#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 -0.72 0.66 0.04 -1.97 -3.17 116.94 111.78 3k5f h PHE 47 Ca 0.00 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.85 3k5f h PHE 47 Cb 0.00 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.10 3k5f h PHE 47 CO 0.00 0.08 0.47 -0.24 -0.60 0.00 0.00 178.31 178.02 3k5f h VAL 48 N 0.00 0.96 0.00 -0.55 3.04 -2.01 0.17 116.25 117.86 3k5f h VAL 48 Ca -0.00 -0.23 0.00 0.00 -1.01 0.00 0.00 66.70 65.46 3k5f h VAL 48 Cb 0.82 0.25 0.00 0.00 -2.01 0.00 0.00 31.29 30.35 3k5f h VAL 48 CO 0.01 0.12 0.00 -0.62 -1.01 0.00 0.00 177.57 176.07 3k5f n GLU 1 N -4.49 0.11 -0.00 4.17 1.02 -1.20 -2.47 120.64 117.79 3k5f n GLU 1 Ca 0.11 0.35 0.10 0.00 -0.02 0.00 0.00 57.16 57.71 3k5f n GLU 1 Cb 0.30 -1.72 -0.10 0.00 -0.02 0.00 0.00 31.44 29.90 3k5f n GLU 1 CO 0.00 0.00 0.00 -1.33 1.18 0.00 0.00 177.13 176.98 3k5f n MET 2 N -1.93 0.07 -1.79 3.49 2.81 0.57 -4.65 117.12 115.69 3k5f n MET 2 Ca 0.03 -0.02 -0.41 0.00 -1.81 0.00 0.00 57.70 55.49 3k5f n MET 2 Cb 0.21 -1.51 -0.01 0.00 -0.71 0.00 0.00 33.22 31.20 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 -3.06 2.05 -1.79 2.03 1.01 -1.03 -1.91 120.40 117.69 3k5f s VAL 3 Ca 0.06 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.09 3k5f s VAL 3 Cb 0.16 -3.03 0.00 0.00 0.00 0.00 0.00 36.38 33.51 3k5f s VAL 3 CO 0.86 0.01 0.00 0.47 0.00 0.00 0.00 175.10 176.44 3k5f n ASP 4 N 1.11 -5.76 -0.13 3.32 10.43 -1.21 -4.87 116.55 119.45 3k5f n ASP 4 Ca 0.04 0.05 0.08 0.00 2.57 0.00 0.00 54.79 57.53 3k5f n ASP 4 Cb 0.38 -4.83 0.41 0.00 1.84 0.00 0.00 41.12 38.92 3k5f n ASP 4 CO 0.00 0.00 0.00 -0.46 -1.07 0.00 0.00 177.20 175.67 3k5f n ASN 5 N -1.93 0.40 -4.49 -2.24 6.94 -0.81 -4.79 115.26 108.34 3k5f n ASN 5 Ca -0.24 -1.60 -0.25 0.00 -0.02 0.00 0.00 54.58 52.47 3k5f n ASN 5 Cb 0.68 -0.03 -0.10 0.00 -2.36 0.00 0.00 39.78 37.97 3k5f n ASN 5 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3k5f s LEU 6 N -1.45 2.67 0.20 -4.53 1.43 -0.30 -4.39 118.68 112.30 3k5f s LEU 6 Ca 0.24 -0.87 -0.22 0.00 -1.03 0.00 0.00 54.13 52.25 3k5f s LEU 6 Cb 0.11 -1.27 0.07 0.00 0.03 0.00 0.00 46.19 45.14 3k5f s LEU 6 CO 0.18 0.07 1.01 0.00 0.23 0.00 0.00 176.35 177.85 3k5f s ARG 7 N -3.18 1.38 0.00 1.70 1.70 -1.03 -2.37 118.95 117.16 3k5f s ARG 7 Ca 0.27 -0.88 0.00 0.00 -0.47 0.00 0.00 55.73 54.64 3k5f s ARG 7 Cb -0.07 0.39 0.00 0.00 -0.57 0.00 0.00 34.95 34.71 3k5f s ARG 7 CO 0.14 -0.65 0.00 0.41 -1.08 0.00 0.00 175.30 174.12 3k5f n GLY 8 N -0.67 -0.87 3.49 3.88 0.00 -0.81 -0.96 105.19 109.25 3k5f n GLY 8 Ca -0.04 -1.28 -0.32 0.00 0.00 0.00 0.00 46.02 44.38 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 -2.00 2.44 -0.04 1.61 1.02 -1.26 -1.36 119.74 120.16 3k5f s LYS 9 Ca 0.00 -0.74 -0.38 0.00 0.02 0.00 0.00 55.97 54.87 3k5f s LYS 9 Cb 0.00 -2.36 -0.17 0.00 -0.52 0.00 0.00 37.83 34.78 3k5f s LYS 9 CO 0.00 0.61 1.42 0.45 -0.92 0.00 0.00 175.35 176.91 3k5f n SER 10 N 2.11 1.62 0.00 2.83 2.88 -1.26 -0.51 113.62 121.29 3k5f n SER 10 Ca -0.17 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.49 3k5f n SER 10 Cb 0.52 -1.13 0.00 0.00 -0.75 0.00 0.00 64.21 62.85 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 2.89 0.81 0.05 0.46 0.00 -1.26 -4.87 105.19 103.26 3k5f n GLY 11 Ca 0.21 0.00 0.06 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.27 1.98 0.00 1.61 6.02 0.33 -4.90 117.38 120.15 3k5f n GLN 12 Ca 0.00 -2.08 0.00 0.00 -0.01 0.00 0.00 57.00 54.91 3k5f n GLN 12 Cb 0.01 -1.27 0.00 0.00 1.02 0.00 0.00 30.24 30.00 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 -1.01 -1.45 3.56 1.08 0.00 -1.25 -4.79 105.19 101.33 3k5f n GLY 13 Ca 0.09 -1.58 -0.34 0.00 0.00 0.00 0.00 46.02 44.20 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 -2.25 2.95 0.15 1.61 1.51 -1.26 -4.06 117.35 116.00 3k5f s TYR 14 Ca 0.00 -0.05 0.07 0.00 -1.01 0.00 0.00 57.07 56.07 3k5f s TYR 14 Cb 0.00 -1.76 -0.04 0.00 -0.11 0.00 0.00 41.96 40.05 3k5f s TYR 14 CO 0.00 0.25 -0.15 1.52 -1.11 0.00 0.00 175.55 176.07 3k5f s TYR 15 N -0.57 1.54 0.20 2.71 -0.85 -0.13 -0.45 117.35 119.79 3k5f s TYR 15 Ca 0.09 -0.56 0.10 0.00 -0.52 0.00 0.00 57.07 56.18 3k5f s TYR 15 Cb -0.12 -0.78 -0.04 0.00 0.38 0.00 0.00 41.96 41.40 3k5f s TYR 15 CO 0.02 0.22 -0.20 0.54 -1.52 0.00 0.00 175.55 174.61 3k5f s VAL 16 N -2.37 2.09 0.10 -3.49 0.11 0.69 -2.47 120.40 115.06 3k5f s VAL 16 Ca 0.14 -2.07 -0.23 0.00 -2.93 0.00 0.00 61.98 56.89 3k5f s VAL 16 Cb -0.04 -2.03 -0.07 0.00 -1.53 0.00 0.00 36.38 32.71 3k5f s VAL 16 CO 0.04 -0.30 0.68 -0.70 -3.33 0.00 0.00 175.10 171.49 3k5f s GLU 17 N -2.97 4.40 0.24 1.54 2.12 -1.26 0.55 118.70 123.32 3k5f s GLU 17 Ca 0.20 0.95 -0.00 0.00 0.36 0.00 0.00 54.97 56.48 3k5f s GLU 17 Cb -0.06 -3.27 -0.03 0.00 0.26 0.00 0.00 34.13 31.03 3k5f s GLU 17 CO 0.09 0.55 0.22 -1.64 -0.54 0.00 0.00 175.26 173.94 3k5f s MET 18 N -0.93 1.41 0.01 4.30 -1.94 -0.21 -4.14 119.30 117.80 3k5f s MET 18 Ca 0.33 -1.69 0.00 0.00 -1.71 0.00 0.00 55.69 52.63 3k5f s MET 18 Cb -0.21 0.32 -0.01 0.00 2.01 0.00 0.00 34.83 36.94 3k5f s MET 18 CO 0.22 -0.50 -0.02 0.95 -0.01 0.00 0.00 175.02 175.66 3k5f s THR 19 N -3.91 0.14 0.03 2.05 -4.23 -0.09 -1.63 115.64 107.99 3k5f s THR 19 Ca 0.37 -0.47 0.01 0.00 -1.18 0.00 0.00 61.69 60.43 3k5f s THR 19 Cb 0.05 -0.20 -0.02 0.00 1.34 0.00 0.00 72.50 73.67 3k5f s THR 19 CO 0.16 -0.21 -0.05 0.68 -0.54 0.00 0.00 174.62 174.65 3k5f s VAL 20 N -0.69 0.34 0.07 2.29 -7.23 -0.90 -1.08 120.40 113.20 3k5f s VAL 20 Ca -0.07 -0.87 0.00 0.00 -1.81 0.00 0.00 61.98 59.23 3k5f s VAL 20 Cb -0.05 -0.42 0.00 0.00 0.56 0.00 0.00 36.38 36.47 3k5f s VAL 20 CO -0.00 -0.35 0.00 0.61 -0.31 0.00 0.00 175.10 175.04 3k5f n GLY 21 N 1.75 -1.78 2.80 2.32 0.00 -0.10 -1.45 105.19 108.73 3k5f n GLY 21 Ca -0.22 -1.46 -0.25 0.00 0.00 0.00 0.00 46.02 44.10 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 -4.35 1.93 0.77 1.61 0.01 -1.26 -2.56 113.70 109.86 3k5f s SER 22 Ca 0.00 -0.25 -0.12 0.00 1.31 0.00 0.00 55.95 56.89 3k5f s SER 22 Cb 0.00 -0.57 0.06 0.00 0.21 0.00 0.00 66.02 65.72 3k5f s SER 22 CO 0.00 -0.19 1.13 -2.16 0.41 0.00 0.00 173.24 172.43 3k5f s PRO 23 N 1.89 2.05 0.07 12.44 0.04 -1.26 -1.54 135.00 148.70 3k5f s PRO 23 Ca 0.04 1.44 -0.34 0.00 0.04 0.00 0.00 61.00 62.18 3k5f s PRO 23 Cb -0.13 -1.85 -0.13 0.00 0.04 0.00 0.00 34.50 32.43 3k5f s PRO 23 CO -0.06 -1.84 1.69 -2.30 0.04 0.00 0.00 177.00 174.53 3k5f n PRO 24 N -3.28 2.17 -3.77 0.56 -0.02 -1.06 -4.89 135.00 124.72 3k5f n PRO 24 Ca 0.11 0.79 -0.37 0.00 -2.02 0.00 0.00 63.50 62.01 3k5f n PRO 24 Cb 0.52 -2.59 -0.13 0.00 -0.02 0.00 0.00 33.50 31.29 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 2.03 3.37 0.13 -0.52 -0.21 -0.53 -4.88 119.66 119.06 3k5f s GLN 25 Ca 0.84 -0.66 -0.30 0.00 0.02 0.00 0.00 55.36 55.25 3k5f s GLN 25 Cb -0.68 -3.33 -0.06 0.00 1.00 0.00 0.00 33.01 29.94 3k5f s GLN 25 CO 0.43 -0.31 1.00 0.99 -2.12 0.00 0.00 175.29 175.28 3k5f s THR 26 N 1.55 4.32 -0.00 -0.19 2.01 -1.26 -2.12 115.64 119.95 3k5f s THR 26 Ca 0.05 1.94 -0.20 0.00 0.31 0.00 0.00 61.69 63.79 3k5f s THR 26 Cb -0.16 -4.24 0.04 