0.00 36.38 33.44 3k5f s VAL 146 CO 0.33 -0.01 0.94 -2.65 0.00 0.00 0.00 175.10 173.71 3k5f n PRO 147 N 6.37 0.72 -1.69 2.72 -0.02 -1.26 -4.62 135.00 137.21 3k5f n PRO 147 Ca 0.18 0.29 -0.42 0.00 -2.02 0.00 0.00 63.50 61.53 3k5f n PRO 147 Cb 0.40 -2.18 -0.00 0.00 -0.02 0.00 0.00 33.50 31.70 3k5f n PRO 147 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3k5f n ASN 148 N -1.11 3.83 -3.62 2.55 5.15 -1.26 -4.33 115.26 116.48 3k5f n ASN 148 Ca 0.14 -2.83 -0.04 0.00 -0.60 0.00 0.00 54.58 51.25 3k5f n ASN 148 Cb 0.48 -1.63 -0.02 0.00 -0.53 0.00 0.00 39.78 38.08 3k5f n ASN 148 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 3k5f s LEU 149 N 2.13 -0.09 0.11 1.20 2.34 -1.26 -1.44 118.68 121.66 3k5f s LEU 149 Ca 0.48 0.01 -0.13 0.00 0.06 0.00 0.00 54.13 54.55 3k5f s LEU 149 Cb 0.14 1.25 0.02 0.00 -0.56 0.00 0.00 46.19 47.04 3k5f s LEU 149 CO -0.08 -0.15 0.31 0.72 -1.06 0.00 0.00 176.35 176.09 3k5f s PHE 150 N -2.15 -0.05 0.07 3.48 -0.71 -1.00 -0.59 117.98 117.03 3k5f s PHE 150 Ca 0.10 -0.31 0.06 0.00 -1.04 0.00 0.00 56.93 55.74 3k5f s PHE 150 Cb -0.01 0.12 -0.03 0.00 -1.21 0.00 0.00 43.02 41.89 3k5f s PHE 150 CO -0.04 -0.63 -0.16 -1.54 -1.34 0.00 0.00 175.22 171.51 3k5f s SER 151 N -2.80 1.97 -0.09 1.98 1.04 -0.06 -0.36 113.70 115.38 3k5f s SER 151 Ca 0.04 -0.60 0.03 0.00 0.48 0.00 0.00 55.95 55.89 3k5f s SER 151 Cb 0.03 -0.09 0.01 0.00 0.10 0.00 0.00 66.02 66.07 3k5f s SER 151 CO -0.11 -0.00 -0.16 -0.76 0.98 0.00 0.00 173.24 173.18 3k5f s LEU 152 N -1.64 1.78 -0.42 2.42 1.43 0.57 -0.95 118.68 121.87 3k5f s LEU 152 Ca 0.02 -0.40 0.03 0.00 -1.03 0.00 0.00 54.13 52.75 3k5f s LEU 152 Cb -0.10 -1.05 0.11 0.00 0.03 0.00 0.00 46.19 45.19 3k5f s LEU 152 CO 0.03 0.06 0.15 -1.58 0.23 0.00 0.00 176.35 175.24 3k5f s GLN 153 N 0.68 1.74 -0.18 1.70 0.74 0.08 -1.40 119.66 123.02 3k5f s GLN 153 Ca -0.13 -2.15 -0.16 0.00 0.05 0.00 0.00 55.36 52.97 3k5f s GLN 153 Cb -0.16 -3.31 -0.04 0.00 1.10 0.00 0.00 33.01 30.60 3k5f s GLN 153 CO 0.04 -1.02 0.39 -0.51 -0.55 0.00 0.00 175.29 173.64 3k5f s LEU 154 N 0.49 4.19 0.04 3.68 1.43 -1.26 -0.83 118.68 126.41 3k5f s LEU 154 Ca 0.13 0.56 0.03 0.00 -1.03 0.00 0.00 54.13 53.82 3k5f s LEU 154 Cb -0.22 -2.52 -0.04 0.00 0.03 0.00 0.00 46.19 43.44 3k5f s LEU 154 CO -0.05 -0.04 -0.01 0.00 0.23 0.00 0.00 176.35 176.49 3k5f n GLY 156 N 1.08 -0.23 3.81 0.00 0.00 -1.26 -3.83 105.19 104.76 3k5f n GLY 156 Ca -0.13 -1.86 -0.33 0.00 0.00 0.00 0.00 46.02 43.69 3k5f n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5f s ALA 157 N -3.45 2.90 0.35 4.61 0.00 -1.26 -4.62 121.76 120.28 3k5f s ALA 157 Ca 0.43 0.49 0.29 0.00 0.00 0.00 0.00 51.96 53.16 3k5f s ALA 157 Cb -0.02 -3.22 1.12 0.00 0.00 0.00 0.00 23.12 21.01 3k5f s ALA 157 CO 0.29 -0.32 1.09 -1.13 0.00 0.00 0.00 175.76 175.69 3k5f n SER 169 N -1.17 0.08 -4.37 0.00 3.41 -1.21 -5.09 113.62 105.27 3k5f n SER 169 Ca 0.08 0.84 -0.23 0.00 -0.26 0.00 0.00 58.87 59.31 3k5f n SER 169 Cb 0.53 -0.42 -0.11 0.00 -0.26 0.00 0.00 64.21 63.95 3k5f n SER 169 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 3k5f s VAL 170 N -4.54 1.99 0.32 -3.33 -7.23 -0.82 -4.91 120.40 101.88 3k5f s VAL 170 Ca -0.04 -2.01 0.02 0.00 -1.81 0.00 0.00 61.98 58.14 3k5f s VAL 170 Cb 0.20 -1.96 -0.02 0.00 0.56 0.00 0.00 36.38 35.17 3k5f s VAL 170 CO 0.60 -0.30 0.35 -0.83 -0.31 0.00 0.00 175.10 174.60 3k5f s GLY 171 N -2.79 1.84 0.00 2.32 0.00 -1.25 -2.79 107.32 104.65 3k5f s GLY 171 Ca 0.19 -1.77 0.00 0.00 0.00 0.00 0.00 44.72 43.13 3k5f s GLY 171 CO 0.08 -1.24 0.00 0.61 0.00 0.00 0.00 173.10 172.55 3k5f n GLY 172 N -0.55 -1.50 2.98 0.20 0.00 -0.91 -1.08 105.19 104.33 3k5f n GLY 172 Ca 0.04 -1.04 -0.18 0.00 0.00 0.00 0.00 46.02 44.83 3k5f n GLY 172 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k5f s SER 173 N -1.18 0.92 -0.29 1.61 0.01 -0.01 -1.17 113.70 113.60 3k5f s SER 173 Ca 0.00 -0.14 0.02 0.00 1.31 0.00 0.00 55.95 57.14 3k5f s SER 173 Cb 0.00 -0.20 0.07 0.00 0.21 0.00 0.00 66.02 66.10 3k5f s SER 173 CO 0.00 0.06 -0.05 -0.32 0.41 0.00 0.00 173.24 173.34 3k5f s MET 174 N 0.09 2.14 -0.37 12.44 1.75 -1.26 -0.74 119.30 133.35 3k5f s MET 174 Ca -0.01 -1.44 -0.20 0.00 -1.25 0.00 0.00 55.69 52.79 3k5f s MET 174 Cb -0.06 -3.03 0.01 0.00 2.84 0.00 0.00 34.83 34.59 3k5f s MET 174 CO -0.00 -0.66 0.62 0.42 -0.65 0.00 0.00 175.02 174.74 3k5f s ILE 175 N 1.10 4.90 -0.27 10.11 -1.09 -0.13 -4.88 121.20 130.95 3k5f s ILE 175 Ca -0.04 0.44 -0.16 0.00 -2.23 0.00 0.00 60.65 58.66 3k5f s ILE 175 Cb -0.20 -4.08 -0.03 0.00 -1.58 0.00 0.00 42.46 36.56 3k5f s ILE 175 CO -0.05 -0.36 0.42 -0.63 -1.23 0.00 0.00 174.94 173.09 3k5f s ILE 176 N 2.68 5.14 0.00 2.92 1.01 -1.26 -0.88 121.20 130.81 3k5f s ILE 176 Ca 0.23 0.66 0.00 0.00 0.00 0.00 0.00 60.65 61.54 3k5f s ILE 176 Cb -0.15 -3.74 0.00 0.00 0.01 0.00 0.00 42.46 38.59 3k5f s ILE 176 CO 0.15 0.14 0.00 0.61 0.00 0.00 0.00 174.94 175.84 3k5f n GLY 177 N 4.60 0.68 0.00 6.18 0.00 0.25 -4.82 105.19 112.07 3k5f n GLY 177 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 3k5f n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5f n GLY 178 N -2.04 -0.90 3.22 -0.02 0.00 -1.22 -4.26 105.19 99.96 3k5f n GLY 178 Ca 0.00 -0.78 -0.31 0.00 0.00 0.00 0.00 46.02 44.93 3k5f n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k5f s ILE 179 N -3.00 1.94 -0.39 -0.61 1.01 -1.26 -3.91 121.20 114.98 3k5f s ILE 179 Ca 0.00 -0.98 -0.10 0.00 0.00 0.00 0.00 60.65 59.57 3k5f s ILE 179 Cb 0.00 -1.67 0.04 0.00 0.01 0.00 0.00 42.46 40.85 3k5f s ILE 179 CO 0.00 0.54 0.22 -0.62 0.00 0.00 0.00 174.94 175.08 3k5f s ASP 180 N 0.14 5.70 0.64 3.58 3.68 -1.26 -4.97 116.67 124.17 3k5f s ASP 180 Ca -0.11 -1.14 0.42 0.00 2.13 0.00 0.00 52.55 53.85 3k5f s ASP 180 Cb -0.16 -2.01 2.21 0.00 -1.45 0.00 0.00 42.92 41.52 3k5f s ASP 180 CO 0.06 -0.43 2.28 0.45 0.13 0.00 0.00 175.17 177.67 3k5f h HIS 181 N 8.43 0.00 -0.00 -5.34 3.86 -1.99 -2.23 115.15 117.88 3k5f h HIS 181 Ca -0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 3k5f h HIS 181 Cb 1.10 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.57 3k5f h HIS 181 CO 0.58 0.00 -0.03 -1.13 0.86 0.00 0.00 177.93 178.21 3k5f n SER 182 N -3.05 0.13 -0.60 2.45 3.41 -1.26 -3.55 113.62 111.15 3k5f n SER 182 Ca -0.02 -0.34 0.13 0.00 -0.26 0.00 0.00 58.87 58.38 3k5f n SER 182 Cb 0.11 -0.20 0.32 0.00 -0.26 0.00 0.00 64.21 64.18 3k5f n SER 182 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3k5f n LEU 183 N -1.17 1.95 -4.01 1.04 4.77 -0.84 -4.84 117.00 113.90 3k5f n LEU 183 Ca 0.15 -0.65 -0.10 0.00 -0.03 0.00 0.00 56.01 55.39 3k5f n LEU 183 Cb 0.24 -0.02 -0.07 0.00 -2.33 0.00 0.00 43.42 41.24 3k5f n LEU 183 CO 0.23 0.33 0.01 -0.72 -1.33 0.00 0.00 177.39 175.91 3k5f s TYR 184 N -2.12 0.51 0.30 -1.77 1.13 -1.23 -0.32 117.35 113.84 3k5f s TYR 184 Ca 0.31 -0.85 0.05 0.00 -1.41 0.00 0.00 57.07 55.17 3k5f s TYR 184 Cb 0.20 -0.06 -0.06 0.00 -1.10 0.00 0.00 41.96 40.95 3k5f s TYR 184 CO 0.37 -0.80 0.01 0.95 -2.51 0.00 0.00 175.55 173.58 3k5f s THR 185 N -4.02 1.33 0.00 -3.49 -4.23 -0.38 -4.81 115.64 100.05 3k5f s THR 185 Ca 0.22 -2.04 0.00 0.00 -1.18 0.00 0.00 61.69 58.69 3k5f s THR 185 Cb 0.03 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 71.26 3k5f s THR 185 CO 0.05 -0.16 0.00 0.61 -0.54 0.00 0.00 174.62 174.58 3k5f n GLY 186 N -0.61 -0.14 3.93 3.99 0.00 -1.26 -3.74 105.19 107.35 3k5f n GLY 186 Ca -0.04 -1.02 -0.27 0.00 0.00 0.00 0.00 46.02 44.69 3k5f n GLY 186 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k5f s SER 187 N -4.00 6.39 -0.09 1.61 0.01 -1.26 -4.96 113.70 111.39 3k5f s SER 187 Ca 0.00 0.42 -0.19 0.00 1.31 0.00 0.00 55.95 57.50 3k5f s SER 187 Cb 0.00 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.17 3k5f s SER 187 CO 0.00 -0.07 0.50 -0.76 0.41 0.00 0.00 173.24 173.32 3k5f s LEU 188 N -3.39 4.31 -0.10 2.44 1.43 -1.26 -4.50 118.68 117.60 3k5f s LEU 188 Ca 0.39 0.89 0.02 0.00 -1.03 0.00 0.00 54.13 54.39 3k5f s LEU 188 Cb -0.11 -2.74 -0.02 0.00 0.03 0.00 0.00 46.19 43.36 3k5f s LEU 188 CO 0.29 0.03 -0.15 0.26 0.23 0.00 0.00 176.35 177.01 3k5f s TRP 189 N 0.42 2.73 -0.07 0.29 0.52 0.47 -4.89 118.94 118.42 3k5f s TRP 189 Ca 0.27 -0.56 -0.01 0.00 0.02 0.00 0.00 56.10 55.82 3k5f s TRP 189 Cb -0.16 -1.76 -0.03 0.00 -1.15 0.00 0.00 33.47 30.37 3k5f s TRP 189 CO 0.12 -0.13 -0.02 0.71 0.02 0.00 0.00 176.95 177.65 3k5f s TYR 190 N 0.03 3.08 -0.04 -1.98 1.51 -1.26 0.19 117.35 118.88 3k5f s TYR 190 Ca -0.05 0.12 0.06 0.00 -1.01 0.00 0.00 57.07 56.19 3k5f s TYR 190 Cb -0.15 -1.75 -0.01 0.00 -0.11 0.00 0.00 41.96 39.95 3k5f s TYR 190 CO 0.04 0.43 -0.21 -0.08 -1.11 0.00 0.00 175.55 174.62 3k5f s THR 191 N -0.89 1.68 0.41 -0.71 -1.32 0.09 -3.78 115.64 111.12 3k5f s THR 191 Ca 0.14 -0.88 -0.26 0.00 -1.21 0.00 0.00 61.69 59.48 3k5f s THR 191 Cb -0.11 -1.42 -0.09 0.00 -1.51 0.00 0.00 72.50 69.36 3k5f s THR 191 CO 0.03 0.48 1.37 -2.84 -2.21 0.00 0.00 174.62 171.44 3k5f s PRO 192 N -0.20 3.95 -0.26 7.08 0.02 -1.26 -0.88 135.00 143.45 3k5f s PRO 192 Ca 0.00 2.30 -0.27 0.00 0.02 0.00 0.00 61.00 63.05 3k5f s PRO 192 Cb -0.11 -2.80 0.01 0.00 0.02 0.00 0.00 34.50 31.62 3k5f s PRO 192 CO 0.02 -0.56 0.95 0.42 -0.33 0.00 0.00 177.00 177.50 3k5f s ILE 193 N -1.21 4.70 0.10 2.83 1.01 -0.53 -4.56 121.20 123.54 3k5f s ILE 193 Ca 0.56 1.73 -0.20 0.00 0.00 0.00 0.00 60.65 62.75 3k5f s ILE 193 Cb -0.41 -4.26 -0.08 0.00 0.01 0.00 0.00 42.46 37.73 3k5f s ILE 193 CO 0.54 -0.22 1.69 -0.09 0.00 0.00 0.00 174.94 176.85 3k5f h ARG 194 N 7.74 0.30 -3.08 2.79 2.43 -0.54 -3.45 114.38 120.56 3k5f h ARG 194 Ca -0.21 -0.04 -0.15 0.00 -0.81 0.00 0.00 59.98 58.77 3k5f h ARG 194 Cb 1.07 -0.06 -0.24 0.00 -0.42 0.00 0.00 29.97 30.33 3k5f h ARG 194 CO 0.95 0.30 -0.37 0.50 -1.51 0.00 0.00 179.97 179.84 3k5f s ARG 195 N -5.77 0.41 -1.14 0.20 3.52 -1.26 -5.09 118.95 109.82 3k5f s ARG 195 Ca -0.13 0.21 -0.17 0.00 -0.13 0.00 0.00 55.73 55.51 3k5f s ARG 195 Cb 0.08 0.19 0.12 0.00 -1.56 0.00 0.00 34.95 33.78 3k5f s ARG 195 CO 0.70 -0.07 1.45 -1.21 -0.81 0.00 0.00 175.30 175.36 3k5f s GLU 196 N -0.27 3.87 0.00 5.12 2.02 -1.26 -4.16 118.70 124.03 3k5f s GLU 196 Ca -0.04 -2.01 0.00 0.00 0.02 0.00 0.00 54.97 52.94 3k5f s GLU 196 Cb -0.03 -5.21 0.00 0.00 0.10 0.00 0.00 34.13 28.99 3k5f s GLU 196 CO 0.01 -1.97 0.00 -2.67 0.02 0.00 0.00 175.26 170.65 3k5f n TRP 197 N 7.11 0.00 -2.24 1.61 4.27 -1.26 -4.57 117.44 122.35 3k5f n TRP 197 Ca 0.36 0.00 -0.26 0.00 -3.89 0.00 0.00 57.50 53.71 3k5f n TRP 197 Cb 0.46 0.00 0.11 0.00 -1.36 0.00 0.00 31.31 30.52 3k5f n TRP 197 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 3k5f s TYR 198 N 0.00 2.26 -1.05 -2.67 2.02 -1.26 -1.46 117.35 115.19 3k5f s TYR 198 Ca 0.00 0.22 -0.17 0.00 -0.37 0.00 0.00 57.07 56.75 3k5f s TYR 198 Cb 0.00 -3.36 0.15 0.00 -0.40 0.00 0.00 41.96 38.35 3k5f s TYR 198 CO 0.00 -1.77 1.26 0.71 -1.57 0.00 0.00 175.55 174.18 3k5f s TYR 199 N -3.36 3.26 -0.08 2.71 1.51 -1.26 -4.83 117.35 115.29 3k5f s TYR 199 Ca 0.65 -1.69 -0.18 0.00 -1.01 0.00 0.00 57.07 54.84 3k5f s TYR 199 Cb -0.08 -4.31 -0.05 0.00 -0.11 0.00 0.00 41.96 37.42 3k5f s TYR 199 CO 0.46 -1.46 0.50 -2.00 -1.11 0.00 0.00 175.55 171.94 3k5f s GLU 200 N 2.29 4.29 0.40 -0.62 2.12 -1.26 -1.73 118.70 124.20 3k5f s GLU 200 Ca 0.37 0.51 0.04 0.00 0.36 0.00 0.00 54.97 56.25 3k5f s GLU 200 Cb -0.04 -3.40 -0.03 0.00 0.26 0.00 0.00 34.13 30.93 3k5f s GLU 200 CO -0.05 0.25 0.12 0.14 -0.54 0.00 0.00 175.26 175.18 3k5f s VAL 201 N 0.30 0.65 -0.11 3.70 -7.23 -0.42 0.24 120.40 117.53 3k5f s VAL 201 Ca 0.27 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.46 3k5f s VAL 201 Cb -0.16 -2.38 0.01 0.00 0.56 0.00 0.00 36.38 34.42 3k5f s VAL 201 CO 0.12 0.00 -0.16 -0.63 -0.31 0.00 0.00 175.10 174.12 3k5f s ILE 202 N -3.21 1.58 -0.20 -0.62 1.01 -1.26 -4.13 121.20 114.36 3k5f s ILE 202 Ca 0.24 -0.69 -0.16 0.00 0.00 0.00 0.00 60.65 60.04 3k5f s ILE 202 Cb 0.03 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 3k5f s ILE 202 CO 0.14 0.46 0.42 -0.63 0.00 0.00 0.00 174.94 175.33 3k5f s ILE 203 N 0.96 5.18 -0.90 2.92 1.01 -1.26 -1.76 121.20 127.35 3k5f s ILE 203 Ca -0.07 0.74 0.15 0.00 0.00 0.00 0.00 60.65 61.48 3k5f s ILE 203 Cb -0.15 -3.75 -0.13 0.00 0.01 0.00 0.00 42.46 38.45 3k5f s ILE 203 CO -0.02 0.23 0.70 1.33 0.00 0.00 0.00 174.94 177.18 3k5f n VAL 204 N 4.42 0.00 -3.59 2.92 0.24 -0.32 -4.75 118.33 117.26 3k5f n VAL 204 Ca -0.08 -0.19 -0.10 0.00 -2.04 0.00 0.00 64.34 61.93 3k5f n VAL 204 Cb 0.51 1.05 -0.06 0.00 -1.47 0.00 0.00 33.84 33.87 3k5f n VAL 204 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3k5f s ARG 205 N -2.30 0.57 -0.03 7.34 3.52 -1.23 -4.69 118.95 122.12 3k5f s ARG 205 Ca 0.08 0.23 0.01 0.00 -0.13 0.00 0.00 55.73 55.91 3k5f s ARG 205 Cb 0.12 0.27 0.03 0.00 -1.56 0.00 0.00 34.95 33.80 3k5f s ARG 205 CO 0.57 -0.16 -0.01 0.08 -0.81 0.00 0.00 175.30 174.97 3k5f s VAL 206 N -0.84 0.25 0.08 7.11 1.01 -1.26 -0.42 120.40 126.33 3k5f s VAL 206 Ca -0.01 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.08 3k5f s VAL 206 Cb -0.01 -0.33 -0.03 0.00 0.00 0.00 0.00 36.38 36.00 3k5f s VAL 206 CO -0.00 0.16 -0.18 -1.61 0.00 0.00 0.00 175.10 173.47 3k5f s GLU 207 N 1.00 1.00 -0.17 2.72 2.02 -0.29 -1.22 118.70 123.76 3k5f s GLU 207 Ca -0.10 -1.04 0.01 0.00 0.02 0.00 0.00 54.97 53.86 3k5f s GLU 207 Cb -0.14 -1.14 0.02 0.00 0.10 0.00 0.00 34.13 32.98 3k5f s GLU 207 CO -0.01 0.26 -0.16 0.42 0.02 0.00 0.00 175.26 175.79 3k5f s ILE 208 N -1.16 1.78 -1.48 -1.63 -1.09 0.13 -0.43 121.20 117.31 3k5f s ILE 208 Ca 0.03 -0.80 -0.06 0.00 -2.23 0.00 0.00 60.65 57.59 3k5f s ILE 208 Cb -0.10 -1.66 0.05 0.00 -1.58 0.00 0.00 42.46 39.17 3k5f s ILE 208 CO 0.03 0.46 0.58 0.59 -1.23 0.00 0.00 174.94 175.36 3k5f n ASN 209 N 4.70 -1.49 0.00 3.58 3.02 -0.17 0.10 115.26 125.01 3k5f n ASN 209 Ca -0.18 -0.97 0.00 0.00 -0.03 0.00 0.00 54.58 53.39 3k5f n ASN 209 Cb 0.50 -3.13 0.00 0.00 -0.61 0.00 0.00 39.78 36.53 3k5f n ASN 209 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k5f n GLY 210 N -1.80 1.30 3.64 7.41 0.00 -1.26 -4.97 105.19 109.51 3k5f n GLY 210 Ca -0.19 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 3k5f n GLY 210 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k5f s GLN 211 N -0.17 4.10 0.22 1.61 2.00 0.11 -5.01 119.66 122.52 3k5f s GLN 211 Ca 0.00 0.16 -0.30 0.00 -2.00 0.00 0.00 55.36 53.22 3k5f s GLN 211 Cb 0.00 -3.59 -0.09 0.00 0.80 0.00 0.00 33.01 30.12 3k5f s GLN 211 CO 0.00 -0.16 1.34 0.34 -0.50 0.00 0.00 175.29 176.30 3k5f s ASP 212 N 1.32 6.84 0.00 6.67 -1.08 -1.26 0.18 116.67 129.34 3k5f s ASP 212 Ca 0.18 2.47 0.08 0.00 -0.52 0.00 0.00 52.55 54.76 3k5f s ASP 212 Cb -0.15 -2.61 0.36 0.00 -1.46 0.00 0.00 42.92 39.06 3k5f s ASP 212 CO 0.09 -0.56 1.23 0.18 0.52 0.00 0.00 175.17 176.63 3k5f n LEU 213 N 2.48 0.00 -3.59 -1.34 4.77 -0.36 -4.90 117.00 114.08 3k5f n LEU 213 Ca 0.06 0.45 -0.27 0.00 -0.03 0.00 0.00 56.01 56.22 3k5f n LEU 213 Cb 0.42 -0.45 0.04 0.00 -2.33 0.00 0.00 43.42 41.10 3k5f n LEU 213 CO 0.58 -0.33 -0.04 0.29 -1.33 0.00 0.00 177.39 176.57 3k5f n LYS 214 N -1.45 -1.39 -4.09 3.23 5.02 -1.26 -5.02 118.16 113.20 3k5f n LYS 214 Ca 0.02 0.58 -0.12 0.00 -2.02 0.00 0.00 58.31 56.78 3k5f n LYS 214 Cb 0.09 -4.40 -0.11 0.00 -0.02 0.00 0.00 35.03 30.59 3k5f n LYS 214 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3k5f