0.00 0.01 0.00 0.00 72.50 68.15 3k5f s THR 26 CO 0.03 0.30 0.43 -0.76 -0.69 0.00 0.00 174.62 173.93 3k5f s LEU 27 N -0.06 0.34 -0.22 4.42 1.43 -0.65 -5.00 118.68 118.94 3k5f s LEU 27 Ca 0.48 0.21 -0.14 0.00 -1.03 0.00 0.00 54.13 53.65 3k5f s LEU 27 Cb -0.25 1.73 -0.04 0.00 0.03 0.00 0.00 46.19 47.66 3k5f s LEU 27 CO 0.31 -0.56 0.33 0.20 0.23 0.00 0.00 176.35 176.86 3k5f s ASN 28 N -1.51 6.32 -0.20 2.29 0.01 -1.26 -1.04 114.94 119.55 3k5f s ASN 28 Ca -0.10 0.37 -0.01 0.00 -0.71 0.00 0.00 52.86 52.40 3k5f s ASN 28 Cb -0.03 -2.19 0.01 0.00 0.41 0.00 0.00 41.25 39.45 3k5f s ASN 28 CO 0.04 -0.05 -0.12 -0.63 -1.51 0.00 0.00 177.10 174.82 3k5f s ILE 29 N 1.36 2.69 0.23 0.60 -1.09 0.19 -0.78 121.20 124.40 3k5f s ILE 29 Ca 0.15 -0.72 -0.31 0.00 -2.23 0.00 0.00 60.65 57.54 3k5f s ILE 29 Cb -0.15 -2.18 -0.10 0.00 -1.58 0.00 0.00 42.46 38.45 3k5f s ILE 29 CO 0.07 0.48 1.53 -0.22 -1.23 0.00 0.00 174.94 175.57 3k5f s LEU 30 N 1.37 4.37 -0.44 2.97 0.20 -0.70 -0.22 118.68 126.22 3k5f s LEU 30 Ca 0.05 2.73 -0.25 0.00 0.69 0.00 0.00 54.13 57.36 3k5f s LEU 30 Cb -0.14 -3.62 0.02 0.00 -0.43 0.00 0.00 46.19 42.03 3k5f s LEU 30 CO -0.08 -0.80 0.88 -0.69 -0.29 0.00 0.00 176.35 175.37 3k5f s VAL 31 N 0.38 4.55 -0.32 1.68 1.01 0.40 0.22 120.40 128.33 3k5f s VAL 31 Ca 0.64 0.74 0.03 0.00 0.00 0.00 0.00 61.98 63.39 3k5f s VAL 31 Cb -0.44 -4.38 0.09 0.00 0.00 0.00 0.00 36.38 31.65 3k5f s VAL 31 CO 0.40 -0.73 0.03 -0.62 0.00 0.00 0.00 175.10 174.18 3k5f s ASP 32 N 2.15 4.55 0.00 3.32 2.15 -0.34 -3.95 116.67 124.54 3k5f s ASP 32 Ca 0.35 -1.92 0.32 0.00 0.43 0.00 0.00 52.55 51.73 3k5f s ASP 32 Cb -0.11 -1.47 1.88 0.00 -0.30 0.00 0.00 42.92 42.92 3k5f s ASP 32 CO 0.24 -0.35 2.21 0.35 -0.17 0.00 0.00 175.17 177.44 3k5f n THR 33 N 4.39 0.00 1.31 1.71 -2.24 -1.26 -0.68 114.28 117.52 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 -0.51 0.38 0.00 -2.10 0.00 0.00 70.33 68.52 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 0.98 0.36 3.32 3.38 0.00 -1.26 -4.19 105.19 107.78 3k5f n GLY 34 Ca 0.24 -0.53 -0.17 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.98 1.14 0.00 1.61 1.04 -1.19 -4.96 113.70 109.37 3k5f s SER 35 Ca 0.35 -1.60 0.00 0.00 0.48 0.00 0.00 55.95 55.18 3k5f s SER 35 Cb 0.21 0.54 0.00 0.00 0.10 0.00 0.00 66.02 66.87 3k5f s SER 35 CO 0.32 -1.07 0.69 -1.20 0.98 0.00 0.00 173.24 172.97 3k5f n SER 36 N -1.21 0.85 -4.72 7.02 7.64 -1.26 0.19 113.62 122.13 3k5f n SER 36 Ca 0.05 -1.42 -0.35 0.00 1.01 0.00 0.00 58.87 58.16 3k5f n SER 36 Cb 0.63 0.00 -0.09 0.00 -1.01 0.00 0.00 64.21 63.74 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 -0.42 5.56 -0.33 6.43 -0.87 -1.26 -4.53 114.94 119.53 3k5f s ASN 37 Ca 0.00 0.21 -0.13 0.00 -1.57 0.00 0.00 52.86 51.37 3k5f s ASN 37 Cb 0.00 -1.69 -0.02 0.00 -0.02 0.00 0.00 41.25 39.51 3k5f s ASN 37 CO 0.00 0.35 0.24 0.12 -2.57 0.00 0.00 177.10 175.25 3k5f s PHE 38 N -0.72 3.23 0.01 2.20 5.99 -1.26 -1.34 117.98 126.09 3k5f s PHE 38 Ca 0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 56.93 56.93 3k5f s PHE 38 Cb -0.12 -2.48 -0.01 0.00 0.00 0.00 0.00 43.02 40.41 3k5f s PHE 38 CO 0.02 -0.33 -0.02 0.00 -0.00 0.00 0.00 175.22 174.90 3k5f s ALA 39 N 1.76 0.07 0.01 11.12 0.00 -0.66 -1.32 121.76 132.75 3k5f s ALA 39 Ca 0.07 -0.41 -0.00 0.00 0.00 0.00 0.00 51.96 51.62 3k5f s ALA 39 Cb -0.17 0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 3k5f s ALA 39 CO 0.11 -0.12 -0.01 0.14 0.00 0.00 0.00 175.76 175.88 3k5f s VAL 40 N -1.05 0.06 0.25 0.00 -7.23 -0.57 -0.34 120.40 111.52 3k5f s VAL 40 Ca -0.11 -0.49 -0.31 0.00 -1.81 0.00 0.00 61.98 59.25 3k5f s VAL 40 Cb -0.07 -0.15 -0.13 0.00 0.56 0.00 0.00 36.38 36.59 3k5f s VAL 40 CO -0.01 -0.27 1.54 0.61 -0.31 0.00 0.00 175.10 176.66 3k5f n GLY 41 N 2.27 1.13 0.22 2.32 0.00 0.15 -1.12 105.19 110.15 3k5f n GLY 41 Ca -0.19 0.52 0.04 0.00 0.00 0.00 0.00 46.02 46.40 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 2.45 2.02 -3.34 4.61 0.00 -0.45 -0.00 120.51 125.80 3k5f n ALA 42 Ca 0.12 -1.66 -0.15 0.00 0.00 0.00 0.00 53.44 51.74 3k5f n ALA 42 Cb 0.33 -0.35 -0.06 0.00 0.00 0.00 0.00 19.45 19.37 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 -1.35 -1.34 0.47 0.00 0.00 -1.22 -4.79 121.76 113.52 3k5f s ALA 43 Ca 0.14 0.73 -0.21 0.00 0.00 0.00 0.00 51.96 52.62 3k5f s ALA 43 Cb 0.12 0.23 -0.11 0.00 0.00 0.00 0.00 23.12 23.36 3k5f s ALA 43 CO 0.01 -0.43 0.65 -2.30 0.00 0.00 0.00 175.76 173.70 3k5f n PRO 44 N 0.69 0.72 -3.64 0.00 -0.02 -1.26 -4.95 135.00 126.54 3k5f n PRO 44 Ca -0.19 0.27 -0.10 0.00 -2.02 0.00 0.00 63.50 61.46 3k5f n PRO 44 Cb 0.59 -1.69 -0.07 0.00 -0.02 0.00 0.00 33.50 32.31 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 -1.50 -0.74 0.59 6.00 2.46 -1.26 -5.03 115.29 115.81 3k5f s HIS 45 Ca 0.65 1.69 0.33 0.00 0.47 0.00 0.00 55.06 58.20 3k5f s HIS 45 Cb -0.55 0.38 1.26 0.00 -0.13 0.00 0.00 32.58 33.54 3k5f s HIS 45 CO 0.56 -0.36 1.53 -1.35 -2.47 0.00 0.00 174.74 172.65 3k5f h PRO 46 N 5.32 0.00 -0.01 2.88 0.11 -2.01 0.13 132.00 138.42 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 0.10 0.00 -0.02 1.19 -0.21 0.00 0.00 178.00 179.06 3k5f n PHE 47 N -3.56 0.00 -3.25 0.65 0.99 -1.26 -4.97 117.46 106.06 3k5f n PHE 47 Ca 0.24 0.00 -0.40 0.00 -0.00 0.00 0.00 57.45 57.29 3k5f n PHE 47 Cb 1.41 0.00 -0.08 0.00 -1.00 0.00 0.00 39.48 39.81 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 -0.91 4.10 0.17 4.37 1.43 0.45 -4.57 118.68 123.72 3k5f s LEU 48 Ca 0.11 0.40 -0.06 0.00 -1.03 0.00 0.00 54.13 53.56 3k5f s LEU 48 Cb 0.08 -2.63 0.06 0.00 0.03 0.00 0.00 46.19 43.73 3k5f s LEU 48 CO 0.14 -0.31 1.48 0.45 0.23 0.00 0.00 176.35 178.34 3k5f h HIS 49 N 8.11 0.84 -3.58 0.29 3.86 -1.92 -3.43 115.15 119.32 3k5f h HIS 49 Ca -0.29 -0.29 -0.07 0.00 -1.16 0.00 0.00 60.37 58.56 3k5f h HIS 49 Cb 1.14 -0.16 -0.07 0.00 1.06 0.00 0.00 27.41 29.37 3k5f h HIS 49 CO 0.75 1.05 -0.05 -0.98 0.86 0.00 0.00 177.93 179.56 3k5f s ARG 50 N -4.09 1.70 0.22 2.45 1.70 -1.26 -5.14 118.95 114.53 3k5f s ARG 50 Ca -0.09 -1.32 -0.18 0.00 -0.47 0.00 0.00 55.73 53.68 3k5f s ARG 50 Cb 0.11 0.50 0.02 0.00 -0.57 0.00 0.00 34.95 35.01 3k5f s ARG 50 CO 0.86 -0.73 0.56 1.52 -1.08 0.00 0.00 175.30 176.42 3k5f s TYR 51 N -3.68 -0.07 -0.05 5.89 -0.85 -1.26 -4.89 117.35 112.44 3k5f s TYR 51 Ca 0.22 -0.29 -0.30 0.00 -0.52 0.00 0.00 57.07 56.18 3k5f s TYR 51 Cb -0.02 0.43 -0.04 0.00 0.38 0.00 0.00 41.96 42.71 3k5f s TYR 51 CO 0.11 -0.99 1.35 -0.47 -1.52 0.00 0.00 175.55 174.03 3k5f s TYR 52 N -3.90 2.87 -0.56 -3.49 5.04 1.00 -4.94 117.35 113.37 3k5f s TYR 52 Ca 0.11 0.90 -0.05 0.00 -2.44 0.00 0.00 57.07 55.59 3k5f s TYR 52 Cb -0.02 -3.59 0.14 0.00 0.35 0.00 0.00 41.96 38.84 3k5f s TYR 52 CO 0.00 -2.14 0.39 -0.65 -1.34 0.00 0.00 175.55 171.82 3k5f s GLN 53 N 2.68 2.49 0.30 4.97 -0.21 -1.26 -4.33 119.66 124.30 3k5f s GLN 53 Ca 0.61 -2.19 0.03 0.00 0.02 0.00 0.00 55.36 53.84 3k5f s GLN 53 Cb -0.28 -3.80 0.62 0.00 1.00 0.00 0.00 33.01 30.56 3k5f s GLN 53 CO 0.23 -1.16 1.85 0.00 -2.12 0.00 0.00 175.29 174.10 3k5f h ARG 54 N 7.65 0.89 -0.31 2.91 3.08 -1.94 -2.13 114.38 124.53 3k5f h ARG 54 Ca -0.07 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 59.96 3k5f h ARG 54 Cb 1.01 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.84 3k5f h ARG 54 CO 0.74 0.59 0.21 -0.56 -1.07 0.00 0.00 179.97 179.88 3k5f h GLN 55 N 0.92 0.27 -0.00 0.04 -0.00 -2.01 -1.74 115.11 112.59 3k5f h GLN 55 Ca 0.47 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 59.11 3k5f h GLN 55 Cb 0.52 -0.06 0.00 0.00 -0.00 0.00 0.00 27.48 27.94 3k5f h GLN 55 CO -0.24 0.18 -0.02 1.28 -0.00 0.00 0.00 178.83 180.03 3k5f n LEU 56 N -4.49 0.12 -4.50 0.06 4.77 -0.80 -4.77 117.00 107.39 3k5f n LEU 56 Ca 0.03 0.12 -0.35 0.00 -0.03 0.00 0.00 56.01 55.78 3k5f n LEU 56 Cb 0.18 -0.17 -0.12 0.00 -2.33 0.00 0.00 43.42 40.99 3k5f n LEU 56 CO 0.35 0.02 -0.30 -0.55 -1.33 0.00 0.00 177.39 175.58 3k5f s SER 57 N -2.35 5.12 0.29 -1.43 0.15 -0.66 -4.18 113.70 110.64 3k5f s SER 57 Ca 0.35 -0.12 0.24 0.00 0.70 0.00 0.00 55.95 57.13 3k5f s SER 57 Cb 0.21 -1.88 0.51 0.00 -1.71 0.00 0.00 66.02 63.15 3k5f s SER 57 CO 0.43 0.08 1.60 0.77 1.20 0.00 0.00 173.24 177.32 3k5f h SER 58 N 7.38 0.00 -0.02 5.45 4.64 -1.57 -3.17 113.55 126.26 3k5f h SER 58 Ca -0.36 -0.02 0.00 0.00 -0.47 0.00 0.00 61.79 60.94 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 -0.02 0.35 -0.87 0.00 0.00 176.83 176.93 3k5f n THR 59 N -2.60 0.00 -2.10 2.95 -2.24 -1.26 -4.95 114.28 104.08 3k5f n THR 59 Ca 0.04 -0.39 -0.41 0.00 -2.27 0.00 0.00 64.05 61.03 3k5f n THR 59 Cb 0.48 1.08 -0.02 0.00 -2.10 0.00 0.00 70.33 69.77 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 -2.03 3.04 -0.10 4.78 5.04 -1.20 -4.52 117.35 122.37 3k5f s TYR 60 Ca 0.32 1.34 -0.02 0.00 -2.44 0.00 0.00 57.07 56.27 3k5f s TYR 60 Cb 0.20 -3.70 0.03 0.00 0.35 0.00 0.00 41.96 38.84 3k5f s TYR 60 CO 0.33 -2.01 0.01 1.03 -1.34 0.00 0.00 175.55 173.57 3k5f s ARG 61 N -1.49 0.62 0.01 4.97 0.52 -0.13 -5.00 118.95 118.45 3k5f s ARG 61 Ca 0.51 -0.01 -0.30 0.00 -0.52 0.00 0.00 55.73 55.41 3k5f s ARG 61 Cb -0.40 -1.23 -0.04 0.00 0.52 0.00 0.00 34.95 33.80 3k5f s ARG 61 CO 0.51 -0.38 1.04 0.34 0.02 0.00 0.00 175.30 176.83 3k5f s ASP 62 N 1.95 7.29 0.00 0.23 2.15 -1.26 -0.48 116.67 126.54 3k5f s ASP 62 Ca 0.04 1.74 0.28 0.00 0.43 0.00 0.00 52.55 55.03 3k5f s ASP 62 Cb -0.13 -2.57 0.99 0.00 -0.30 0.00 0.00 42.92 40.90 3k5f s ASP 62 CO -0.06 -0.33 1.71 0.18 -0.17 0.00 0.00 175.17 176.50 3k5f n LEU 63 N 4.01 0.93 -3.90 -1.34 4.77 -0.47 -4.94 117.00 116.06 3k5f n LEU 63 Ca 0.07 -0.23 -0.25 0.00 -0.03 0.00 0.00 56.01 55.58 3k5f n LEU 63 Cb 0.50 -0.11 -0.01 0.00 -2.33 0.00 0.00 43.42 41.47 3k5f n LEU 63 CO 0.53 0.17 -0.18 0.54 -1.33 0.00 0.00 177.39 177.12 3k5f n ARG 64 N -0.58 -3.74 -3.70 3.23 1.74 -1.25 -4.97 116.66 107.39 3k5f n ARG 64 Ca 0.15 0.46 -0.11 0.00 -0.77 0.00 0.00 57.85 57.58 3k5f n ARG 64 Cb 0.32 -4.73 -0.11 0.00 -1.02 0.00 0.00 32.46 26.93 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 -6.43 0.42 0.78 5.56 2.20 -1.26 -5.05 119.74 115.96 3k5f s LYS 65 Ca 0.04 0.76 -0.12 0.00 -0.36 0.00 0.00 55.97 56.30 3k5f s LYS 65 Cb -0.02 0.03 0.06 0.00 -1.51 0.00 0.00 37.83 36.40 3k5f s LYS 65 CO 0.87 -0.14 1.15 0.20 -0.36 0.00 0.00 175.35 177.07 3k5f s GLY 66 N 1.17 1.60 -0.13 5.54 0.00 -1.26 -0.65 107.32 113.59 3k5f s GLY 66 Ca -0.08 -0.60 -0.18 0.00 0.00 0.00 0.00 44.72 43.86 3k5f s GLY 66 CO -0.10 -0.14 0.48 0.54 0.00 0.00 0.00 173.10 173.87 3k5f s VAL 67 N -3.51 0.01 -0.03 1.40 0.11 0.06 -4.74 120.40 113.70 3k5f s VAL 67 Ca 0.61 -0.10 0.02 0.00 -2.93 0.00 0.00 61.98 59.59 3k5f s VAL 67 Cb -0.11 -0.71 0.00 0.00 -1.53 0.00 0.00 36.38 34.04 3k5f s VAL 67 CO 0.49 -0.05 -0.09 -0.47 -3.33 0.00 0.00 175.10 171.65 3k5f s TYR 68 N -0.24 0.93 -0.05 1.54 5.04 -1.26 -0.51 117.35 122.81 3k5f s TYR 68 Ca -0.04 -0.24 -0.02 0.00 -2.44 0.00 0.00 57.07 54.33 3k5f s TYR 68 Cb -0.03 -0.68 0.03 0.00 0.35 0.00 0.00 41.96 41.63 3k5f s TYR 68 CO 0.03 -0.11 0.05 0.08 -1.34 0.00 0.00 175.55 174.25 3k5f s VAL 69 N 0.25 0.01 -0.14 3.14 1.01 -0.20 -4.83 120.40 119.64 3k5f s VAL 69 Ca -0.04 0.35 -0.04 0.00 0.00 0.00 0.00 61.98 62.25 3k5f s VAL 69 Cb -0.09 -0.24 -0.03 0.00 0.00 0.00 0.00 36.38 36.02 3k5f s VAL 69 CO 0.01 0.20 -0.01 -2.16 0.00 0.00 0.00 175.10 173.14 3k5f s PRO 70 N 2.10 3.50 0.48 2.72 0.04 -1.26 -1.69 135.00 140.89 3k5f s PRO 70 Ca 0.05 -0.45 0.06 0.00 0.04 0.00 0.00 61.00 60.70 3k5f s PRO 70 Cb -0.12 -2.93 0.00 0.00 0.04 0.00 0.00 34.50 31.49 3k5f s PRO 70 CO -0.04 0.40 0.33 0.71 0.04 0.00 0.00 177.00 178.44 3k5f s TYR 71 N -0.04 2.13 0.37 0.56 2.02 -0.27 -4.99 117.35 117.13 3k5f s TYR 71 Ca 0.03 -0.70 0.14 0.00 -0.37 0.00 0.00 57.07 56.17 3k5f s TYR 71 Cb -0.13 -1.98 0.99 0.00 -0.40 0.00 0.00 41.96 40.45 3k5f s TYR 71 CO 0.02 -0.20 1.78 1.15 -1.57 0.00 0.00 175.55 176.73 3k5f h THR 72 N 1.00 0.59 -3.20 -0.71 2.02 -2.00 -3.37 112.91 107.25 3k5f h THR 72 Ca -0.40 -0.17 -0.29 0.00 0.77 0.00 0.00 66.41 66.32 3k5f h THR 72 Cb 1.28 0.05 -0.35 0.00 -1.74 0.00 0.00 68.15 67.39 3k5f h THR 72 CO 0.61 0.09 -0.65 -1.58 0.37 0.00 0.00 175.52 174.37 3k5f s GLN 73 N -5.59 0.03 0.00 6.66 0.74 -1.26 -5.11 119.66 115.13 3k5f s GLN 73 Ca -0.09 0.45 0.00 0.00 0.05 0.00 0.00 55.36 55.76 3k5f s GLN 73 Cb 0.25 -0.27 0.00 0.00 1.10 0.00 0.00 33.01 34.09 3k5f s GLN 73 CO 0.80 -0.25 0.00 0.41 -0.55 0.00 0.00 175.29 175.69 3k5f n GLY 74 N 4.87 1.43 3.51 2.59 0.00 -1.26 -4.87 105.19 111.47 3k5f n GLY 74 Ca -0.13 -1.84 -0.08 0.00 0.00 0.00 0.00 46.02 43.97 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 -2.92 0.84 0.24 1.61 -2.85 -0.80 -1.12 119.74 114.74 3k5f s LYS 75 Ca 0.00 -0.31 -0.16 0.00 -1.00 0.00 0.00 55.97 54.49 3k5f s LYS 75 Cb 0.00 0.38 0.01 0.00 -2.06 0.00 0.00 37.83 36.16 3k5f s LYS 75 CO 0.00 -0.37 0.55 1.67 0.10 0.00 0.00 175.35 177.30 3k5f s TRP 76 N -3.13 0.08 0.06 1.78 1.48 -0.68 -0.98 118.94 117.53 3k5f s TRP 76 Ca 0.05 -0.46 -0.04 0.00 -1.06 0.00 0.00 56.10 54.59 3k5f s TRP 76 Cb -0.01 0.38 -0.02 0.00 -1.16 0.00 0.00 33.47 32.66 3k5f s TRP 76 CO -0.09 -1.03 0.05 -1.83 -4.06 0.00 0.00 176.95 170.00 3k5f s GLU 77 N -3.95 0.65 0.00 3.25 -1.05 0.08 -1.04 118.70 116.64 3k5f s GLU 77 Ca 0.15 -1.02 0.00 0.00 -0.15 0.00 0.00 54.97 53.96 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 0.05 -0.16 0.00 0.41 0.95 0.00 0.00 175.26 176.51 3k5f n GLY 78 N 0.29 1.08 3.45 -3.83 0.00 0.34 -1.68 105.19 104.84 3k5f n GLY 78 Ca -0.16 -0.70 -0.33 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.01 3.34 0.39 1.61 2.56 -0.73 -0.76 118.70 125.10 3k5f s GLU 79 Ca 0.00 -0.61 -0.19 0.00 0.00 0.00 0.00 54.97 54.16 3k5f s GLU 79 Cb 0.00 -2.70 -0.10 0.00 2.00 0.00 0.00 34.13 33.33 3k5f s GLU 79 CO 0.00 0.31 0.88 -0.51 -0.56 0.00 0.00 175.26 175.38 3k5f s LEU 80 N 0.12 4.01 0.07 2.70 1.43 0.17 -0.84 118.68 126.35 3k5f s LEU 80 Ca -0.04 1.56 -0.26 0.00 -1.03 0.00 0.00 54.13 54.36 3k5f s LEU 80 Cb -0.14 -4.35 0.09 0.00 0.03 0.00 0.00 46.19 41.82 3k5f s LEU 80 CO 0.04 -0.29 1.17 -0.83 0.23 0.00 0.00 176.35 176.67 3k5f s GLY 81 N -2.17 -0.09 0.17 -3.19 0.00 -0.80 -1.37 107.32 99.87 3k5f s GLY 81 Ca 0.58 0.01 0.08 0.00 