s MET 215 N -5.54 0.62 0.05 1.97 -1.94 -1.26 -5.10 119.30 108.10 3k5f s MET 215 Ca 0.44 -0.97 -0.30 0.00 -1.71 0.00 0.00 55.69 53.15 3k5f s MET 215 Cb -0.14 -0.21 -0.09 0.00 2.01 0.00 0.00 34.83 36.40 3k5f s MET 215 CO 0.84 0.01 1.82 0.34 -0.01 0.00 0.00 175.02 178.02 3k5f s ASP 216 N -2.13 6.50 0.58 3.03 -1.08 -1.26 -4.82 116.67 117.50 3k5f s ASP 216 Ca -0.02 2.59 0.26 0.00 -0.52 0.00 0.00 52.55 54.86 3k5f s ASP 216 Cb -0.04 -2.55 1.43 0.00 -1.46 0.00 0.00 42.92 40.31 3k5f s ASP 216 CO -0.02 -0.99 1.79 0.00 0.52 0.00 0.00 175.17 176.47 3k5f h LYS 218 N 0.00 0.00 -0.27 0.00 1.57 -1.71 -1.63 116.57 114.54 3k5f h LYS 218 Ca 0.00 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.73 3k5f h LYS 218 Cb 0.62 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.92 3k5f h LYS 218 CO 0.00 0.21 -0.07 0.93 -0.57 0.00 0.00 179.45 179.95 3k5f h GLU 219 N 0.00 0.42 0.00 3.15 4.39 -1.00 -2.38 114.58 119.16 3k5f h GLU 219 Ca -0.00 -0.10 -0.04 0.00 0.34 0.00 0.00 59.36 59.56 3k5f h GLU 219 Cb 0.41 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 3k5f h GLU 219 CO 0.03 0.51 -0.19 1.88 -1.16 0.00 0.00 179.01 180.07 3k5f h TYR 220 N 0.40 0.00 -0.16 4.33 0.99 -1.43 -3.11 116.97 117.99 3k5f h TYR 220 Ca 0.08 0.00 -0.08 0.00 2.00 0.00 0.00 58.73 60.73 3k5f h TYR 220 Cb 0.38 0.00 -0.05 0.00 1.00 0.00 0.00 36.73 38.06 3k5f h TYR 220 CO 0.01 0.19 -0.28 0.09 -0.00 0.00 0.00 178.16 178.18 3k5f n ASN 221 N -3.73 2.13 -4.52 3.88 3.02 -0.92 -4.46 115.26 110.66 3k5f n ASN 221 Ca -0.02 -3.79 -0.41 0.00 -0.03 0.00 0.00 54.58 50.33 3k5f n ASN 221 Cb 0.31 -0.57 -0.09 0.00 -0.61 0.00 0.00 39.78 38.81 3k5f n ASN 221 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3k5f s TYR 222 N -3.22 3.21 -2.02 3.10 5.04 -1.06 0.19 117.35 122.60 3k5f s TYR 222 Ca 0.41 -0.17 0.20 0.00 -2.44 0.00 0.00 57.07 55.07 3k5f s TYR 222 Cb 0.38 -2.67 0.57 0.00 0.35 0.00 0.00 41.96 40.58 3k5f s TYR 222 CO -0.03 -0.48 1.47 -0.40 -1.34 0.00 0.00 175.55 174.77 3k5f n ASP 223 N 5.36 3.44 -3.61 4.32 5.75 -1.26 -3.42 116.55 127.13 3k5f n ASP 223 Ca -0.09 -2.00 -0.00 0.00 -0.01 0.00 0.00 54.79 52.69 3k5f n ASP 223 Cb 0.49 -0.42 -0.01 0.00 -1.03 0.00 0.00 41.12 40.14 3k5f n ASP 223 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 3k5f s LYS 224 N -1.15 0.09 -0.08 0.11 -2.85 0.13 -4.79 119.74 111.20 3k5f s LYS 224 Ca 0.43 -0.04 0.01 0.00 -1.00 0.00 0.00 55.97 55.37 3k5f s LYS 224 Cb 0.22 0.04 0.02 0.00 -2.06 0.00 0.00 37.83 36.05 3k5f s LYS 224 CO 0.29 -0.04 -0.09 -1.12 0.10 0.00 0.00 175.35 174.49 3k5f s SER 225 N -2.46 1.81 0.16 0.03 0.01 -1.26 0.73 113.70 112.73 3k5f s SER 225 Ca 0.13 -0.28 0.06 0.00 1.31 0.00 0.00 55.95 57.17 3k5f s SER 225 Cb 0.03 -0.78 -0.04 0.00 0.21 0.00 0.00 66.02 65.43 3k5f s SER 225 CO -0.04 -0.04 -0.12 0.27 0.41 0.00 0.00 173.24 173.72 3k5f s ILE 226 N 1.09 1.36 -0.33 1.44 -4.36 -0.42 -1.30 121.20 118.68 3k5f s ILE 226 Ca -0.07 -2.06 -0.11 0.00 -0.26 0.00 0.00 60.65 58.15 3k5f s ILE 226 Cb -0.14 -1.87 -0.00 0.00 1.25 0.00 0.00 42.46 41.70 3k5f s ILE 226 CO -0.01 -0.66 0.19 -0.69 0.24 0.00 0.00 174.94 174.00 3k5f s VAL 227 N -3.08 4.78 -0.27 8.37 1.01 -0.71 -0.84 120.40 129.68 3k5f s VAL 227 Ca 0.17 -0.45 -0.01 0.00 0.00 0.00 0.00 61.98 61.69 3k5f s VAL 227 Cb 0.01 -3.49 0.08 0.00 0.00 0.00 0.00 36.38 32.98 3k5f s VAL 227 CO 0.03 -0.01 0.06 -0.62 0.00 0.00 0.00 175.10 174.55 3k5f s ASP 228 N 1.63 3.70 0.28 3.32 2.15 -0.33 -4.40 116.67 123.02 3k5f s ASP 228 Ca 0.05 -1.35 0.23 0.00 0.43 0.00 0.00 52.55 51.91 3k5f s ASP 228 Cb -0.18 -0.84 1.03 0.00 -0.30 0.00 0.00 42.92 42.63 3k5f s ASP 228 CO 0.07 -0.36 1.70 -1.54 -0.17 0.00 0.00 175.17 174.88 3k5f n SER 229 N 4.87 0.65 -0.35 -0.34 3.41 -1.26 -2.28 113.62 118.33 3k5f n SER 229 Ca -0.05 0.69 0.14 0.00 -0.26 0.00 0.00 58.87 59.39 3k5f n SER 229 Cb 0.44 -0.82 0.62 0.00 -0.26 0.00 0.00 64.21 64.19 3k5f n SER 229 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k5f n GLY 230 N -0.32 -0.26 3.20 5.00 0.00 -1.26 -4.54 105.19 107.02 3k5f n GLY 230 Ca 0.01 -0.37 -0.32 0.00 0.00 0.00 0.00 46.02 45.34 3k5f n GLY 230 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5f s THR 231 N -1.98 2.11 0.02 2.61 2.01 -0.96 -4.97 115.64 114.47 3k5f s THR 231 Ca 0.40 -0.98 -0.27 0.00 0.31 0.00 0.00 61.69 61.15 3k5f s THR 231 Cb 0.21 -1.82 -0.16 0.00 0.01 0.00 0.00 72.50 70.73 3k5f s THR 231 CO 0.33 0.55 1.24 0.74 -0.69 0.00 0.00 174.62 176.79 3k5f h THR 232 N 5.76 0.32 -4.45 -0.82 2.02 -1.85 0.23 112.91 114.12 3k5f h THR 232 Ca -0.26 -0.36 -0.47 0.00 0.77 0.00 0.00 66.41 66.08 3k5f h THR 232 Cb 1.21 0.43 0.11 0.00 -1.74 0.00 0.00 68.15 68.16 3k5f h THR 232 CO 0.52 0.04 0.37 0.20 0.37 0.00 0.00 175.52 177.02 3k5f s ASN 233 N -4.69 4.34 -0.26 4.18 -0.87 -1.26 -1.10 114.94 115.29 3k5f s ASN 233 Ca -0.15 0.94 -0.18 0.00 -1.57 0.00 0.00 52.86 51.90 3k5f s ASN 233 Cb 0.02 -1.53 -0.03 0.00 -0.02 0.00 0.00 41.25 39.70 3k5f s ASN 233 CO 0.50 -2.02 0.53 -0.22 -2.57 0.00 0.00 177.10 173.32 3k5f s LEU 234 N -5.70 4.06 -0.13 0.60 2.96 -0.71 -2.81 118.68 116.94 3k5f s LEU 234 Ca 0.62 0.56 -0.03 0.00 -0.22 0.00 0.00 54.13 55.07 3k5f s LEU 234 Cb -0.12 -2.70 -0.03 0.00 0.50 0.00 0.00 46.19 43.84 3k5f s LEU 234 CO 0.51 -0.29 -0.04 -0.13 -1.32 0.00 0.00 176.35 175.08 3k5f s ARG 235 N 2.29 3.45 0.05 1.98 0.52 0.37 -1.28 118.95 126.32 3k5f s ARG 235 Ca 0.22 -0.52 0.08 0.00 -0.52 0.00 0.00 55.73 54.99 3k5f s ARG 235 Cb -0.16 -2.84 -0.03 0.00 0.52 0.00 0.00 34.95 32.45 3k5f s ARG 235 CO 0.09 0.36 -0.22 -0.51 0.02 0.00 0.00 175.30 175.03 3k5f s LEU 236 N 0.05 2.17 0.56 2.53 1.43 -0.43 -0.22 118.68 124.78 3k5f s LEU 236 Ca -0.00 -0.55 -0.20 0.00 -1.03 0.00 0.00 54.13 52.35 3k5f s LEU 236 Cb -0.13 -1.06 -0.05 0.00 0.03 0.00 0.00 46.19 44.97 3k5f s LEU 236 CO 0.03 0.18 1.10 -2.65 0.23 0.00 0.00 176.35 175.24 3k5f n PRO 237 N 1.79 1.19 -0.33 1.29 -0.02 -1.26 -0.10 135.00 137.55 3k5f n PRO 237 Ca -0.17 0.45 -0.05 0.00 -2.02 0.00 0.00 63.50 61.70 3k5f n PRO 237 Cb 0.53 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.69 3k5f n PRO 237 CO 0.00 0.00 0.00 1.17 1.98 0.00 0.00 175.50 178.65 3k5f n LYS 238 N -0.90 -0.29 -0.28 -0.52 4.81 -1.07 0.02 118.16 119.93 3k5f n LYS 238 Ca 0.12 1.26 -0.03 0.00 -0.87 0.00 0.00 58.31 58.78 3k5f n LYS 238 Cb 0.45 -1.85 0.12 0.00 0.02 0.00 0.00 35.03 33.77 3k5f n LYS 238 CO 0.00 0.00 0.00 -0.22 1.17 0.00 0.00 177.40 178.35 3k5f h LYS 239 N 0.00 1.15 -0.21 1.64 3.64 -1.92 -1.15 116.57 119.72 3k5f h LYS 239 Ca 0.20 -0.15 -0.20 0.00 -1.27 0.00 0.00 60.65 59.23 3k5f h LYS 239 Cb 0.41 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 3k5f h LYS 239 CO -0.79 0.87 -0.65 0.28 -2.27 0.00 0.00 179.45 176.88 3k5f h VAL 240 N 1.15 1.29 -0.33 2.00 2.07 -1.43 -2.77 116.25 118.23 3k5f h VAL 240 Ca 0.28 -1.87 0.02 0.00 0.82 0.00 0.00 66.70 65.96 3k5f h VAL 240 Cb 0.08 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.65 3k5f h VAL 240 CO -0.04 0.60 0.18 0.15 0.02 0.00 0.00 177.57 178.47 3k5f h PHE 241 N 0.56 0.33 -0.62 1.57 3.57 -0.03 -0.43 116.94 121.89 3k5f h PHE 241 Ca -0.02 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3k5f h PHE 241 Cb 1.26 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.87 3k5f h PHE 241 CO 0.07 0.19 0.40 0.93 -2.23 0.00 0.00 178.31 177.68 3k5f h GLU 242 N 0.37 0.83 -0.57 1.11 5.08 -1.20 -0.64 114.58 119.56 3k5f h GLU 242 Ca 0.13 -0.06 -0.09 0.00 -1.00 0.00 0.00 59.36 58.34 3k5f h GLU 242 Cb 0.03 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 3k5f h GLU 242 CO -0.08 0.56 -0.01 0.00 -1.00 0.00 0.00 179.01 178.49 3k5f h ALA 243 N 1.22 0.76 0.01 3.43 0.00 -1.20 -1.78 119.26 121.69 3k5f h ALA 243 Ca 0.23 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 3k5f h ALA 243 Cb -0.08 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 17.50 3k5f h ALA 243 CO -0.05 0.60 -0.00 0.00 0.00 0.00 0.00 179.25 179.80 3k5f h ALA 244 N 0.97 -0.01 -0.68 0.00 0.00 -0.72 -1.83 119.26 116.98 3k5f h ALA 244 Ca 0.16 -0.11 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3k5f h ALA 244 Cb 0.56 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 3k5f h ALA 244 CO 0.03 -0.40 0.40 0.28 0.00 0.00 0.00 179.25 179.57 3k5f h VAL 245 N -0.23 1.02 -0.43 0.00 2.07 -1.11 0.11 116.25 117.68 3k5f h VAL 245 Ca -0.00 -0.26 0.04 0.00 0.82 0.00 0.00 66.70 67.29 3k5f h VAL 245 Cb 0.23 0.19 -0.04 0.00 -1.52 0.00 0.00 31.29 30.16 3k5f h VAL 245 CO 0.00 0.14 0.21 0.50 0.02 0.00 0.00 177.57 178.44 3k5f h LYS 246 N 0.76 0.41 -0.36 1.57 3.64 -1.19 0.23 116.57 121.64 3k5f h LYS 246 Ca 0.29 -0.02 -0.12 0.00 -1.27 0.00 0.00 60.65 59.53 3k5f h LYS 246 Cb 0.12 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 3k5f h LYS 246 CO -0.15 0.27 -0.25 1.03 -2.27 0.00 0.00 179.45 178.08 3k5f h SER 247 N 0.42 0.74 0.33 4.20 0.87 -0.68 -2.34 113.55 117.10 3k5f h SER 247 Ca 0.19 -0.27 -0.14 0.00 -1.23 0.00 0.00 61.79 60.33 3k5f h SER 247 Cb 0.10 -0.20 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 3k5f h SER 247 CO -0.13 0.96 -0.58 0.40 -0.53 0.00 0.00 176.83 176.95 3k5f h ILE 248 N 0.63 1.37 -0.20 2.23 2.04 -0.24 -1.95 117.51 121.40 3k5f h ILE 248 Ca 0.08 -1.92 -0.04 0.00 1.00 0.00 0.00 64.86 63.98 3k5f h ILE 248 Cb 0.75 1.95 -0.01 0.00 -0.74 0.00 0.00 36.82 38.78 3k5f h ILE 248 CO 0.06 0.57 -0.04 0.11 0.00 0.00 0.00 178.15 178.85 3k5f h LYS 249 N 0.19 0.38 -0.56 2.37 1.57 -0.45 -2.76 116.57 117.30 3k5f h LYS 249 Ca -0.00 -0.14 -0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3k5f h LYS 249 Cb 1.08 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.34 3k5f h LYS 249 CO 0.09 0.63 0.33 0.00 -0.57 0.00 0.00 179.45 179.93 3k5f h ALA 250 N 0.74 0.72 -0.23 3.86 0.00 -1.36 0.20 119.26 123.18 3k5f h ALA 250 Ca 0.05 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3k5f h ALA 250 Cb 0.49 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3k5f h ALA 250 CO 0.02 0.21 0.06 0.00 0.00 0.00 0.00 179.25 179.54 3k5f h ALA 251 N 1.16 1.69 -0.44 0.00 0.00 -1.35 -1.94 119.26 118.39 3k5f h ALA 251 Ca 0.20 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.94 3k5f h ALA 251 Cb -0.00 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 17.64 3k5f h ALA 251 CO -0.04 0.24 0.06 -1.13 0.00 0.00 0.00 179.25 178.39 3k5f n SER 252 N -4.41 4.15 0.24 0.00 3.41 -0.84 -4.68 113.62 111.49 3k5f n SER 252 Ca 0.00 -3.18 0.12 0.00 -0.26 0.00 0.00 58.87 55.56 3k5f n SER 252 Cb 0.14 -0.63 0.66 0.00 -0.26 0.00 0.00 64.21 64.13 3k5f n SER 252 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 3k5f h SER 253 N 2.17 0.00 0.00 4.04 4.64 0.21 -0.45 113.55 124.16 3k5f h SER 253 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3k5f h SER 253 Cb 1.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.87 3k5f h SER 253 CO 0.41 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.72 3k5f n THR 254 N -2.49 0.00 -3.76 2.95 -2.24 -1.26 -4.60 114.28 102.88 3k5f n THR 254 Ca -0.02 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.64 3k5f n THR 254 Cb 0.25 -0.71 -0.12 0.00 -2.10 0.00 0.00 70.33 67.65 3k5f n THR 254 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3k5f s GLU 255 N -2.00 0.23 -0.04 -0.78 2.02 -0.18 -5.16 118.70 112.80 3k5f s GLU 255 Ca 0.27 0.42 -0.08 0.00 0.02 0.00 0.00 54.97 55.60 3k5f s GLU 255 Cb 0.13 0.00 -0.05 0.00 0.10 0.00 0.00 34.13 34.31 3k5f s GLU 255 CO 0.21 -0.10 0.24 0.21 0.02 0.00 0.00 175.26 175.84 3k5f s LYS 256 N 0.68 3.57 0.03 1.61 2.20 -1.26 -4.95 119.74 121.63 3k5f s LYS 256 Ca -0.05 -0.03 0.05 0.00 -0.36 0.00 0.00 55.97 55.58 3k5f s LYS 256 Cb -0.06 -3.14 -0.02 0.00 -1.51 0.00 0.00 37.83 33.10 3k5f s LYS 256 CO -0.04 0.71 -0.14 -0.06 -0.36 0.00 0.00 175.35 175.45 3k5f s PHE 257 N -1.17 1.25 0.69 4.03 0.40 -1.26 -5.13 117.98 116.79 3k5f s PHE 257 Ca 0.22 -0.34 -0.17 0.00 -0.60 0.00 0.00 56.93 56.05 3k5f s PHE 257 Cb -0.13 -0.75 0.01 0.00 0.51 0.00 0.00 43.02 42.66 3k5f s PHE 257 CO 0.11 0.03 1.20 -2.30 0.70 0.00 0.00 175.22 174.97 3k5f n PRO 258 N 2.00 0.81 -0.10 0.24 -0.02 -1.26 -4.88 135.00 131.79 3k5f n PRO 258 Ca -0.17 0.34 0.08 0.00 -2.02 0.00 0.00 63.50 61.73 3k5f n PRO 258 Cb 0.55 -2.44 0.43 0.00 -0.02 0.00 0.00 33.50 32.02 3k5f n PRO 258 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3k5f h ASP 259 N 0.10 0.50 -0.05 2.55 5.19 -2.00 -0.04 116.42 122.67 3k5f h ASP 259 Ca -0.49 0.00 0.01 0.00 -0.62 0.00 0.00 57.03 55.93 3k5f h ASP 259 Cb 1.33 -0.10 -0.00 0.00 0.18 0.00 0.00 39.33 40.74 3k5f h ASP 259 CO 0.50 0.32 0.05 1.23 -3.12 0.00 0.00 179.24 178.22 3k5f h GLY 260 N 0.57 0.00 0.57 2.75 0.00 -1.94 -2.07 103.07 102.95 3k5f h GLY 260 Ca 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.58 3k5f h GLY 260 CO -0.08 0.00 -0.14 -2.75 0.00 0.00 0.00 176.54 173.57 3k5f h PHE 261 N 0.00 -0.37 0.00 5.60 3.57 -1.16 0.26 116.94 124.84 3k5f h PHE 261 Ca 0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.51 3k5f h PHE 261 Cb 0.12 0.12 0.00 0.00 2.79 0.00 0.00 35.95 38.98 3k5f h PHE 261 CO 0.00 -0.02 0.00 0.91 -2.23 0.00 0.00 178.31 176.97 3k5f n TRP 262 N -5.09 0.55 1.17 0.41 7.02 -0.98 -0.59 117.44 119.93 3k5f n TRP 262 Ca -0.09 0.25 0.12 0.00 -1.02 0.00 0.00 57.50 56.77 3k5f n TRP 262 Cb 0.27 -0.90 0.26 0.00 -2.42 0.00 0.00 31.31 28.51 3k5f n TRP 262 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3k5f n LEU 263 N -2.03 1.40 -0.24 -0.99 4.77 -0.82 -4.94 117.00 114.15 3k5f n LEU 263 Ca 0.01 -0.44 -0.03 0.00 -0.03 0.00 0.00 56.01 55.51 3k5f n LEU 263 Cb 0.11 -0.08 -0.01 0.00 -2.33 0.00 0.00 43.42 41.11 3k5f n LEU 263 CO 0.12 0.26 -0.03 0.61 -1.33 0.00 0.00 177.39 177.02 3k5f n GLY 264 N 1.36 0.58 0.31 -0.72 0.00 0.25 -4.94 105.19 102.03 3k5f n GLY 264 Ca 0.12 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 45.07 3k5f n GLY 264 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k5f n GLU 265 N -2.77 0.44 -2.87 1.61 1.02 0.68 -4.85 120.64 113.90 3k5f n GLU 265 Ca -0.03 0.18 -0.33 0.00 -0.02 0.00 0.00 57.16 56.97 3k5f n GLU 265 Cb 0.14 -1.25 -0.06 0.00 -0.02 0.00 0.00 31.44 30.24 3k5f n GLU 265 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3k5f s GLN 266 N -2.58 4.10 0.06 3.49 -0.21 0.18 -4.94 119.66 119.77 3k5f s GLN 266 Ca -0.26 0.93 0.04 0.00 0.02 0.00 0.00 55.36 56.09 3k5f s GLN 266 Cb 0.07 -2.26 -0.04 0.00 1.00 0.00 0.00 33.01 31.78 3k5f s GLN 266 CO 0.36 -0.00 -0.03 -0.48 -2.12 0.00 0.00 175.29 173.01 3k5f s LEU 267 N -3.26 3.34 -0.01 2.90 2.34 -1.26 -4.19 118.68 118.53 3k5f s LEU 267 Ca 0.59 -0.18 0.03 0.00 0.06 0.00 0.00 54.13 54.62 3k5f s LEU 267 Cb -0.10 -2.03 -0.03 0.00 -0.56 0.00 0.00 46.19 43.47 3k5f s LEU 267 CO 0.18 0.21 -0.06 0.54 -1.06 0.00 0.00 176.35 176.15 3k5f s VAL 268 N -1.20 3.69 0.16 1.48 0.11 -0.38 -4.90 120.40 119.36 3k5f s VAL 268 Ca 0.22 -0.70 0.09 0.00 -2.93 0.00 0.00 61.98 58.67 3k5f s VAL 268 Cb -0.11 -2.58 -0.04 0.00 -1.53 0.00 0.00 36.38 32.11 3k5f s VAL 268 CO 0.14 0.44 -0.20 0.00 -3.33 0.00 0.00 175.10 172.15 3k5f s TRP 270 N -1.76 0.27 0.54 0.00 0.51 0.36 -4.96 118.94 113.89 3k5f s TRP 270 Ca 0.15 -0.63 -0.22 0.00 -2.12 0.00 0.00 56.10 53.28 3k5f s TRP 270 Cb -0.07 -0.19 -0.05 0.00 -0.81 0.00 0.00 33.47 32.34 3k5f s TRP 270 CO 0.07 -0.36 1.32 -1.14 -0.51 0.00 0.00 176.95 176.33 3k5f s GLN 271 N -2.83 3.22 -0.37 4.98 0.74 -1.26 0.42 119.66 124.57 3k5f s GLN 271 Ca -0.03 