0.00 0.00 0.00 44.72 45.40 3k5f s GLY 81 CO 0.15 3.02 -0.16 -0.51 0.00 0.00 0.00 173.10 175.60 3k5f s THR 82 N -2.25 1.69 0.16 0.90 -4.23 0.37 0.11 115.64 112.39 3k5f s THR 82 Ca 0.23 -2.00 -0.24 0.00 -1.18 0.00 0.00 61.69 58.49 3k5f s THR 82 Cb -0.00 -1.86 0.06 0.00 1.34 0.00 0.00 72.50 72.04 3k5f s THR 82 CO 0.01 -0.45 0.96 -0.62 -0.54 0.00 0.00 174.62 173.99 3k5f s ASP 83 N -2.88 -0.15 0.06 3.99 -1.08 -1.04 -0.96 116.67 114.61 3k5f s ASP 83 Ca 0.17 -0.46 -0.27 0.00 -0.52 0.00 0.00 52.55 51.48 3k5f s ASP 83 Cb -0.04 0.50 -0.05 0.00 -1.46 0.00 0.00 42.92 41.87 3k5f s ASP 83 CO 0.06 -0.93 0.83 -0.76 0.52 0.00 0.00 175.17 174.89 3k5f s LEU 84 N -3.00 4.45 0.02 -1.34 1.43 -1.26 -1.72 118.68 117.26 3k5f s LEU 84 Ca 0.13 1.55 0.05 0.00 -1.03 0.00 0.00 54.13 54.84 3k5f s LEU 84 Cb -0.02 -3.35 -0.02 0.00 0.03 0.00 0.00 46.19 42.83 3k5f s LEU 84 CO 0.03 -0.03 -0.15 -0.69 0.23 0.00 0.00 176.35 175.74 3k5f s VAL 85 N 0.06 1.18 0.05 -1.59 1.01 0.61 -0.93 120.40 120.79 3k5f s VAL 85 Ca 0.42 -0.83 -0.01 0.00 0.00 0.00 0.00 61.98 61.55 3k5f s VAL 85 Cb -0.21 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 3k5f s VAL 85 CO 0.25 0.18 -0.03 -0.44 0.00 0.00 0.00 175.10 175.06 3k5f s SER 86 N -0.76 0.48 -0.37 3.32 0.01 -0.24 -2.05 113.70 114.09 3k5f s SER 86 Ca 0.04 -1.01 0.02 0.00 1.31 0.00 0.00 55.95 56.32 3k5f s SER 86 Cb -0.07 0.20 0.11 0.00 0.21 0.00 0.00 66.02 66.48 3k5f s SER 86 CO 0.00 -0.60 0.13 -0.63 0.41 0.00 0.00 173.24 172.55 3k5f s ILE 87 N -3.92 1.79 0.22 1.44 1.01 -1.26 -0.91 121.20 119.56 3k5f s ILE 87 Ca 0.07 -2.26 -0.18 0.00 0.00 0.00 0.00 60.65 58.28 3k5f s ILE 87 Cb 0.08 -2.30 0.21 0.00 0.01 0.00 0.00 42.46 40.46 3k5f s ILE 87 CO -0.10 -0.70 1.56 -0.65 0.00 0.00 0.00 174.94 175.06 3k5f h PRO 88 N 7.44 -0.04 -1.54 2.79 0.11 -1.90 -0.63 132.00 138.22 3k5f h PRO 88 Ca -0.07 0.00 -0.71 0.00 0.11 0.00 0.00 66.00 65.34 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 0.53 -0.03 0.94 0.72 -0.21 0.00 0.00 178.00 179.95 3k5f n HIS 89 N -5.47 3.00 -2.05 0.65 8.25 -1.26 -4.89 115.22 113.44 3k5f n HIS 89 Ca 0.09 -2.61 0.00 0.00 -0.26 0.00 0.00 57.72 54.93 3k5f n HIS 89 Cb 0.39 -1.31 0.00 0.00 1.12 0.00 0.00 29.99 30.19 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 -0.63 5.06 3.76 -1.41 0.00 -0.24 -4.31 105.19 107.42 3k5f n GLY 90 Ca 0.57 -1.10 -0.41 0.00 0.00 0.00 0.00 46.02 45.08 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 2.59 -1.90 1.61 -0.02 -1.26 -4.85 135.00 131.17 3k5f n PRO 91 Ca 0.00 0.91 -0.42 0.00 -2.02 0.00 0.00 63.50 61.97 3k5f n PRO 91 Cb 0.00 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 30.86 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 0.54 4.12 -4.09 2.55 5.15 -1.26 -4.59 115.26 117.68 3k5f n ASN 92 Ca 0.02 -2.88 -0.10 0.00 -0.60 0.00 0.00 54.58 51.02 3k5f n ASN 92 Cb 0.38 -1.65 -0.08 0.00 -0.53 0.00 0.00 39.78 37.91 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 3.01 0.01 -0.01 3.44 -7.23 -1.26 -5.16 120.40 113.19 3k5f s VAL 93 Ca 0.47 -1.69 0.00 0.00 -1.81 0.00 0.00 61.98 58.96 3k5f s VAL 93 Cb 0.12 -2.30 0.02 0.00 0.56 0.00 0.00 36.38 34.77 3k5f s VAL 93 CO -0.06 -0.03 0.00 -0.89 -0.31 0.00 0.00 175.10 173.81 3k5f s THR 94 N -4.08 0.07 0.04 5.32 2.01 -1.26 -4.46 115.64 113.28 3k5f s THR 94 Ca 0.30 0.07 -0.02 0.00 0.31 0.00 0.00 61.69 62.34 3k5f s THR 94 Cb 0.03 -0.14 -0.02 0.00 0.01 0.00 0.00 72.50 72.38 3k5f s THR 94 CO 0.09 0.08 0.02 0.68 -0.69 0.00 0.00 174.62 174.80 3k5f s VAL 95 N 0.61 0.15 -0.20 3.82 -7.23 -0.87 -4.95 120.40 111.72 3k5f s VAL 95 Ca -0.05 -1.24 -0.18 0.00 -1.81 0.00 0.00 61.98 58.69 3k5f s VAL 95 Cb -0.08 -0.87 -0.03 0.00 0.56 0.00 0.00 36.38 35.96 3k5f s VAL 95 CO -0.01 -0.69 0.52 -0.60 -0.31 0.00 0.00 175.10 174.01 3k5f s ARG 96 N -2.61 4.18 0.19 4.82 3.52 -1.26 -0.28 118.95 127.50 3k5f s ARG 96 Ca -0.05 0.41 0.02 0.00 -0.13 0.00 0.00 55.73 55.97 3k5f s ARG 96 Cb -0.01 -3.57 -0.05 0.00 -1.56 0.00 0.00 34.95 29.76 3k5f s ARG 96 CO -0.05 -0.16 0.02 0.00 -0.81 0.00 0.00 175.30 174.30 3k5f s ALA 97 N 1.69 1.40 0.40 6.12 0.00 -0.70 -4.93 121.76 125.74 3k5f s ALA 97 Ca 0.24 -1.64 -0.25 0.00 0.00 0.00 0.00 51.96 50.32 3k5f s ALA 97 Cb -0.15 0.65 -0.08 0.00 0.00 0.00 0.00 23.12 23.53 3k5f s ALA 97 CO 0.09 -0.35 1.11 -0.80 0.00 0.00 0.00 175.76 175.82 3k5f s ASN 98 N -3.19 6.60 -0.05 0.00 0.01 -1.26 -2.49 114.94 114.56 3k5f s ASN 98 Ca 0.26 2.21 -0.02 0.00 -0.71 0.00 0.00 52.86 54.60 3k5f s ASN 98 Cb 0.06 -2.60 0.04 0.00 0.41 0.00 0.00 41.25 39.16 3k5f s ASN 98 CO 0.06 -0.61 0.10 -0.63 -1.51 0.00 0.00 177.10 174.50 3k5f s ILE 99 N -1.52 -0.09 -0.31 0.60 1.01 0.12 -4.71 121.20 116.30 3k5f s ILE 99 Ca 0.58 0.25 -0.16 0.00 0.00 0.00 0.00 60.65 61.31 3k5f s ILE 99 Cb -0.27 -0.18 -0.02 0.00 0.01 0.00 0.00 42.46 42.00 3k5f s ILE 99 CO 0.33 0.10 0.44 0.00 0.00 0.00 0.00 174.94 175.81 3k5f s ALA 100 N 1.41 3.52 -0.62 9.38 0.00 -0.43 -1.91 121.76 133.12 3k5f s ALA 100 Ca -0.06 -0.93 -0.23 0.00 0.00 0.00 0.00 51.96 50.73 3k5f s ALA 100 Cb -0.12 -2.86 0.05 0.00 0.00 0.00 0.00 23.12 20.20 3k5f s ALA 100 CO -0.05 -0.94 0.97 0.00 0.00 0.00 0.00 175.76 175.75 3k5f s ALA 101 N 2.20 3.11 -0.20 0.00 0.00 -0.02 -1.51 121.76 125.34 3k5f s ALA 101 Ca 0.16 -1.55 -0.29 0.00 0.00 0.00 0.00 51.96 50.28 3k5f s ALA 101 Cb -0.16 -3.82 -0.03 0.00 0.00 0.00 0.00 23.12 19.11 3k5f s ALA 101 CO 0.11 -2.63 1.69 0.42 0.00 0.00 0.00 175.76 175.36 3k5f s ILE 102 N 4.10 3.59 -0.05 0.00 1.01 -0.28 -1.77 121.20 127.80 3k5f s ILE 102 Ca 0.26 0.66 0.21 0.00 0.00 0.00 0.00 60.65 61.78 3k5f s ILE 102 Cb -0.14 -3.60 -0.31 0.00 0.01 0.00 0.00 42.46 38.41 3k5f s ILE 102 CO 0.14 -0.25 0.40 0.35 0.00 0.00 0.00 174.94 175.59 3k5f n THR 103 N 6.47 0.19 -3.70 2.92 -2.24 -0.67 -1.34 114.28 115.92 3k5f n THR 103 Ca 0.20 -0.53 -0.14 0.00 -2.27 0.00 0.00 64.05 61.31 3k5f n THR 103 Cb 0.45 -0.05 -0.09 0.00 -2.10 0.00 0.00 70.33 68.54 3k5f n THR 103 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 3k5f s GLU 104 N -3.32 0.65 0.19 -0.78 2.12 -1.10 -4.87 118.70 111.59 3k5f s GLU 104 Ca -0.08 0.42 -0.12 0.00 0.36 0.00 0.00 54.97 55.54 3k5f s GLU 104 Cb 0.12 0.31 0.00 0.00 0.26 0.00 0.00 34.13 34.83 3k5f s GLU 104 CO 0.86 -0.13 0.39 -1.54 -0.54 0.00 0.00 175.26 174.30 3k5f s SER 105 N -0.30 -0.07 -0.08 -1.70 1.04 -1.26 -0.74 113.70 110.58 3k5f s SER 105 Ca -0.05 -0.75 -0.03 0.00 0.48 0.00 0.00 55.95 55.60 3k5f s SER 105 Cb -0.03 0.50 0.05 0.00 0.10 0.00 0.00 66.02 66.63 3k5f s SER 105 CO 0.03 -0.98 0.17 -0.62 0.98 0.00 0.00 173.24 172.82 3k5f s ASP 106 N -2.94 0.35 -1.04 7.02 3.68 -0.15 -4.87 116.67 118.72 3k5f s ASP 106 Ca 0.15 0.36 -0.03 0.00 2.13 0.00 0.00 52.55 55.17 3k5f s ASP 106 Cb 0.01 0.30 0.02 0.00 -1.45 0.00 0.00 42.92 41.80 3k5f s ASP 106 CO 0.00 -0.21 0.15 0.29 0.13 0.00 0.00 175.17 175.54 3k5f n LYS 107 N 4.88 -2.69 -0.01 4.34 5.02 -1.26 -1.90 118.16 126.55 3k5f n LYS 107 Ca -0.13 0.51 -0.01 0.00 -2.02 0.00 0.00 58.31 56.66 3k5f n LYS 107 Cb 0.51 -5.14 -0.00 0.00 -0.02 0.00 0.00 35.03 30.37 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 -3.49 0.00 -2.01 2.13 