2.14 -0.40 0.00 0.05 0.00 0.00 55.36 57.12 3k5f s GLN 271 Cb 0.00 -2.26 -0.16 0.00 1.10 0.00 0.00 33.01 31.70 3k5f s GLN 271 CO -0.06 -1.09 1.94 0.00 -0.55 0.00 0.00 175.29 175.53 3k5f n ALA 272 N -0.98 0.13 -0.96 1.58 0.00 -0.62 -0.51 120.51 119.15 3k5f n ALA 272 Ca 0.10 0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.78 3k5f n ALA 272 Cb 0.46 -2.25 0.00 0.00 0.00 0.00 0.00 19.45 17.65 3k5f n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k5f n GLY 273 N 5.50 0.50 0.51 0.00 0.00 -1.26 -4.91 105.19 105.53 3k5f n GLY 273 Ca 0.37 -0.22 0.06 0.00 0.00 0.00 0.00 46.02 46.23 3k5f n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k5f n THR 274 N -2.96 0.10 -1.68 2.61 -2.24 0.33 -5.01 114.28 105.44 3k5f n THR 274 Ca 0.00 -0.55 -0.55 0.00 -2.27 0.00 0.00 64.05 60.68 3k5f n THR 274 Cb 0.00 1.18 -0.06 0.00 -2.10 0.00 0.00 70.33 69.34 3k5f n THR 274 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3k5f n THR 275 N 0.68 0.26 -1.56 4.28 -1.04 -1.26 -4.82 114.28 110.81 3k5f n THR 275 Ca 0.08 -0.05 -0.41 0.00 -2.04 0.00 0.00 64.05 61.63 3k5f n THR 275 Cb 0.32 -1.22 -0.01 0.00 -1.82 0.00 0.00 70.33 67.60 3k5f n THR 275 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3k5f n PRO 276 N 4.78 3.28 -0.10 -2.82 -0.04 -1.26 -4.74 135.00 134.10 3k5f n PRO 276 Ca 0.24 -2.46 0.15 0.00 -0.04 0.00 0.00 63.50 61.39 3k5f n PRO 276 Cb 0.17 -3.06 0.54 0.00 -0.04 0.00 0.00 33.50 31.11 3k5f n PRO 276 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3k5f h TRP 277 N 5.53 0.37 0.00 0.54 4.06 -1.94 -1.95 115.95 122.56 3k5f h TRP 277 Ca 0.70 0.01 -0.04 0.00 2.06 0.00 0.00 58.89 61.63 3k5f h TRP 277 Cb 0.48 -0.12 -0.01 0.00 -1.00 0.00 0.00 29.16 28.51 3k5f h TRP 277 CO 1.65 0.16 -0.17 -2.95 -3.56 0.00 0.00 178.44 173.56 3k5f h ASN 278 N 0.33 0.00 0.84 -3.49 -0.00 -2.00 -2.23 115.58 109.04 3k5f h ASN 278 Ca 0.31 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.61 3k5f h ASN 278 Cb 0.76 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 39.08 3k5f h ASN 278 CO -0.08 0.17 0.00 2.30 -0.00 0.00 0.00 177.43 179.82 3k5f n ILE 279 N -4.29 0.43 -3.92 6.14 -5.35 -0.73 -4.69 119.36 106.94 3k5f n ILE 279 Ca -0.02 0.08 -0.35 0.00 -0.27 0.00 0.00 62.75 62.18 3k5f n ILE 279 Cb 0.24 -0.71 -0.08 0.00 -1.74 0.00 0.00 39.64 37.34 3k5f n ILE 279 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 3k5f s PHE 280 N -3.02 3.36 0.69 4.28 0.08 -0.84 -2.92 117.98 119.61 3k5f s PHE 280 Ca 0.11 0.25 -0.11 0.00 0.12 0.00 0.00 56.93 57.30 3k5f s PHE 280 Cb 0.15 -2.05 0.00 0.00 -0.57 0.00 0.00 43.02 40.55 3k5f s PHE 280 CO 0.43 0.34 1.07 -1.25 -0.10 0.00 0.00 175.22 175.71 3k5f s PRO 281 N -0.01 3.00 -0.01 0.24 0.04 -1.26 -4.77 135.00 132.23 3k5f s PRO 281 Ca 0.08 0.69 -0.11 0.00 0.04 0.00 0.00 61.00 61.70 3k5f s PRO 281 Cb -0.12 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.35 3k5f s PRO 281 CO 0.00 -0.99 0.34 0.14 0.04 0.00 0.00 177.00 176.54 3k5f s VAL 282 N -3.20 5.17 -0.19 -0.36 -7.23 -1.26 -4.27 120.40 109.06 3k5f s VAL 282 Ca 0.57 0.56 -0.05 0.00 -1.81 0.00 0.00 61.98 61.25 3k5f s VAL 282 Cb -0.12 -3.62 -0.03 0.00 0.56 0.00 0.00 36.38 33.17 3k5f s VAL 282 CO 0.54 0.50 0.00 -0.63 -0.31 0.00 0.00 175.10 175.20 3k5f s ILE 283 N -1.16 4.11 -0.20 -0.62 1.01 0.08 -0.99 121.20 123.43 3k5f s ILE 283 Ca 0.24 -0.27 -0.05 0.00 0.00 0.00 0.00 60.65 60.58 3k5f s ILE 283 Cb -0.15 -2.84 -0.02 0.00 0.01 0.00 0.00 42.46 39.46 3k5f s ILE 283 CO 0.13 0.45 -0.01 -0.44 0.00 0.00 0.00 174.94 175.07 3k5f s SER 284 N 0.71 4.73 -0.23 3.58 0.01 0.42 0.79 113.70 123.71 3k5f s SER 284 Ca 0.00 -0.24 -0.03 0.00 1.31 0.00 0.00 55.95 56.99 3k5f s SER 284 Cb -0.14 -1.81 0.00 0.00 0.21 0.00 0.00 66.02 64.28 3k5f s SER 284 CO 0.02 0.05 -0.05 -0.76 0.41 0.00 0.00 173.24 172.91 3k5f s LEU 285 N 1.07 2.94 -0.14 2.44 1.43 -0.16 -1.14 118.68 125.12 3k5f s LEU 285 Ca 0.02 -0.52 -0.16 0.00 -1.03 0.00 0.00 54.13 52.44 3k5f s LEU 285 Cb -0.14 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 3k5f s LEU 285 CO 0.01 -0.05 0.39 -0.31 0.23 0.00 0.00 176.35 176.62 3k5f s TYR 286 N 1.44 3.48 -0.07 0.29 1.51 0.44 -1.22 117.35 123.22 3k5f s TYR 286 Ca 0.05 0.74 0.01 0.00 -1.01 0.00 0.00 57.07 56.85 3k5f s TYR 286 Cb -0.15 -2.46 -0.03 0.00 -0.11 0.00 0.00 41.96 39.22 3k5f s TYR 286 CO -0.04 0.18 -0.08 -0.51 -1.11 0.00 0.00 175.55 173.99 3k5f s LEU 287 N 0.62 3.08 0.23 -1.29 1.43 0.51 -1.17 118.68 122.10 3k5f s LEU 287 Ca 0.21 -0.06 -0.32 0.00 -1.03 0.00 0.00 54.13 52.93 3k5f s LEU 287 Cb -0.14 -1.66 -0.12 0.00 0.03 0.00 0.00 46.19 44.29 3k5f s LEU 287 CO 0.07 0.35 1.64 0.80 0.23 0.00 0.00 176.35 179.44 3k5f n MET 288 N 2.30 2.61 -2.25 1.70 0.00 -0.72 -2.28 117.12 118.48 3k5f n MET 288 Ca -0.18 0.94 -0.26 0.00 -0.00 0.00 0.00 57.70 58.20 3k5f n MET 288 Cb 0.53 -2.74 0.11 0.00 0.00 0.00 0.00 33.22 31.12 3k5f n MET 288 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 3k5f s GLY 289 N 0.84 1.74 0.54 -5.12 0.00 -1.26 -4.00 107.32 100.06 3k5f s GLY 289 Ca 0.71 -1.26 0.23 0.00 0.00 0.00 0.00 44.72 44.40 3k5f s GLY 289 CO 0.40 -0.70 2.08 0.83 0.00 0.00 0.00 173.10 175.70 3k5f h GLU 290 N -0.87 0.00 -5.08 2.90 4.39 -1.77 -3.38 114.58 110.77 3k5f h GLU 290 Ca -0.42 0.00 -0.45 0.00 0.34 0.00 0.00 59.36 58.84 3k5f h GLU 290 Cb 1.28 0.00 -0.28 0.00 -0.10 0.00 0.00 28.75 29.64 3k5f h GLU 290 CO 0.48 0.00 -0.80 0.08 -1.16 0.00 0.00 179.01 177.61 3k5f s VAL 291 N -4.95 0.96 -1.46 3.13 1.01 -1.26 -5.02 120.40 112.81 3k5f s VAL 291 Ca -0.05 -0.56 0.07 0.00 0.00 0.00 0.00 61.98 61.44 3k5f s VAL 291 Cb 0.18 -0.81 0.13 0.00 0.00 0.00 0.00 36.38 35.88 3k5f s VAL 291 CO 0.67 0.24 1.08 0.35 0.00 0.00 0.00 175.10 177.44 3k5f n THR 292 N 2.69 0.83 0.15 3.92 -2.24 -1.26 -0.43 114.28 117.95 3k5f n THR 292 Ca -0.14 0.21 0.09 0.00 -2.27 0.00 0.00 64.05 61.93 3k5f n THR 292 Cb 0.56 -1.09 0.17 0.00 -2.10 0.00 0.00 70.33 67.87 3k5f n THR 292 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3k5f n ASN 293 N -1.27 3.06 -1.24 3.42 6.94 -1.26 -0.57 115.26 124.35 3k5f n ASN 293 Ca 0.03 -1.89 0.01 0.00 -0.02 0.00 0.00 54.58 52.71 3k5f n ASN 293 Cb 0.06 -0.21 0.12 0.00 -2.36 0.00 0.00 39.78 37.38 3k5f n ASN 293 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3k5f n GLN 294 N 1.08 1.41 -1.44 -3.83 6.02 0.43 -4.09 117.38 116.96 3k5f n GLN 294 Ca 0.15 -3.06 -0.30 0.00 -0.01 0.00 0.00 57.00 53.79 3k5f n GLN 294 Cb 0.50 -1.23 0.20 0.00 1.02 0.00 0.00 30.24 30.73 3k5f n GLN 294 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3k5f s SER 295 N -2.97 2.09 0.24 1.08 0.01 -0.18 -4.18 113.70 109.79 3k5f s SER 295 Ca 0.38 0.56 -0.19 0.00 1.31 0.00 0.00 55.95 58.01 3k5f s SER 295 Cb 0.38 -0.79 0.02 0.00 0.21 0.00 0.00 66.02 65.84 3k5f s SER 295 CO -0.08 -3.40 0.63 0.72 0.41 0.00 0.00 173.24 171.52 3k5f s PHE 296 N -3.35 -0.14 0.15 2.43 -0.12 -0.96 -1.11 117.98 114.88 3k5f s PHE 296 Ca 0.71 -0.25 0.08 0.00 -0.05 0.00 0.00 56.93 57.42 3k5f s PHE 296 Cb -0.09 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.82 3k5f s PHE 296 CO 0.55 -1.09 -0.17 -0.98 -0.05 0.00 0.00 175.22 173.47 3k5f s ARG 297 N -3.90 1.21 -0.04 1.99 1.70 -0.28 -0.36 118.95 119.26 3k5f s ARG 297 Ca 0.11 -1.37 0.06 0.00 -0.47 0.00 0.00 55.73 54.07 3k5f s ARG 297 Cb -0.04 -1.21 -0.01 0.00 -0.57 0.00 0.00 34.95 33.12 3k5f s ARG 297 CO 0.03 0.24 -0.23 0.96 -1.08 0.00 0.00 175.30 175.22 3k5f s ILE 298 N -2.09 1.86 -0.18 4.99 -4.36 -0.36 -1.73 121.20 119.34 3k5f s ILE 298 Ca 0.14 -0.98 -0.05 0.00 -0.26 0.00 0.00 60.65 59.50 3k5f s ILE 298 Cb -0.05 -1.56 -0.03 0.00 1.25 0.00 0.00 42.46 42.06 3k5f s ILE 298 CO 0.06 0.52 0.00 -0.89 0.24 0.00 0.00 174.94 174.87 3k5f s