7.35 -1.26 -3.99 117.46 116.19 3k5f n PHE 108 Ca -0.09 0.00 -0.42 0.00 -0.76 0.00 0.00 57.45 56.18 3k5f n PHE 108 Cb 0.58 -0.06 -0.03 0.00 0.35 0.00 0.00 39.48 40.32 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 -1.25 3.07 -0.13 -5.13 0.40 -1.26 -4.99 117.98 108.69 3k5f s PHE 109 Ca -0.04 0.88 -0.12 0.00 -0.60 0.00 0.00 56.93 57.06 3k5f s PHE 109 Cb 0.00 -3.83 -0.05 0.00 0.51 0.00 0.00 43.02 39.65 3k5f s PHE 109 CO 0.05 -2.87 0.25 0.42 0.70 0.00 0.00 175.22 173.77 3k5f s ILE 110 N 0.54 5.32 -0.25 0.64 1.01 -1.26 -4.95 121.20 122.25 3k5f s ILE 110 Ca 0.64 0.46 -0.28 0.00 0.00 0.00 0.00 60.65 61.47 3k5f s ILE 110 Cb -0.42 -3.57 -0.04 0.00 0.01 0.00 0.00 42.46 38.44 3k5f s ILE 110 CO 0.37 0.47 2.07 0.21 0.00 0.00 0.00 174.94 178.07 3k5f s ASN 111 N -0.09 5.61 0.00 3.58 2.47 -1.26 -2.31 114.94 122.94 3k5f s ASN 111 Ca 0.16 1.70 0.00 0.00 0.42 0.00 0.00 52.86 55.13 3k5f s ASN 111 Cb -0.13 -2.52 0.00 0.00 -1.45 0.00 0.00 41.25 37.15 3k5f s ASN 111 CO 0.04 -1.87 0.00 0.61 -3.72 0.00 0.00 177.10 172.16 3k5f n GLY 112 N 5.64 0.81 0.08 1.21 0.00 -1.26 -4.98 105.19 106.69 3k5f n GLY 112 Ca 0.27 -0.65 -0.08 0.00 0.00 0.00 0.00 46.02 45.56 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 1.45 0.82 0.00 1.61 3.41 -0.98 -4.98 113.62 114.95 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 0.42 0.01 0.00 0.00 -0.26 0.00 0.00 64.21 64.38 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 -3.02 0.00 -4.64 4.04 4.05 -1.26 -4.64 115.26 109.78 3k5f n ASN 114 Ca -0.18 0.00 -0.31 0.00 0.45 0.00 0.00 54.58 54.54 3k5f n ASN 114 Cb 1.05 0.00 -0.09 0.00 1.23 0.00 0.00 39.78 41.97 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 -3.05 2.93 -0.00 1.20 1.48 -1.26 -4.57 118.94 115.66 3k5f s TRP 115 Ca 0.00 -0.03 0.01 0.00 -1.06 0.00 0.00 56.10 55.01 3k5f s TRP 115 Cb 0.00 -1.56 0.01 0.00 -1.16 0.00 0.00 33.47 30.76 3k5f s TRP 115 CO 0.00 0.44 1.00 0.39 -4.06 0.00 0.00 176.95 174.72 3k5f n GLU 116 N 1.01 2.93 -3.09 3.25 4.71 0.04 -4.89 120.64 124.60 3k5f n GLU 116 Ca -0.13 -1.54 -0.07 0.00 -0.01 0.00 0.00 57.16 55.41 3k5f n GLU 116 Cb 0.52 -1.02 0.02 0.00 -1.01 0.00 0.00 31.44 29.95 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 -0.53 1.39 3.00 0.62 0.00 -1.11 -0.67 105.19 107.87 3k5f n GLY 117 Ca 0.01 -1.24 -0.12 0.00 0.00 0.00 0.00 46.02 44.67 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 -2.38 0.01 -0.35 -0.61 2.07 0.54 -1.73 121.20 118.75 3k5f s ILE 118 Ca 0.13 -0.12 0.00 0.00 -1.41 0.00 0.00 60.65 59.26 3k5f s ILE 118 Cb -0.03 -0.19 0.09 0.00 0.13 0.00 0.00 42.46 42.46 3k5f s ILE 118 CO 0.10 -0.07 0.08 -0.22 -1.91 0.00 0.00 174.94 172.92 3k5f s LEU 119 N -0.17 4.67 -0.29 8.50 2.96 0.13 -1.65 118.68 132.83 3k5f s LEU 119 Ca -0.02 -1.89 -0.29 0.00 -0.22 0.00 0.00 54.13 51.70 3k5f s LEU 119 Cb -0.02 -1.71 0.00 0.00 0.50 0.00 0.00 46.19 44.97 3k5f s LEU 119 CO 0.00 -0.40 1.23 -0.83 -1.32 0.00 0.00 176.35 175.03 3k5f s GLY 120 N 1.31 1.46 0.00 7.98 0.00 -0.45 -1.20 107.32 116.42 3k5f s GLY 120 Ca 0.05 0.09 0.24 0.00 0.00 0.00 0.00 44.72 45.10 3k5f s GLY 120 CO -0.05 2.49 1.39 1.04 0.00 0.00 0.00 173.10 177.97 3k5f n LEU 121 N 7.31 3.07 0.00 0.66 4.77 0.15 -4.26 117.00 128.69 3k5f n LEU 121 Ca 0.14 -1.22 -0.08 0.00 -0.03 0.00 0.00 56.01 54.81 3k5f n LEU 121 Cb 0.47 -0.15 0.06 0.00 -2.33 0.00 0.00 43.42 41.46 3k5f n LEU 121 CO 0.61 0.61 0.25 0.00 -1.33 0.00 0.00 177.39 177.53 3k5f n ALA 122 N 1.28 -0.40 -2.03 -1.18 0.00 0.13 -4.95 120.51 113.36 3k5f n ALA 122 Ca 0.17 -0.51 -0.30 0.00 0.00 0.00 0.00 53.44 52.81 3k5f n ALA 122 Cb 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 -1.73 3.58 0.49 0.00 1.51 -0.57 -4.64 117.35 115.99 3k5f s TYR 123 Ca 0.22 1.12 0.23 0.00 -1.01 0.00 0.00 57.07 57.63 3k5f s TYR 123 Cb -0.01 -2.56 1.28 0.00 -0.11 0.00 0.00 41.96 40.57 3k5f s TYR 123 CO 0.15 -0.48 1.93 0.00 -1.11 0.00 0.00 175.55 176.04 3k5f h ALA 124 N 0.06 2.44 -1.06 3.71 0.00 -1.88 -2.43 119.26 120.09 3k5f h ALA 124 Ca -0.45 -0.01 0.31 0.00 0.00 0.00 0.00 54.91 54.75 3k5f h ALA 124 Cb 1.19 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.87 3k5f h ALA 124 CO 0.62 -0.65 0.65 1.49 0.00 0.00 0.00 179.25 181.36 3k5f h GLU 125 N 0.17 0.35 -0.46 0.00 4.81 -1.85 0.65 114.58 118.25 3k5f h GLU 125 Ca 0.36 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.57 3k5f h GLU 125 Cb 1.16 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.46 3k5f h GLU 125 CO -0.06 0.23 0.00 0.44 -0.73 0.00 0.00 179.01 178.89 3k5f n ILE 126 N -4.84 1.90 -2.39 2.32 -5.35 -0.91 -4.59 119.36 105.50 3k5f n ILE 126 Ca 0.30 -1.39 -0.33 0.00 -0.27 0.00 0.00 62.75 61.06 3k5f n ILE 126 Cb 0.98 0.05 -0.02 0.00 -1.74 0.00 0.00 39.64 38.90 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 -2.07 2.86 0.06 -1.28 0.00 0.22 -4.64 121.76 116.91 3k5f s ALA 127 Ca 0.43 0.49 0.04 0.00 0.00 0.00 0.00 51.96 52.93 3k5f s ALA 127 Cb 0.30 -3.23 -0.04 0.00 0.00 0.00 0.00 23.12 20.15 3k5f s ALA 127 CO 0.17 -0.44 -0.03 1.03 0.00 0.00 0.00 175.76 176.49 3k5f s ARG 128 N -3.57 2.51 0.48 0.00 1.81 -1.26 -2.93 118.95 115.99 3k5f s ARG 128 Ca 0.65 -0.81 0.27 0.00 -1.72 0.00 0.00 55.73 54.12 3k5f s ARG 128 Cb -0.15 -2.51 1.03 0.00 -0.45 0.00 0.00 34.95 32.87 3k5f s ARG 128 CO 0.26 0.56 1.86 -1.00 -0.68 0.00 0.00 175.30 176.30 3k5f h PRO 129 N 3.82 0.00 -3.26 3.54 0.13 -1.88 -3.47 132.00 130.89 3k5f h PRO 129 Ca -0.48 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.58 3k5f h PRO 129 Cb 1.17 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.28 3k5f h PRO 129 CO 0.57 0.13 0.16 0.16 -0.23 0.00 0.00 178.00 178.79 3k5f s ASP 130 N -6.02 0.19 0.00 1.44 1.47 -1.15 -5.03 116.67 107.58 3k5f s ASP 130 Ca 0.01 -1.18 0.08 0.00 1.18 0.00 0.00 52.55 52.64 3k5f s ASP 130 Cb 0.09 0.80 0.48 0.00 -0.34 0.00 0.00 42.92 43.95 3k5f s ASP 130 CO 0.61 -1.57 0.94 -0.90 0.68 0.00 0.00 175.17 174.92 3k5f n ASP 131 N -1.33 0.00 0.04 2.11 5.68 -1.25 -2.40 116.55 119.41 3k5f n ASP 131 Ca -0.06 -0.76 0.12 0.00 -0.50 0.00 0.00 54.79 53.59 3k5f n ASP 131 Cb 0.60 0.00 0.25 0.00 -1.14 0.00 0.00 41.12 40.83 3k5f n ASP 131 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3k5f n SER 132 N -0.75 0.60 -4.50 -1.12 3.41 -1.26 -4.61 113.62 105.39 3k5f n SER 132 Ca 0.06 0.11 -0.42 0.00 -0.26 0.00 0.00 58.87 58.36 3k5f n SER 132 Cb 0.03 0.03 -0.03 0.00 -0.26 0.00 0.00 64.21 63.98 3k5f n SER 132 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3k5f s LEU 133 N -3.85 4.19 0.04 1.04 2.96 -1.01 -4.99 118.68 117.06 3k5f s LEU 133 Ca 0.08 -1.50 -0.36 0.00 -0.22 0.00 0.00 54.13 52.13 3k5f s LEU 133 Cb 0.15 -2.48 -0.15 0.00 0.50 0.00 0.00 46.19 44.20 3k5f s LEU 133 CO 0.69 -1.36 1.52 1.21 -1.32 0.00 0.00 176.35 177.08 3k5f n GLU 134 N 7.87 1.52 -1.31 1.98 2.13 -1.26 -4.89 120.64 126.68 3k5f n GLU 134 Ca 0.21 0.55 -0.31 0.00 0.66 0.00 0.00 57.16 58.27 3k5f n GLU 134 Cb 0.49 -2.26 0.09 0.00 0.27 0.00 0.00 31.44 30.04 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 1.38 2.22 0.14 5.31 0.02 -1.26 -4.53 135.00 138.28 3k5f s PRO 135 Ca 0.86 1.07 -0.20 0.00 0.02 0.00 0.00 61.00 62.75 