THR 299 N -0.29 4.16 -0.26 8.37 2.01 -0.56 -0.98 115.64 128.08 3k5f s THR 299 Ca 0.02 -0.25 -0.08 0.00 0.31 0.00 0.00 61.69 61.69 3k5f s THR 299 Cb -0.11 -2.86 -0.03 0.00 0.01 0.00 0.00 72.50 69.51 3k5f s THR 299 CO 0.01 0.46 0.08 -0.63 -0.69 0.00 0.00 174.62 173.85 3k5f s ILE 300 N 0.58 4.34 0.44 1.82 -1.09 0.24 -3.79 121.20 123.74 3k5f s ILE 300 Ca -0.00 -0.19 -0.05 0.00 -2.23 0.00 0.00 60.65 58.17 3k5f s ILE 300 Cb -0.14 -3.05 -0.04 0.00 -1.58 0.00 0.00 42.46 37.65 3k5f s ILE 300 CO 0.02 0.31 0.73 -0.76 -1.23 0.00 0.00 174.94 174.01 3k5f s LEU 301 N 1.62 3.74 0.55 2.97 1.43 -1.26 -0.74 118.68 126.99 3k5f s LEU 301 Ca 0.06 0.86 0.23 0.00 -1.03 0.00 0.00 54.13 54.25 3k5f s LEU 301 Cb -0.15 -3.79 1.52 0.00 0.03 0.00 0.00 46.19 43.80 3k5f s LEU 301 CO 0.04 -0.49 2.17 1.55 0.23 0.00 0.00 176.35 179.86 3k5f h PRO 302 N 0.53 0.00 0.00 1.29 0.13 -1.86 0.27 132.00 132.36 3k5f h PRO 302 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3k5f h PRO 302 Cb 1.20 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.33 3k5f h PRO 302 CO 0.62 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.43 3k5f n GLN 303 N -4.21 0.12 -0.11 0.86 3.00 -1.26 -1.21 117.38 114.57 3k5f n GLN 303 Ca -0.02 0.58 -0.20 0.00 -0.01 0.00 0.00 57.00 57.35 3k5f n GLN 303 Cb 0.15 -1.87 -0.07 0.00 0.00 0.00 0.00 30.24 28.44 3k5f n GLN 303 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.06 178.10 3k5f n GLN 304 N -2.13 0.56 -0.02 -1.09 6.02 0.93 -4.50 117.38 117.15 3k5f n GLN 304 Ca -0.01 0.32 0.07 0.00 -0.01 0.00 0.00 57.00 57.38 3k5f n GLN 304 Cb 0.06 -1.53 0.40 0.00 1.02 0.00 0.00 30.24 30.19 3k5f n GLN 304 CO 0.00 0.00 0.00 2.48 -1.01 0.00 0.00 177.06 178.53 3k5f n TYR 305 N -4.37 0.04 -3.79 1.08 0.18 -1.10 -4.21 117.16 104.99 3k5f n TYR 305 Ca -0.35 -0.02 -0.34 0.00 1.88 0.00 0.00 57.90 59.06 3k5f n TYR 305 Cb 0.69 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.54 3k5f n TYR 305 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3k5f s LEU 306 N -1.43 4.96 -0.07 -3.48 1.43 -0.35 0.03 118.68 119.76 3k5f s LEU 306 Ca 0.22 -2.90 -0.30 0.00 -1.03 0.00 0.00 54.13 50.12 3k5f s LEU 306 Cb 0.11 -1.79 -0.03 0.00 0.03 0.00 0.00 46.19 44.51 3k5f s LEU 306 CO 0.17 -0.33 1.26 -0.60 0.23 0.00 0.00 176.35 177.09 3k5f s ARG 307 N -0.14 4.31 0.25 1.70 3.52 -0.30 -4.74 118.95 123.55 3k5f s ARG 307 Ca 0.17 1.73 -0.30 0.00 -0.13 0.00 0.00 55.73 57.20 3k5f s ARG 307 Cb -0.22 -3.62 -0.09 0.00 -1.56 0.00 0.00 34.95 29.46 3k5f s ARG 307 CO -0.02 -0.54 1.27 -1.25 -0.81 0.00 0.00 175.30 173.94 3k5f s PRO 308 N 2.60 4.43 0.22 5.12 0.04 -1.26 -0.14 135.00 146.01 3k5f s PRO 308 Ca 0.57 2.05 0.06 0.00 0.04 0.00 0.00 61.00 63.72 3k5f s PRO 308 Cb -0.25 -3.16 -0.05 0.00 0.04 0.00 0.00 34.50 31.07 3k5f s PRO 308 CO 0.21 -0.15 -0.09 0.14 0.04 0.00 0.00 177.00 177.15 3k5f s VAL 309 N -0.44 1.54 0.14 -0.36 -7.23 -0.71 -4.90 120.40 108.44 3k5f s VAL 309 Ca 0.52 -2.14 -0.34 0.00 -1.81 0.00 0.00 61.98 58.21 3k5f s VAL 309 Cb -0.36 -2.19 -0.14 0.00 0.56 0.00 0.00 36.38 34.25 3k5f s VAL 309 CO 0.43 -0.48 1.55 -0.62 -0.31 0.00 0.00 175.10 175.66 3k5f n GLU 310 N -0.43 1.98 -2.49 4.82 -0.58 -1.26 -4.45 120.64 118.24 3k5f n GLU 310 Ca -0.07 0.72 -0.42 0.00 -0.42 0.00 0.00 57.16 56.96 3k5f n GLU 310 Cb 0.62 -2.47 -0.03 0.00 -0.57 0.00 0.00 31.44 28.99 3k5f n GLU 310 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3k5f s ASP 311 N 0.96 7.11 -0.08 1.62 -1.08 -1.26 -4.93 116.67 119.00 3k5f s ASP 311 Ca 0.80 1.85 -0.13 0.00 -0.52 0.00 0.00 52.55 54.56 3k5f s ASP 311 Cb -0.73 -2.57 -0.29 0.00 -1.46 0.00 0.00 42.92 37.88 3k5f s ASP 311 CO 0.40 -0.50 0.59 0.58 0.52 0.00 0.00 175.17 176.76 3k5f h VAL 312 N 4.83 0.94 0.00 1.11 2.07 -1.95 -3.43 116.25 119.81 3k5f h VAL 312 Ca -0.37 -2.45 0.00 0.00 0.82 0.00 0.00 66.70 64.70 3k5f h VAL 312 Cb 1.18 2.72 0.00 0.00 -1.52 0.00 0.00 31.29 33.67 3k5f h VAL 312 CO 0.84 0.80 0.00 0.00 0.02 0.00 0.00 177.57 179.23 3k5f n ALA 313 N -2.92 0.00 -2.88 1.67 0.00 -1.26 -4.98 120.51 110.14 3k5f n ALA 313 Ca -0.26 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.06 3k5f n ALA 313 Cb 1.00 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.33 3k5f n ALA 313 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3k5f s THR 314 N 0.00 0.35 -1.11 0.00 2.01 -1.26 -5.06 115.64 110.57 3k5f s THR 314 Ca 0.00 -0.79 -0.24 0.00 0.31 0.00 0.00 61.69 60.97 3k5f s THR 314 Cb 0.00 -0.41 -0.12 0.00 0.01 0.00 0.00 72.50 71.98 3k5f s THR 314 CO 0.00 -0.30 2.00 -0.44 -0.69 0.00 0.00 174.62 175.20 3k5f s SER 315 N -1.16 4.58 0.00 3.53 0.01 -1.26 -3.08 113.70 116.32 3k5f s SER 315 Ca -0.09 -1.29 0.00 0.00 1.31 0.00 0.00 55.95 55.88 3k5f s SER 315 Cb -0.08 -2.59 0.00 0.00 0.21 0.00 0.00 66.02 63.57 3k5f s SER 315 CO -0.00 -3.51 0.00 0.00 0.41 0.00 0.00 173.24 170.14 3k5f n GLN 316 N 8.35 0.00 -5.05 12.44 10.64 -1.26 -5.13 117.38 137.38 3k5f n GLN 316 Ca 0.43 0.00 -0.32 0.00 -1.83 0.00 0.00 57.00 55.28 3k5f n GLN 316 Cb 0.46 0.00 -0.14 0.00 -0.86 0.00 0.00 30.24 29.70 3k5f n GLN 316 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 3k5f s ASP 317 N 0.00 3.63 -0.29 2.61 1.01 -1.18 -1.60 116.67 120.85 3k5f s ASP 317 Ca 0.00 -0.33 -0.20 0.00 0.71 0.00 0.00 52.55 52.74 3k5f s ASP 317 Cb 0.00 -0.80 -0.01 0.00 1.01 0.00 0.00 42.92 43.12 3k5f s ASP 317 CO 0.00 0.30 0.60 -1.81 0.21 0.00 0.00 175.17 174.47 3k5f s ASP 318 N -0.50 6.48 0.05 0.27 1.01 0.17 -4.82 116.67 119.33 3k5f s ASP 318 Ca 0.06 0.44 0.05 0.00 0.71 0.00 0.00 52.55 53.82 3k5f s ASP 318 Cb -0.11 -2.32 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 3k5f s ASP 318 CO 0.01 -0.43 -0.09 0.00 0.21 0.00 0.00 175.17 174.87 3k5f s TYR 320 N -1.09 0.59 0.05 0.00 1.51 0.12 -1.74 117.35 116.81 3k5f s TYR 320 Ca 0.19 -0.95 0.07 0.00 -1.01 0.00 0.00 57.07 55.38 3k5f s TYR 320 Cb -0.11 -0.40 -0.03 0.00 -0.11 0.00 0.00 41.96 41.30 3k5f s TYR 320 CO 0.10 -0.29 -0.18 0.15 -1.11 0.00 0.00 175.55 174.22 3k5f s LYS 321 N -3.53 2.03 -0.51 -0.62 -0.14 0.80 -1.25 119.74 116.51 3k5f s LYS 321 Ca 0.05 -1.01 -0.28 0.00 -1.36 0.00 0.00 55.97 53.37 3k5f s LYS 321 Cb 0.05 -2.18 0.01 0.00 -1.68 0.00 0.00 37.83 34.03 3k5f s LYS 321 CO -0.07 0.53 1.46 0.12 -0.76 0.00 0.00 175.35 176.63 3k5f s PHE 322 N -0.96 2.26 -0.16 3.18 5.36 -1.26 -1.15 117.98 125.24 3k5f s PHE 322 Ca 0.15 0.55 -0.00 0.00 -0.96 0.00 0.00 56.93 56.67 3k5f s PHE 322 Cb -0.11 -4.34 0.12 0.00 -0.34 0.00 0.00 43.02 38.36 3k5f s PHE 322 CO 0.06 -2.04 1.86 0.00 -1.46 0.00 0.00 175.22 173.64 3k5f n ALA 323 N 9.60 4.34 -3.76 11.12 0.00 0.10 -4.44 120.51 137.47 3k5f n ALA 323 Ca 0.14 -0.85 -0.24 0.00 0.00 0.00 0.00 53.44 52.50 3k5f n ALA 323 Cb 0.49 -1.18 -0.17 0.00 0.00 0.00 0.00 19.45 18.59 3k5f n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3k5f s ILE 324 N -1.14 0.78 0.25 0.00 1.01 -1.26 -1.73 121.20 119.10 3k5f s ILE 324 Ca 0.16 -0.17 0.03 0.00 0.00 0.00 0.00 60.65 60.67 3k5f s ILE 324 Cb 0.13 -0.82 -0.05 0.00 0.01 0.00 0.00 42.46 41.72 3k5f s ILE 324 CO 0.00 0.31 0.03 -0.94 0.00 0.00 0.00 174.94 174.34 3k5f s SER 325 N 1.51 1.77 0.43 3.58 1.04 -0.41 -4.72 113.70 116.91 3k5f s SER 325 Ca -0.00 -1.27 -0.20 0.00 0.48 0.00 0.00 55.95 54.96 3k5f s SER 325 Cb -0.13 0.03 -0.10 0.00 0.10 0.00 0.00 66.02 65.91 3k5f s SER 325 CO -0.04 -0.57 0.93 -1.58 0.98 0.00 0.00 173.24 172.96 3k5f s GLN 326 N -3.90 4.17 0.06 4.02 0.74 -1.26 -1.31 119.66 122.17 3k5f s GLN 326 Ca 0.31 1.05 0.03 0.00 0.05 0.00 0.00 55.36 56.80 3k5f s GLN 326 Cb 0.07 -2.20 -0.03 0.00 1.10 0.00 0.00 33.01 31.95 3k5f s GLN 326 CO 0.11 -0.04 -0.09 0.45 -0.55 0.00 0.00 175.29 175.16 3k5f s SER 327 N -2.32 1.13 0.00 6.67 