3k5f s PRO 135 Cb -0.87 -1.90 0.02 0.00 0.02 0.00 0.00 34.50 31.77 3k5f s PRO 135 CO 0.47 -1.64 1.68 0.35 -0.33 0.00 0.00 177.00 177.53 3k5f h PHE 136 N -1.12 -0.26 -0.39 6.54 3.57 -1.81 -2.43 116.94 121.05 3k5f h PHE 136 Ca -0.44 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.06 3k5f h PHE 136 Cb 1.24 0.15 -0.02 0.00 2.79 0.00 0.00 35.95 40.11 3k5f h PHE 136 CO 0.56 -0.17 0.15 0.35 -2.23 0.00 0.00 178.31 176.97 3k5f h PHE 137 N -0.07 0.54 -0.52 0.41 3.57 -1.93 -0.77 116.94 118.17 3k5f h PHE 137 Ca 0.14 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.56 3k5f h PHE 137 Cb 0.27 -0.17 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 3k5f h PHE 137 CO -0.30 0.43 0.09 -0.44 -2.23 0.00 0.00 178.31 175.86 3k5f h ASP 138 N 0.55 0.82 -0.66 0.41 3.32 -1.85 -1.55 116.42 117.46 3k5f h ASP 138 Ca 0.14 -0.26 -0.03 0.00 0.02 0.00 0.00 57.03 56.90 3k5f h ASP 138 Cb 0.11 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.42 3k5f h ASP 138 CO -0.01 0.87 0.30 0.28 -1.72 0.00 0.00 179.24 178.95 3k5f h SER 139 N 0.74 0.88 0.35 6.45 0.02 -0.86 -1.57 113.55 119.56 3k5f h SER 139 Ca 0.16 -0.15 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 3k5f h SER 139 Cb 0.39 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 62.70 3k5f h SER 139 CO 0.01 0.78 -0.21 0.25 -1.14 0.00 0.00 176.83 176.53 3k5f h LEU 140 N 0.92 -0.51 -0.92 5.07 5.85 -0.94 0.36 115.31 125.14 3k5f h LEU 140 Ca 0.22 0.03 0.02 0.00 0.84 0.00 0.00 57.88 59.00 3k5f h LEU 140 Cb 0.15 0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.28 3k5f h LEU 140 CO -0.02 -0.33 0.61 0.58 -0.34 0.00 0.00 178.44 178.93 3k5f h VAL 141 N -0.53 1.19 -0.04 1.05 2.07 -1.19 -0.42 116.25 118.37 3k5f h VAL 141 Ca -0.04 -0.41 -0.20 0.00 0.82 0.00 0.00 66.70 66.87 3k5f h VAL 141 Cb 0.43 -0.12 -0.00 0.00 -1.52 0.00 0.00 31.29 30.08 3k5f h VAL 141 CO 0.05 0.22 -0.81 0.50 0.02 0.00 0.00 177.57 177.55 3k5f h LYS 142 N 1.20 0.36 0.00 1.57 3.64 -1.13 -3.28 116.57 118.93 3k5f h LYS 142 Ca 0.36 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 3k5f h LYS 142 Cb -0.06 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 3k5f h LYS 142 CO -0.10 0.99 -0.48 1.04 -2.27 0.00 0.00 179.45 178.63 3k5f n GLN 143 N -3.78 0.20 -2.46 1.90 6.02 0.10 -4.95 117.38 114.42 3k5f n GLN 143 Ca -0.05 0.07 -0.05 0.00 -0.01 0.00 0.00 57.00 56.97 3k5f n GLN 143 Cb 0.75 -1.64 -0.01 0.00 1.02 0.00 0.00 30.24 30.36 3k5f n GLN 143 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3k5f n THR 144 N -1.95 0.00 -0.37 5.09 -2.24 -0.19 -5.04 114.28 109.58 3k5f n THR 144 Ca 0.04 -0.45 0.11 0.00 -2.27 0.00 0.00 64.05 61.48 3k5f n THR 144 Cb 0.41 0.16 0.31 0.00 -2.10 0.00 0.00 70.33 69.10 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 -0.18 0.96 -1.81 4.78 8.25 -1.26 -4.78 115.22 121.18 3k5f n HIS 145 Ca -0.01 -0.51 -0.42 0.00 -0.26 0.00 0.00 57.72 56.52 3k5f n HIS 145 Cb 0.12 -0.02 -0.03 0.00 1.12 0.00 0.00 29.99 31.17 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 -1.07 2.77 0.71 1.59 1.01 -1.26 -4.95 120.40 119.21 3k5f s VAL 146 Ca 0.46 0.24 -0.16 0.00 0.00 0.00 0.00 61.98 62.52 3k5f s VAL 146 Cb 0.25 -3.16 0.01 0.00 0.00 0.00 0.00 36.38 33.48 3k5f s VAL 146 CO 0.31 -0.00 1.10 -2.65 0.00 0.00 0.00 175.10 173.86 3k5f n PRO 147 N 5.71 0.63 -1.60 2.72 -0.02 -1.26 -4.63 135.00 136.53 3k5f n PRO 147 Ca 0.17 0.27 -0.41 0.00 -2.02 0.00 0.00 63.50 61.51 3k5f n PRO 147 Cb 0.39 -2.35 -0.01 0.00 -0.02 0.00 0.00 33.50 31.52 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 -2.01 4.26 -3.60 2.55 5.15 -1.26 -4.34 115.26 116.01 3k5f n ASN 148 Ca 0.14 -2.78 -0.04 0.00 -0.60 0.00 0.00 54.58 51.29 3k5f n ASN 148 Cb 0.49 -1.58 -0.02 0.00 -0.53 0.00 0.00 39.78 38.14 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 1.83 -0.13 0.17 1.20 2.34 -1.26 -1.47 118.68 121.35 3k5f s LEU 149 Ca 0.50 0.00 -0.12 0.00 0.06 0.00 0.00 54.13 54.57 3k5f s LEU 149 Cb 0.14 1.37 0.01 0.00 -0.56 0.00 0.00 46.19 47.15 3k5f s LEU 149 CO -0.06 -0.22 0.36 0.72 -1.06 0.00 0.00 176.35 176.09 3k5f s PHE 150 N -2.40 0.17 0.03 3.48 -0.71 -0.96 -0.77 117.98 116.83 3k5f s PHE 150 Ca 0.09 -0.54 0.02 0.00 -1.04 0.00 0.00 56.93 55.47 3k5f s PHE 150 Cb -0.01 0.11 -0.02 0.00 -1.21 0.00 0.00 43.02 41.89 3k5f s PHE 150 CO -0.05 -0.77 -0.07 -1.54 -1.34 0.00 0.00 175.22 171.45 3k5f s SER 151 N -2.92 0.83 -0.06 1.98 1.04 -0.04 -0.56 113.70 113.96 3k5f s SER 151 Ca 0.13 -0.46 0.04 0.00 0.48 0.00 0.00 55.95 56.14 3k5f s SER 151 Cb 0.02 0.01 0.00 0.00 0.10 0.00 0.00 66.02 66.15 3k5f s SER 151 CO -0.03 -0.15 -0.18 -0.76 0.98 0.00 0.00 173.24 173.11 3k5f s LEU 152 N -1.29 1.91 -0.34 2.42 1.43 0.63 -1.11 118.68 122.33 3k5f s LEU 152 Ca -0.07 -0.40 0.02 0.00 -1.03 0.00 0.00 54.13 52.65 3k5f s LEU 152 Cb -0.08 -1.07 0.10 0.00 0.03 0.00 0.00 46.19 45.17 3k5f s LEU 152 CO 0.00 0.14 0.08 -1.58 0.23 0.00 0.00 176.35 175.23 3k5f s GLN 153 N 0.21 1.27 -0.25 1.70 0.74 -0.14 -0.95 119.66 122.24 3k5f s GLN 153 Ca -0.09 -1.68 -0.12 0.00 0.05 0.00 0.00 55.36 53.52 3k5f s GLN 153 Cb -0.14 -2.81 -0.05 0.00 1.10 0.00 0.00 33.01 31.11 3k5f s GLN 153 CO 0.04 -0.97 0.24 -0.51 -0.55 0.00 0.00 175.29 173.54 3k5f s LEU 154 N 1.03 4.09 -0.13 3.68 1.43 -1.26 -0.24 118.68 127.28 3k5f s LEU 154 Ca 0.11 0.19 -0.06 0.00 -1.03 0.00 0.00 54.13 53.34 3k5f s LEU 154 Cb -0.19 -2.23 -0.04 0.00 0.03 0.00 0.00 46.19 43.76 3k5f s LEU 154 CO -0.12 -0.02 0.09 0.00 0.23 0.00 0.00 176.35 176.52 3k5f s GLY 156 N -0.67 1.55 0.29 0.00 0.00 -1.26 -3.92 107.32 103.30 3k5f s GLY 156 Ca 0.12 -0.82 -0.30 0.00 0.00 0.00 0.00 44.72 43.72 3k5f s GLY 156 CO 0.02 0.05 1.55 0.00 0.00 0.00 0.00 173.10 174.72 3k5f s ALA 157 N -2.84 3.70 0.00 3.20 0.00 -1.26 -4.63 121.76 119.93 3k5f s ALA 157 Ca 0.70 1.51 0.00 0.00 0.00 0.00 0.00 51.96 54.17 3k5f s ALA 157 Cb -0.12 -3.62 0.00 0.00 0.00 0.00 0.00 23.12 19.38 3k5f s ALA 157 CO 0.57 -0.93 0.00 -1.13 0.00 0.00 0.00 175.76 174.27 3k5f n SER 169 N 2.08 0.00 -4.88 0.00 3.41 -0.74 -4.99 113.62 108.50 3k5f n SER 169 Ca 0.07 0.00 -0.30 0.00 -0.26 0.00 0.00 58.87 58.38 3k5f n SER 169 Cb 0.38 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 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 0.00 4.81 0.31 -3.33 -7.23 -0.46 -4.95 120.40 109.54 3k5f s VAL 170 Ca 0.00 0.56 0.05 0.00 -1.81 0.00 0.00 61.98 60.78 3k5f s VAL 170 Cb 0.00 -3.73 -0.03 0.00 0.56 0.00 0.00 36.38 33.18 3k5f s VAL 170 CO 0.00 -0.48 0.24 -0.83 -0.31 0.00 0.00 175.10 173.72 3k5f s GLY 171 N -3.12 2.16 0.00 2.32 0.00 -1.25 -1.92 107.32 105.52 3k5f s GLY 171 Ca 0.50 -1.95 0.00 0.00 0.00 0.00 0.00 44.72 43.27 3k5f s GLY 171 CO 0.30 -1.48 0.00 0.61 0.00 0.00 0.00 173.10 172.53 3k5f n GLY 172 N -0.56 -1.49 2.99 0.20 0.00 -1.00 -1.04 105.19 104.29 3k5f n GLY 172 Ca 0.06 -1.05 -0.18 0.00 0.00 0.00 0.00 46.02 44.84 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 -0.81 0.98 -0.30 1.61 0.01 0.66 -1.15 113.70 114.70 3k5f s SER 173 Ca 0.00 -0.15 0.02 0.00 1.31 0.00 0.00 55.95 57.13 3k5f s SER 173 Cb 0.00 -0.17 0.07 0.00 0.21 0.00 0.00 66.02 66.13 3k5f s SER 173 CO 0.00 0.08 -0.02 -0.32 0.41 0.00 0.00 173.24 173.39 3k5f s MET 174 N -0.03 2.05 -0.38 12.44 1.75 -1.26 -0.96 119.30 132.91 3k5f s MET 174 Ca 0.01 -1.52 -0.20 0.00 -1.25 0.00 0.00 55.69 52.73 3k5f s MET 174 Cb -0.05 -3.09 0.01 0.00 2.84 0.00 0.00 34.83 34.54 3k5f s MET 174 CO -0.00 -0.72 0.62 0.42 -0.65 0.00 0.00 175.02 174.69 3k5f s ILE 175 N 1.08 4.89 -0.30 10.11 -1.09 -0.27 -4.87 121.20 130.75 3k5f s ILE 175 Ca -0.01 0.43 -0.16 0.00 -2.23 0.00 0.00 60.65 58.68 3k5f s ILE 175 Cb -0.20 -4.10 -0.02 0.00 -1.58 0.00 0.00 42.46 36.56 3k5f s ILE 175 CO -0.05 -0.38 0.42 -0.63 -1.23 0.00 0.00 174.94 173.07 3k5f s ILE 176 N 2.70 5.13 0.00 2.92 1.01 -1.26 -0.86 121.20 130.84 3k5f s ILE 176 Ca 0.23 0.46 0.00 0.00 0.00 0.00 0.00 60.65 61.34 3k5f s ILE 176 Cb -0.14 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 38.53 3k5f s ILE 176 CO 0.16 0.02 0.00 0.61 0.00 0.00 0.00 174.94 175.73 3k5f n GLY 177 N 4.73 0.67 0.00 6.18 0.00 0.05 -4.81 105.19 112.01 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 -2.01 -1.08 3.35 -0.02 0.00 -1.23 -4.27 105.19 99.93 3k5f n GLY 178 Ca 0.00 -0.88 -0.32 0.00 0.00 0.00 0.00 46.02 44.81 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 2.71 -0.41 -0.61 1.01 -1.26 -4.05 121.20 115.59 3k5f s ILE 179 Ca 0.00 -0.81 -0.12 0.00 0.00 0.00 0.00 60.65 59.72 3k5f s ILE 179 Cb 0.00 -2.08 0.05 0.00 0.01 0.00 0.00 42.46 40.44 3k5f s ILE 179 CO 0.00 0.55 0.27 -0.62 0.00 0.00 0.00 174.94 175.15 3k5f s ASP 180 N 0.00 5.84 0.06 3.58 3.68 -1.26 -4.97 116.67 123.60 3k5f s ASP 180 Ca -0.06 -1.20 0.04 0.00 2.13 0.00 0.00 52.55 53.46 3k5f s ASP 180 Cb -0.15 -2.06 0.21 0.00 -1.45 0.00 0.00 42.92 39.47 3k5f s ASP 180 CO 0.05 -0.49 1.11 1.41 0.13 0.00 0.00 175.17 177.38 3k5f n HIS 181 N 5.04 0.13 1.26 -5.34 8.25 -1.26 -1.53 115.22 121.77 3k5f n HIS 181 Ca -0.11 0.07 0.13 0.00 -0.26 0.00 0.00 57.72 57.55 3k5f n HIS 181 Cb 0.45 -0.60 0.32 0.00 1.12 0.00 0.00 29.99 31.28 3k5f n HIS 181 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 3k5f n SER 182 N -1.63 1.76 -0.65 0.41 3.41 -1.26 -4.08 113.62 111.57 3k5f n SER 182 Ca -0.00 -1.44 0.13 0.00 -0.26 0.00 0.00 58.87 57.29 3k5f n SER 182 Cb 0.01 0.10 0.38 0.00 -0.26 0.00 0.00 64.21 64.45 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 0.17 2.02 -3.96 1.04 4.77 -0.58 -4.79 117.00 115.66 3k5f n LEU 183 Ca 0.15 -0.72 -0.09 0.00 -0.03 0.00 0.00 56.01 55.32 3k5f n LEU 183 Cb 0.42 -0.03 -0.05 0.00 -2.33 0.00 0.00 43.42 41.43 3k5f n LEU 183 CO 0.20 0.36 0.20 -0.72 -1.33 0.00 0.00 177.39 176.10 3k5f s TYR 184 N -1.93 0.28 0.15 -1.77 1.13 -1.26 0.15 117.35 114.10 3k5f s TYR 184 Ca 0.35 -0.64 0.06 0.00 -1.41 0.00 0.00 57.07 55.42 3k5f s TYR 184 Cb 0.20 0.24 -0.04 0.00 -1.10 0.00 0.00 41.96 41.26 3k5f s TYR 184 CO 0.31 -0.99 -0.13 0.95 -2.51 0.00 0.00 175.55 173.19 3k5f s THR 185 N -3.99 1.37 0.00 -3.49 -4.23 -0.27 -4.77 115.64 100.25 3k5f s THR 185 Ca 0.20 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.72 3k5f s THR 185 Cb -0.01 -1.79 0.00 0.00 1.34 0.00 0.00 72.50 72.04 3k5f s THR 185 CO 0.07 -0.60 0.00 0.61 -0.54 0.00 0.00 174.62 174.16 3k5f n GLY 186 N -0.00 -1.41 3.92 3.99 0.00 -1.26 -3.52 105.19 106.91 3k5f n GLY 186 Ca -0.11 -1.28 -0.27 0.00 0.00 0.00 0.00 46.02 44.36 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 6.38 -0.07 1.61 0.01 -1.26 -4.96 113.70 111.41 3k5f s SER 187 Ca 0.00 0.51 -0.17 0.00 1.31 0.00 0.00 55.95 57.61 3k5f s SER 187 Cb 0.00 -2.06 -0.05 0.00 0.21 0.00 0.00 66.02 64.12 3k5f s SER 187 CO 0.00 -0.17 0.44 -0.76 0.41 0.00 0.00 173.24 173.17 3k5f s LEU 188 N -3.69 4.35 -0.11 2.44 1.43 -1.26 -4.51 118.68 117.34 3k5f s LEU 188 Ca 0.41 0.86 0.02 0.00 -1.03 0.00 0.00 54.13 54.39 3k5f s LEU 188 Cb -0.10 -2.64 -0.01 0.00 0.03 0.00 0.00 46.19 43.46 3k5f s LEU 188 CO 0.31 0.13 -0.18 0.26 0.23 0.00 0.00 176.35 177.10 3k5f s TRP 189 N -0.05 2.68 -0.06 0.29 0.52 0.19 -4.89 118.94 117.60 3k5f s TRP 189 Ca 0.24 -0.75 -0.01 0.00 0.02 0.00 0.00 56.10 55.60 3k5f s TRP 189 Cb -0.16 -1.75 -0.03 0.00 -1.15 0.00 0.00 33.47 30.38 3k5f s TRP 189 CO 0.11 -0.25 -0.01 0.71 0.02 0.00 0.00 176.95 177.53 3k5f s TYR 190 N 0.21 3.10 -0.01 -1.98 1.51 -1.26 -0.04 117.35 118.89 3k5f s TYR 190 Ca -0.11 0.14 0.07 0.00 -1.01 0.00 0.00 57.07 56.16 3k5f s TYR 190 Cb -0.16 -1.75 -0.02 0.00 -0.11 0.00 0.00 41.96 39.92 3k5f s TYR 190 CO 0.06 0.44 -0.23 -0.08 -1.11 0.00 0.00 175.55 174.63 3k5f s THR 191 N -0.92 1.85 0.45 -0.71 -1.32 -0.10 -3.92 115.64 110.97 3k5f s THR 191 Ca 0.15 -1.05 -0.24 0.00 -1.21 0.00 0.00 61.69 59.34 3k5f s THR 191 Cb -0.11 -1.54 -0.07 0.00 -1.51 0.00 0.00 72.50 69.26 3k5f s THR 191 CO 0.04 0.48 1.23 -2.84 -2.21 0.00 0.00 174.62 171.32 3k5f s PRO 192 N -0.66 3.76 -0.25 7.08 0.02 -1.26 -0.70 135.00 142.99 3k5f s PRO 192 Ca 0.09 1.94 -0.25 0.00 0.02 0.00 0.00 61.00 62.80 3k5f s PRO 192 Cb -0.09 -2.51 -0.00 0.00 0.02 0.00 0.00 34.50 31.92 3k5f s PRO 192 CO -0.00 -0.60 0.86 0.42 -0.33 0.00 0.00 177.00 177.35 3k5f s ILE 193 N -1.42 4.81 0.12 2.83 1.01 -0.60 -4.55 121.20 123.40 3k5f s ILE 193 Ca 0.62 1.62 -0.16 0.00 0.00 0.00 0.00 60.65 62.73 3k5f s ILE 193 Cb -0.33 -4.15 -0.03 0.00 0.01 0.00 0.00 42.46 37.96 3k5f s ILE 193 CO 0.41 -0.11 1.62 -0.09 0.00 0.00 0.00 174.94 176.77 3k5f h ARG 194 N 7.68 0.59 -2.90 2.79 2.43 -0.89 -3.45 114.38 120.62 3k5f h ARG 194 Ca -0.22 -0.14 -0.13 0.00 -0.81 0.00 0.00 59.98 58.68 3k5f h ARG 194 Cb 1.09 -0.08 -0.23 0.00 -0.42 0.00 0.00 29.97 30.33 3k5f h ARG 194 CO 0.89 0.63 -0.28 0.50 -1.51 0.00 0.00 179.97 180.20 3k5f s ARG 195 N -5.29 0.50 -1.05 0.20 3.52 -1.26 -5.09 118.95 110.48 3k5f s ARG 195 Ca -0.13 0.30 -0.18 0.00 -0.13 0.00 0.00 55.73 55.59 3k5f s ARG 195 Cb 0.09 0.24 0.12 0.00 -1.56 0.00 0.00 34.95 33.84 3k5f s ARG 195 CO 0.76 -0.09 1.33 -1.21 -0.81 0.00 0.00 175.30 175.28 3k5f s GLU 196 N -0.25 3.76 0.00 5.12 2.02 -1.26 -4.12 118.70 123.96 3k5f s GLU 196 Ca -0.04 -1.87 0.00 0.00 0.02 0.00 0.00 54.97 53.08 3k5f s GLU 196 Cb -0.03 -5.10 0.00 0.00 0.10 0.00 0.00 34.13 29.10 3k5f s GLU 196 CO 0.02 -1.90 0.00 -2.67 0.02 0.00 0.00 175.26 170.72 3k5f n TRP 197 N 6.96 0.00 -2.28 1.61 4.27 -1.26 -4.61 117.44 122.14 3k5f n TRP 197 Ca 0.31 0.00 -0.26 0.00 -3.89 0.00 0.00 57.50 53.67 3k5f n TRP 197 Cb 0.48 0.00 0.11 0.00 -1.36 0.00 0.00 31.31 30.53 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 2.18 -1.16 -2.67 2.02 -1.26 -1.51 117.35 114.94 3k5f s TYR 198 Ca 0.00 0.16 -0.16 0.00 -0.37 0.00 0.00 57.07 56.71 3k5f s TYR 198 Cb 0.00 -3.34 0.14 0.00 -0.40 0.00 0.00 41.96 38.36 3k5f s TYR 198 CO 0.00 -1.78 1.43 0.71 -1.57 0.00 0.00 175.55 174.34 3k5f s TYR 199 N -3.35 3.26 0.02 2.71 1.51 -1.26 -4.83 117.35 115.40 3k5f s TYR 199 Ca 0.65 -1.85 -0.21 0.00 -1.01 0.00 0.00 57.07 54.65 3k5f s TYR 199 Cb -0.07 -4.41 -0.06 0.00 -0.11 0.00 0.00 41.96 37.32 3k5f s TYR 199 CO 0.46 -1.51 0.63 -2.00 -1.11 0.00 0.00 175.55 172.02 3k5f s GLU 200 N 2.41 4.34 0.37 -0.62 2.12 -1.26 -1.91 118.70 124.16 3k5f s GLU 200 Ca 0.43 0.80 0.04 0.00 0.36 0.00 0.00 54.97 56.60 3k5f s GLU 200 Cb -0.02 -3.33 -0.03 0.00 0.26 0.00 0.00 34.13 31.01 3k5f s GLU 