0.15 0.85 -4.71 113.70 115.47 3k5f s SER 327 Ca 0.61 -0.65 0.04 0.00 0.70 0.00 0.00 55.95 56.65 3k5f s SER 327 Cb -0.09 0.02 0.07 0.00 -1.71 0.00 0.00 66.02 64.31 3k5f s SER 327 CO 0.16 -0.21 0.85 -1.54 1.20 0.00 0.00 173.24 173.69 3k5f n SER 328 N 1.15 1.82 -0.81 5.45 3.41 -1.26 -2.59 113.62 120.79 3k5f n SER 328 Ca -0.20 -1.55 0.06 0.00 -0.26 0.00 0.00 58.87 56.91 3k5f n SER 328 Cb 0.56 -0.04 0.15 0.00 -0.26 0.00 0.00 64.21 64.62 3k5f n SER 328 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3k5f n THR 329 N 0.09 1.58 0.00 6.66 -2.24 -1.26 -4.85 114.28 114.25 3k5f n THR 329 Ca 0.03 -2.57 0.00 0.00 -2.27 0.00 0.00 64.05 59.25 3k5f n THR 329 Cb 0.20 0.09 0.00 0.00 -2.10 0.00 0.00 70.33 68.53 3k5f n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k5f n GLY 330 N -0.70 0.50 3.74 3.38 0.00 -1.22 -4.50 105.19 106.39 3k5f n GLY 330 Ca 0.15 -2.14 -0.41 0.00 0.00 0.00 0.00 46.02 43.63 3k5f n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5f s THR 331 N -1.03 4.36 -0.19 2.61 2.01 0.22 -4.28 115.64 119.35 3k5f s THR 331 Ca 0.00 2.03 0.01 0.00 0.31 0.00 0.00 61.69 64.04 3k5f s THR 331 Cb 0.00 -4.30 0.04 0.00 0.01 0.00 0.00 72.50 68.24 3k5f s THR 331 CO 0.00 0.39 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.52 3k5f s VAL 332 N -0.46 1.62 -0.74 3.82 1.01 0.70 -1.30 120.40 125.05 3k5f s VAL 332 Ca 0.44 -0.93 -0.19 0.00 0.00 0.00 0.00 61.98 61.30 3k5f s VAL 332 Cb -0.24 -1.67 0.12 0.00 0.00 0.00 0.00 36.38 34.59 3k5f s VAL 332 CO 0.30 0.22 0.89 -0.04 0.00 0.00 0.00 175.10 176.48 3k5f s MET 333 N 1.42 3.31 0.00 2.72 -1.94 -0.02 -0.48 119.30 124.30 3k5f s MET 333 Ca -0.00 -1.52 0.00 0.00 -1.71 0.00 0.00 55.69 52.46 3k5f s MET 333 Cb -0.16 -4.49 0.00 0.00 2.01 0.00 0.00 34.83 32.20 3k5f s MET 333 CO -0.09 -1.63 0.00 0.41 -0.01 0.00 0.00 175.02 173.70 3k5f n GLY 334 N 5.19 0.07 0.37 -0.03 0.00 -1.12 -1.19 105.19 108.47 3k5f n GLY 334 Ca 0.05 -1.82 0.11 0.00 0.00 0.00 0.00 46.02 44.36 3k5f n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5f h ALA 335 N -1.27 1.68 -0.08 4.61 0.00 -0.24 -0.77 119.26 123.19 3k5f h ALA 335 Ca 0.00 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 3k5f h ALA 335 Cb 0.00 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 3k5f h ALA 335 CO 0.00 0.04 0.03 -0.39 0.00 0.00 0.00 179.25 178.93 3k5f h VAL 336 N 0.83 1.03 0.17 0.00 -1.51 -1.36 0.25 116.25 115.66 3k5f h VAL 336 Ca 0.50 -0.11 -0.23 0.00 -1.23 0.00 0.00 66.70 65.63 3k5f h VAL 336 Cb 0.69 0.95 0.03 0.00 -2.13 0.00 0.00 31.29 30.82 3k5f h VAL 336 CO -0.27 0.04 -1.00 0.40 -1.23 0.00 0.00 177.57 175.51 3k5f h ILE 337 N 0.11 1.45 -0.27 7.19 1.08 -1.44 -3.35 117.51 122.28 3k5f h ILE 337 Ca 0.03 -2.57 -0.09 0.00 -0.39 0.00 0.00 64.86 61.84 3k5f h ILE 337 Cb 0.03 3.14 -0.01 0.00 -3.07 0.00 0.00 36.82 36.90 3k5f h ILE 337 CO -0.00 0.74 -0.20 0.24 -0.69 0.00 0.00 178.15 178.24 3k5f h MET 338 N -0.21 0.49 -0.86 2.37 2.86 -0.72 -3.34 114.93 115.52 3k5f h MET 338 Ca -0.17 -0.17 0.16 0.00 -2.06 0.00 0.00 59.70 57.46 3k5f h MET 338 Cb 1.79 -0.04 -0.16 0.00 0.06 0.00 0.00 31.60 33.25 3k5f h MET 338 CO 0.19 0.66 -0.28 0.93 1.06 0.00 0.00 176.91 179.47 3k5f h GLU 339 N 0.44 -0.03 0.00 1.72 5.08 -0.65 0.66 114.58 121.80 3k5f h GLU 339 Ca 0.07 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.43 3k5f h GLU 339 Cb 0.59 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.85 3k5f h GLU 339 CO 0.04 -0.02 0.00 0.41 -1.00 0.00 0.00 179.01 178.44 3k5f n GLY 340 N -1.52 -0.75 3.40 -3.84 0.00 -1.25 -4.53 105.19 96.70 3k5f n GLY 340 Ca 0.11 -0.13 -0.20 0.00 0.00 0.00 0.00 46.02 45.80 3k5f n GLY 340 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k5f s PHE 341 N -2.00 1.82 -0.23 1.61 0.40 0.22 -1.75 117.98 118.06 3k5f s PHE 341 Ca 0.32 -0.99 -0.07 0.00 -0.60 0.00 0.00 56.93 55.59 3k5f s PHE 341 Cb 0.15 -1.14 -0.03 0.00 0.51 0.00 0.00 43.02 42.50 3k5f s PHE 341 CO 0.25 -0.07 0.06 -0.47 0.70 0.00 0.00 175.22 175.70 3k5f s TYR 342 N -3.41 3.12 -0.20 0.36 5.04 0.11 -4.32 117.35 118.06 3k5f s TYR 342 Ca 0.36 -0.27 -0.02 0.00 -2.44 0.00 0.00 57.07 54.69 3k5f s TYR 342 Cb 0.08 -2.18 -0.00 0.00 0.35 0.00 0.00 41.96 40.21 3k5f s TYR 342 CO 0.14 -0.20 -0.09 0.08 -1.34 0.00 0.00 175.55 174.14 3k5f s VAL 343 N 1.21 3.03 -0.31 3.14 1.01 -0.49 -2.02 120.40 125.96 3k5f s VAL 343 Ca 0.04 -0.62 -0.10 0.00 0.00 0.00 0.00 61.98 61.31 3k5f s VAL 343 Cb -0.14 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.88 3k5f s VAL 343 CO 0.03 0.46 0.16 -0.69 0.00 0.00 0.00 175.10 175.07 3k5f s VAL 344 N 1.32 4.71 -1.03 2.92 1.01 0.57 -0.31 120.40 129.60 3k5f s VAL 344 Ca 0.04 -0.35 -0.15 0.00 0.00 0.00 0.00 61.98 61.52 3k5f s VAL 344 Cb -0.14 -3.39 0.19 0.00 0.00 0.00 0.00 36.38 33.04 3k5f s VAL 344 CO -0.05 0.08 1.14 -0.36 0.00 0.00 0.00 175.10 175.91 3k5f s PHE 345 N 1.64 3.57 -1.24 5.22 0.08 0.51 -0.41 117.98 127.35 3k5f s PHE 345 Ca 0.05 -1.97 -0.14 0.00 0.12 0.00 0.00 56.93 54.99 3k5f s PHE 345 Cb -0.17 -4.12 0.16 0.00 -0.57 0.00 0.00 43.02 38.32 3k5f s PHE 345 CO 0.07 -1.26 1.54 -3.47 -0.10 0.00 0.00 175.22 172.00 3k5f n ASP 346 N 5.07 5.15 -0.36 1.36 -0.08 -0.14 -2.38 116.55 125.18 3k5f n ASP 346 Ca 0.26 -2.98 -0.02 0.00 -1.51 0.00 0.00 54.79 50.54 3k5f n ASP 346 Cb 0.45 -1.58 0.13 0.00 2.34 0.00 0.00 41.12 42.46 3k5f n ASP 346 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 3k5f h ARG 347 N 6.99 1.28 -0.72 -0.67 3.08 -1.75 -0.96 114.38 121.63 3k5f h ARG 347 Ca 0.35 -0.08 0.12 0.00 0.07 0.00 0.00 59.98 60.44 3k5f h ARG 347 Cb 0.84 -0.29 -0.05 0.00 0.08 0.00 0.00 29.97 30.55 3k5f h ARG 347 CO 1.33 0.85 0.48 0.00 -1.07 0.00 0.00 179.97 181.55 3k5f h ALA 348 N 1.39 1.97 -0.19 0.04 0.00 -1.56 -1.66 119.26 119.25 3k5f h ALA 348 Ca 0.36 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3k5f h ALA 348 Cb -0.14 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.55 3k5f h ALA 348 CO -0.08 -0.14 0.00 0.54 0.00 0.00 0.00 179.25 179.57 3k5f n ARG 349 N -4.49 2.54 -3.95 0.00 1.74 -0.95 -5.00 116.66 106.56 3k5f n ARG 349 Ca 0.13 -2.55 -0.31 0.00 -0.77 0.00 0.00 57.85 54.34 3k5f n ARG 349 Cb 0.42 -1.61 -0.01 0.00 -1.02 0.00 0.00 32.46 30.24 3k5f n ARG 349 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3k5f n LYS 350 N -0.56 -1.91 -3.65 5.56 5.02 -0.46 -4.92 118.16 117.23 3k5f n LYS 350 Ca 0.17 0.32 -0.11 0.00 -2.02 0.00 0.00 58.31 56.67 3k5f n LYS 350 Cb 0.71 -3.96 -0.05 0.00 -0.02 0.00 0.00 35.03 31.71 3k5f n LYS 350 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3k5f s ARG 351 N -6.66 1.02 -0.11 1.97 1.70 -0.63 -1.46 118.95 114.77 3k5f s ARG 351 Ca 0.21 -0.61 0.03 0.00 -0.47 0.00 0.00 55.73 54.89 3k5f s ARG 351 Cb -0.09 0.45 0.01 0.00 -0.57 0.00 0.00 34.95 34.75 3k5f s ARG 351 CO 0.91 -0.38 -0.20 0.42 -1.08 0.00 0.00 175.30 174.97 3k5f s ILE 352 N -3.39 1.85 0.03 4.99 1.01 -0.06 -0.97 121.20 124.67 3k5f s ILE 352 Ca 0.00 -0.87 0.01 0.00 0.00 0.00 0.00 60.65 59.79 3k5f s ILE 352 Cb 0.01 -1.64 -0.04 0.00 0.01 0.00 0.00 42.46 40.80 3k5f s ILE 352 CO -0.09 0.51 0.08 -0.83 0.00 0.00 0.00 174.94 174.61 3k5f s GLY 353 N 0.70 2.02 -0.01 6.18 0.00 0.45 -0.73 107.32 115.92 3k5f s GLY 353 Ca -0.11 -0.93 0.04 0.00 0.00 0.00 0.00 44.72 43.72 3k5f s GLY 353 CO 0.02 -0.86 -0.15 -1.36 0.00 0.00 0.00 173.10 170.76 3k5f s PHE 354 N -1.28 1.30 0.05 1.90 0.40 0.13 -0.32 117.98 120.16 3k5f s PHE 354 Ca 0.26 -0.25 -0.17 0.00 -0.60 0.00 0.00 56.93 56.17 3k5f s PHE 354 Cb -0.12 -0.84 0.03 0.00 0.51 0.00 0.00 43.02 42.60 3k5f s PHE 354 CO 0.18 -0.02 0.40 0.00 0.70 0.00 0.00 175.22 176.47 3k5f s ALA 355 N -0.33 -0.96 0.13 5.36 0.00 -0.86 -0.39 121.76 124.71 3k5f s ALA 355 Ca 0.05 0.26 -0.31 0.00 0.00 0.00 0.00 51.96 51.96 3k5f s ALA 355 Cb -0.06 0.35 -0.10 0.00 0.00 0.00 0.00 23.12 23.32 3k5f s ALA 355 CO -0.01 -0.45 1.64 0.08 0.00 0.00 0.00 175.76 177.02 3k5f s VAL 356 N -2.51 2.68 0.46 0.00 1.01 -1.25 0.09 120.40 120.88 3k5f s VAL 356 Ca -0.05 0.37 -0.21 0.00 0.00 0.00 0.00 61.98 62.08 3k5f s VAL 356 Cb -0.01 -3.24 -0.09 0.00 0.00 0.00 0.00 36.38 33.05 3k5f s VAL 356 CO -0.03 0.02 1.04 -0.55 0.00 0.00 0.00 175.10 175.58 3k5f s SER 357 N 1.73 6.44 0.52 3.32 0.15 -0.71 -1.25 113.70 123.89 3k5f s SER 357 Ca 0.73 1.96 0.30 0.00 0.70 0.00 0.00 55.95 59.65 3k5f s SER 357 Cb -0.43 -2.57 1.32 0.00 -1.71 0.00 0.00 66.02 62.63 3k5f s SER 357 CO 0.32 -0.71 1.98 0.00 1.20 0.00 0.00 173.24 176.03 3k5f h ALA 358 N 1.80 1.05 -0.69 5.45 0.00 -0.98 -2.05 119.26 123.84 3k5f h ALA 358 Ca -0.49 -0.08 -0.25 0.00 0.00 0.00 0.00 54.91 54.08 3k5f h ALA 358 Cb 1.22 -0.01 -0.15 0.00 0.00 0.00 0.00 17.79 18.85 3k5f h ALA 358 CO 0.60 0.12 0.27 0.00 0.00 0.00 0.00 179.25 180.24 3k5f n HIS 360 N -0.51 -0.65 -1.43 0.00 -0.00 -0.77 -4.71 115.22 107.15 3k5f n HIS 360 Ca 0.42 0.31 -0.34 0.00 -0.00 0.00 0.00 57.72 58.12 3k5f n HIS 360 Cb 1.35 -1.90 0.09 0.00 -0.00 0.00 0.00 29.99 29.53 3k5f n HIS 360 CO 0.00 0.00 0.00 0.14 -0.00 0.00 0.00 176.34 176.48 3k5f s VAL 361 N -2.15 2.54 0.04 0.61 -7.23 -1.26 -5.05 120.40 107.90 3k5f s VAL 361 Ca 0.64 0.25 0.07 0.00 -1.81 0.00 0.00 61.98 61.13 3k5f s VAL 361 Cb -0.28 -2.75 -0.02 0.00 0.56 0.00 0.00 36.38 33.88 3k5f s VAL 361 CO 0.60 -0.16 -0.21 -1.00 -0.31 0.00 0.00 175.10 174.02 3k5f s HIS 362 N -2.17 1.87 -0.05 2.82 3.76 -1.26 -4.55 115.29 115.71 3k5f s HIS 362 Ca 0.71 -0.38 -0.16 0.00 -0.15 0.00 0.00 55.06 55.08 3k5f s HIS 362 Cb -0.26 -1.12 0.03 0.00 1.11 0.00 0.00 32.58 32.34 3k5f s HIS 362 CO 0.46 0.08 0.37 0.34 -0.85 0.00 0.00 174.74 175.14 3k5f s ASP 363 N -1.09 -0.29 0.24 1.40 -1.08 -1.22 -4.96 116.67 109.66 3k5f s ASP 363 Ca 0.08 0.32 -0.02 0.00 -0.52 0.00 0.00 52.55 52.40 3k5f s ASP 363 Cb -0.09 0.45 0.28 0.00 -1.46 0.00 0.00 42.92 42.11 3k5f s ASP 363 CO 0.01 -0.40 1.70 -0.33 0.52 0.00 0.00 175.17 176.68 3k5f h GLU 364 N 4.14 0.75 0.00 4.34 5.08 -2.03 -3.33 114.58 123.53 3k5f h GLU 364 Ca -0.29 -0.25 0.00 0.00 -1.00 0.00 0.00 59.36 57.83 3k5f h GLU 364 Cb 1.17 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 30.36 3k5f h GLU 364 CO 0.37 0.84 0.00 1.97 -1.00 0.00 0.00 179.01 181.18 3k5f n PHE 365 N -4.16 0.00 -4.07 4.33 1.16 -1.26 -5.05 117.46 108.41 3k5f n PHE 365 Ca 0.01 -0.07 -0.08 0.00 -1.87 0.00 0.00 57.45 55.45 3k5f n PHE 365 Cb 0.36 -0.01 -0.10 0.00 -1.61 0.00 0.00 39.48 38.12 3k5f n PHE 365 CO 0.00 0.00 0.00 1.03 -1.87 0.00 0.00 176.76 175.92 3k5f s ARG 366 N -0.13 0.55 -0.11 3.97 0.52 -1.25 -5.16 118.95 117.34 3k5f s ARG 366 Ca 0.00 -1.08 -0.08 0.00 -0.52 0.00 0.00 55.73 54.06 3k5f s ARG 366 Cb 0.00 0.15 0.04 0.00 0.52 0.00 0.00 34.95 35.66 3k5f s ARG 366 CO 0.00 -0.09 0.27 -0.08 0.02 0.00 0.00 175.30 175.42 3k5f s THR 367 N -3.29 -0.02 0.56 0.02 -1.32 -1.26 -3.46 115.64 106.87 3k5f s THR 367 Ca 0.02 0.07 -0.19 0.00 -1.21 0.00 0.00 61.69 60.38 3k5f s THR 367 Cb 0.03 -0.40 -0.07 0.00 -1.51 0.00 0.00 72.50 70.55 3k5f s THR 367 CO -0.07 0.03 0.73 0.00 -2.21 0.00 0.00 174.62 173.09 3k5f n ALA 368 N 3.61 -0.56 -3.59 11.08 0.00 -1.26 -4.97 120.51 124.82 3k5f n ALA 368 Ca -0.19 0.01 -0.10 0.00 0.00 0.00 0.00 53.44 53.16 3k5f n ALA 368 Cb 0.56 -1.95 -0.02 0.00 0.00 0.00 0.00 19.45 18.04 3k5f n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k5f s ALA 369 N -1.60 -1.45 -0.20 0.00 0.00 -1.25 -4.99 121.76 112.27 3k5f s ALA 369 Ca 0.71 0.18 -0.02 0.00 0.00 0.00 0.00 51.96 52.83 3k5f s ALA 369 Cb -0.45 0.87 0.06 0.00 0.00 0.00 0.00 23.12 23.60 3k5f s ALA 369 CO 0.52 -0.88 0.01 0.08 0.00 0.00 0.00 175.76 175.49 3k5f s VAL 370 N -3.81 0.81 0.04 0.00 1.01 -1.26 -1.50 120.40 115.70 3k5f s VAL 370 Ca 0.05 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.36 3k5f s VAL 370 Cb -0.03 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.08 3k5f s VAL 370 CO -0.05 -0.17 -0.19 -1.61 0.00 0.00 0.00 175.10 173.08 3k5f s GLU 371 N 1.73 1.28 0.23 2.72 2.02 -0.70 -4.94 118.70 121.02 3k5f s GLU 371 Ca -0.02 -0.89 -0.21 0.00 0.02 0.00 0.00 54.97 53.86 3k5f s GLU 371 Cb -0.17 -1.36 0.07 0.00 0.10 0.00 0.00 34.13 32.76 3k5f s GLU 371 CO -0.07 0.35 0.96 0.20 0.02 0.00 0.00 175.26 176.71 3k5f s GLY 372 N -1.16 0.09 0.50 -1.39 0.00 -1.26 -1.13 107.32 102.97 3k5f s GLY 372 Ca 0.06 -0.33 -0.06 0.00 0.00 0.00 0.00 44.72 44.39 3k5f s GLY 372 CO 0.02 1.22 0.82 2.56 0.00 0.00 0.00 173.10 177.72 3k5f s PRO 373 N -2.50 3.54 0.04 2.90 0.04 -1.26 -5.10 135.00 132.66 3k5f s PRO 373 Ca 0.18 0.28 0.03 0.00 0.04 0.00 0.00 61.00 61.53 3k5f s PRO 373 Cb -0.03 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 32.16 3k5f s PRO 373 CO 0.06 -0.27 -0.10 -0.06 0.04 0.00 0.00 177.00 176.67 3k5f s PHE 374 N -2.81 0.88 -0.24 0.56 0.40 -0.26 -4.92 117.98 111.58 3k5f s PHE 374 Ca 0.49 -0.37 -0.10 0.00 -0.60 0.00 0.00 56.93 56.34 3k5f s PHE 374 Cb -0.10 -0.52 -0.05 0.00 0.51 0.00 0.00 43.02 42.86 3k5f s PHE 374 CO 0.46 -0.02 0.15 0.54 0.70 0.00 0.00 175.22 177.05 3k5f s VAL 375 N -0.96 5.22 0.34 -0.44 0.11 -1.26 -1.01 120.40 122.40 3k5f s VAL 375 Ca -0.03 0.13 0.08 0.00 -2.93 0.00 0.00 61.98 59.23 3k5f s VAL 375 Cb -0.08 -3.43 -0.03 0.00 -1.53 0.00 0.00 36.38 31.31 3k5f s VAL 375 CO 0.01 0.35 0.28 0.42 -3.33 0.00 0.00 175.10 172.82 3k5f s THR 376 N 1.09 0.04 0.93 5.04 -4.23 0.27 -4.99 115.64 113.79 3k5f s THR 376 Ca 0.07 -2.00 -0.11 0.00 -1.18 0.00 0.00 61.69 58.47 3k5f s THR 376 Cb -0.14 -2.48 0.15 0.00 1.34 0.00 0.00 72.50 71.37 3k5f s THR 376 CO 0.05 0.00 1.09 -0.76 -0.54 0.00 0.00 174.62 174.46 3k5f s LEU 377 N -3.41 2.26 0.00 4.79 1.43 -1.26 -4.79 118.68 117.70 3k5f s LEU 377 Ca 0.39 1.72 0.07 0.00 -1.03 0.00 0.00 54.13 55.28 3k5f s LEU 377 Cb 0.02 -4.08 0.07 0.00 0.03 0.00 0.00 46.19 42.23 3k5f s LEU 377 CO 0.28 -2.96 0.56 -0.90 0.23 0.00 0.00 176.35 173.56 3k5f n ASP 378 N -4.11 1.65 -0.37 2.29 5.68 -1.26 -4.94 116.55 115.49 3k5f n ASP 378 Ca 0.08 -2.17 -0.00 0.00 -0.50 0.00 0.00 54.79 52.19 3k5f n ASP 378 Cb 0.54 -0.28 0.14 0.00 -1.14 0.00 0.00 41.12 40.38 3k5f n ASP 378 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 3k5f h MET 379 N 0.00 1.25 -0.22 0.11 1.85 -1.97 -1.91 114.93 114.04 3k5f h MET 379 Ca -0.21 -0.08 -0.04 0.00 -0.61 0.00 0.00 59.70 58.77 3k5f h MET 379 Cb 0.93 -0.28 -0.01 0.00 0.43 0.00 0.00 31.60 32.66 3k5f h MET 379 CO 0.30 0.83 -0.04 1.49 -0.40 0.00 0.00 176.91 179.09 3k5f h GLU 380 N 1.29 0.33 0.00 0.39 4.57 -1.95 1.14 114.58 120.35 3k5f h GLU 380 Ca 0.39 -0.06 -0.11 0.00 -1.18 0.00 0.00 59.36 58.40 3k5f h GLU 380 Cb -0.04 -0.05 -0.02 0.00 -0.16 0.00 0.00 28.75 28.48 3k5f h GLU 380 CO -0.11 0.39 -0.61 -0.44 -1.18 0.00 0.00 179.01 177.06 3k5f h ASP 381 N 0.32 0.00 0.00 1.04 3.32 -1.75 -3.38 116.42 115.97 3k5f h ASP 381 Ca 0.07 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.06 3k5f h ASP 381 Cb 0.28 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.82 3k5f h ASP 381 CO 0.01 0.49 -1.36 0.00 -1.72 0.00 0.00 179.24 176.66 3k5f s GLY 383 N -3.27 2.93 0.17 0.00 0.00 0.39 -4.05 107.32 103.49 3k5f s GLY 383 Ca -0.03 1.20 -0.07 0.00 0.00 0.00 0.00 44.72 45.82 3k5f s GLY 383 CO 0.26 1.78 0.44 -0.47 0.00 0.00 0.00 173.10 175.11 3k5f s TYR 384 N -1.26 3.46 0.00 1.90 5.04 -1.26 -4.90 117.35 120.33 3k5f s TYR 384 Ca 0.55 0.67 0.00 0.00 -2.44 0.00 0.00 57.07 55.85 3k5f s TYR 384 Cb -0.37 -2.10 0.00 0.00 0.35 0.00 0.00 41.96 39.84 3k5f s TYR 384 CO 0.48 0.38 0.00 0.09 -1.34 0.00 0.00 175.55 175.16