200 CO -0.01 0.38 0.15 0.14 -0.54 0.00 0.00 175.26 175.38 3k5f s VAL 201 N -0.27 0.51 -0.13 3.70 -7.23 -0.30 -0.16 120.40 116.52 3k5f s VAL 201 Ca 0.32 -2.00 0.02 0.00 -1.81 0.00 0.00 61.98 58.51 3k5f s VAL 201 Cb -0.19 -2.43 0.01 0.00 0.56 0.00 0.00 36.38 34.33 3k5f s VAL 201 CO 0.19 0.00 -0.18 -0.63 -0.31 0.00 0.00 175.10 174.16 3k5f s ILE 202 N -3.34 1.78 -0.21 -0.62 1.01 -1.26 -4.13 121.20 114.43 3k5f s ILE 202 Ca 0.29 -0.80 -0.16 0.00 0.00 0.00 0.00 60.65 59.98 3k5f s ILE 202 Cb 0.03 -1.60 -0.04 0.00 0.01 0.00 0.00 42.46 40.87 3k5f s ILE 202 CO 0.17 0.50 0.42 -0.63 0.00 0.00 0.00 174.94 175.40 3k5f s ILE 203 N 0.98 5.17 -0.98 2.92 1.01 -1.26 -1.89 121.20 127.15 3k5f s ILE 203 Ca -0.05 0.75 0.18 0.00 0.00 0.00 0.00 60.65 61.52 3k5f s ILE 203 Cb -0.15 -3.75 -0.16 0.00 0.01 0.00 0.00 42.46 38.41 3k5f s ILE 203 CO -0.03 0.22 0.78 1.33 0.00 0.00 0.00 174.94 177.24 3k5f n VAL 204 N 4.46 0.00 -3.58 2.92 0.24 0.06 -4.75 118.33 117.68 3k5f n VAL 204 Ca -0.07 -0.13 -0.11 0.00 -2.04 0.00 0.00 64.34 61.98 3k5f n VAL 204 Cb 0.51 1.04 -0.05 0.00 -1.47 0.00 0.00 33.84 33.86 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 -2.55 0.64 -0.03 7.34 3.52 -1.22 -4.80 118.95 121.85 3k5f s ARG 205 Ca 0.08 0.21 0.01 0.00 -0.13 0.00 0.00 55.73 55.90 3k5f s ARG 205 Cb 0.13 0.30 0.02 0.00 -1.56 0.00 0.00 34.95 33.85 3k5f s ARG 205 CO 0.67 -0.19 -0.01 0.08 -0.81 0.00 0.00 175.30 175.04 3k5f s VAL 206 N -0.97 0.25 0.06 7.11 1.01 -1.26 -0.74 120.40 125.87 3k5f s VAL 206 Ca -0.02 0.01 0.07 0.00 0.00 0.00 0.00 61.98 62.03 3k5f s VAL 206 Cb -0.01 -0.31 -0.03 0.00 0.00 0.00 0.00 36.38 36.03 3k5f s VAL 206 CO 0.02 0.15 -0.18 -1.61 0.00 0.00 0.00 175.10 173.47 3k5f s GLU 207 N 0.80 1.10 -0.03 2.72 2.02 -0.13 -1.66 118.70 123.52 3k5f s GLU 207 Ca -0.08 -0.96 -0.00 0.00 0.02 0.00 0.00 54.97 53.94 3k5f s GLU 207 Cb -0.12 -1.22 0.03 0.00 0.10 0.00 0.00 34.13 32.92 3k5f s GLU 207 CO -0.01 0.29 0.02 0.42 0.02 0.00 0.00 175.26 176.01 3k5f s ILE 208 N -1.00 0.07 -1.54 -1.63 1.01 0.11 -0.54 121.20 117.68 3k5f s ILE 208 Ca 0.04 0.20 -0.05 0.00 0.00 0.00 0.00 60.65 60.84 3k5f s ILE 208 Cb -0.09 -0.22 0.01 0.00 0.01 0.00 0.00 42.46 42.17 3k5f s ILE 208 CO 0.02 0.15 0.66 -3.20 0.00 0.00 0.00 174.94 172.57 3k5f n ASN 209 N 4.49 -6.06 0.00 3.58 5.15 -0.55 -0.96 115.26 120.91 3k5f n ASN 209 Ca -0.20 -0.32 0.00 0.00 -0.60 0.00 0.00 54.58 53.46 3k5f n ASN 209 Cb 0.50 -4.89 0.00 0.00 -0.53 0.00 0.00 39.78 34.86 3k5f n ASN 209 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k5f n GLY 210 N -1.56 1.17 3.67 8.20 0.00 -1.26 -4.99 105.19 110.43 3k5f n GLY 210 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.19 4.06 0.31 1.61 2.00 -0.13 -5.06 119.66 122.25 3k5f s GLN 211 Ca 0.00 -0.30 -0.29 0.00 -2.00 0.00 0.00 55.36 52.77 3k5f s GLN 211 Cb 0.00 -3.30 -0.10 0.00 0.80 0.00 0.00 33.01 30.41 3k5f s GLN 211 CO 0.00 0.28 1.25 0.34 -0.50 0.00 0.00 175.29 176.66 3k5f s ASP 212 N 0.38 6.93 0.00 6.67 -1.08 -1.26 -0.72 116.67 127.59 3k5f s ASP 212 Ca 0.05 2.55 0.20 0.00 -0.52 0.00 0.00 52.55 54.83 3k5f s ASP 212 Cb -0.12 -2.64 0.90 0.00 -1.46 0.00 0.00 42.92 39.60 3k5f s ASP 212 CO -0.01 -0.42 1.64 0.18 0.52 0.00 0.00 175.17 177.09 3k5f n LEU 213 N 1.05 0.00 -3.73 -1.34 4.77 -0.66 -4.89 117.00 112.20 3k5f n LEU 213 Ca 0.00 0.45 -0.28 0.00 -0.03 0.00 0.00 56.01 56.15 3k5f n LEU 213 Cb 0.43 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 41.05 3k5f n LEU 213 CO 0.58 -0.14 -0.03 0.29 -1.33 0.00 0.00 177.39 176.76 3k5f n LYS 214 N -1.45 -3.28 -4.10 3.23 5.02 -1.26 -4.95 118.16 111.36 3k5f n LYS 214 Ca 0.06 0.41 -0.25 0.00 -2.02 0.00 0.00 58.31 56.50 3k5f n LYS 214 Cb 0.22 -5.12 -0.05 0.00 -0.02 0.00 0.00 35.03 30.05 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 -6.40 2.86 0.06 1.97 -1.94 -1.26 -5.05 119.30 109.54 3k5f s MET 215 Ca 0.55 -0.94 -0.30 0.00 -1.71 0.00 0.00 55.69 53.28 3k5f s MET 215 Cb -0.29 -2.60 -0.09 0.00 2.01 0.00 0.00 34.83 33.86 3k5f s MET 215 CO 0.67 0.46 1.85 0.34 -0.01 0.00 0.00 175.02 178.33 3k5f s ASP 216 N -3.28 6.48 0.61 3.03 -1.08 -1.26 -4.83 116.67 116.35 3k5f s ASP 216 Ca 0.31 2.63 0.28 0.00 -0.52 0.00 0.00 52.55 55.25 3k5f s ASP 216 Cb -0.09 -2.55 1.41 0.00 -1.46 0.00 0.00 42.92 40.24 3k5f s ASP 216 CO 0.23 -1.00 1.82 0.00 0.52 0.00 0.00 175.17 176.74 3k5f h LYS 218 N 0.00 0.30 -0.24 0.00 1.57 -1.84 -1.31 116.57 115.06 3k5f h LYS 218 Ca 0.18 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3k5f h LYS 218 Cb 1.24 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 33.47 3k5f h LYS 218 CO -0.00 0.23 0.13 0.93 -0.57 0.00 0.00 179.45 180.16 3k5f h GLU 219 N 0.31 0.32 0.00 3.15 4.39 -0.91 -1.76 114.58 120.09 3k5f h GLU 219 Ca 0.08 -0.03 -0.04 0.00 0.34 0.00 0.00 59.36 59.72 3k5f h GLU 219 Cb 0.01 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 3k5f h GLU 219 CO -0.01 0.24 -0.18 1.88 -1.16 0.00 0.00 179.01 179.78 3k5f h TYR 220 N 0.33 0.00 -0.08 4.33 0.99 -1.36 -3.16 116.97 118.01 3k5f h TYR 220 Ca 0.09 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.77 3k5f h TYR 220 Cb 0.02 0.00 -0.03 0.00 1.00 0.00 0.00 36.73 37.72 3k5f h TYR 220 CO 0.00 0.18 -0.41 0.09 -0.00 0.00 0.00 178.16 178.02 3k5f n ASN 221 N -3.45 1.88 -4.53 3.88 3.02 -0.69 -4.45 115.26 110.92 3k5f n ASN 221 Ca -0.01 -3.89 -0.41 0.00 -0.03 0.00 0.00 54.58 50.25 3k5f n ASN 221 Cb 0.36 -0.55 -0.09 0.00 -0.61 0.00 0.00 39.78 38.88 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 -3.25 3.21 -1.96 3.10 5.04 -1.02 0.11 117.35 122.58 3k5f s TYR 222 Ca 0.40 -0.15 0.21 0.00 -2.44 0.00 0.00 57.07 55.09 3k5f s TYR 222 Cb 0.38 -2.68 0.60 0.00 0.35 0.00 0.00 41.96 40.61 3k5f s TYR 222 CO -0.06 -0.48 1.50 -0.40 -1.34 0.00 0.00 175.55 174.78 3k5f n ASP 223 N 5.37 3.66 -3.61 4.32 5.75 -1.26 -3.35 116.55 127.42 3k5f n ASP 223 Ca -0.09 -2.02 -0.01 0.00 -0.01 0.00 0.00 54.79 52.66 3k5f n ASP 223 Cb 0.49 -0.46 -0.01 0.00 -1.03 0.00 0.00 41.12 40.11 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 -1.13 0.11 -0.08 0.11 -2.85 0.12 -4.74 119.74 111.27 3k5f s LYS 224 Ca 0.45 -0.05 0.01 0.00 -1.00 0.00 0.00 55.97 55.39 3k5f s LYS 224 Cb 0.24 0.04 0.02 0.00 -2.06 0.00 0.00 37.83 36.07 3k5f s LYS 224 CO 0.30 -0.05 -0.10 -1.12 0.10 0.00 0.00 175.35 174.48 3k5f s SER 225 N -2.38 1.86 0.16 0.03 0.01 -1.26 0.56 113.70 112.68 3k5f s SER 225 Ca 0.12 -0.29 0.06 0.00 1.31 0.00 0.00 55.95 57.15 3k5f s SER 225 Cb 0.02 -0.81 -0.04 0.00 0.21 0.00 0.00 66.02 65.40 3k5f s SER 225 CO -0.04 -0.02 -0.12 0.27 0.41 0.00 0.00 173.24 173.73 3k5f s ILE 226 N 1.03 1.37 -0.33 1.44 -4.36 -0.61 -1.15 121.20 118.59 3k5f s ILE 226 Ca -0.08 -2.01 -0.11 0.00 -0.26 0.00 0.00 60.65 58.19 3k5f s ILE 226 Cb -0.15 -1.82 -0.01 0.00 1.25 0.00 0.00 42.46 41.74 3k5f s ILE 226 CO -0.01 -0.62 0.19 -0.69 0.24 0.00 0.00 174.94 174.05 3k5f s VAL 227 N -2.91 4.83 -0.28 8.37 1.01 -0.80 -0.71 120.40 129.90 3k5f s VAL 227 Ca 0.16 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 3k5f s VAL 227 Cb -0.00 -3.49 0.09 0.00 0.00 0.00 0.00 36.38 32.98 3k5f s VAL 227 CO 0.03 0.02 0.07 -0.62 0.00 0.00 0.00 175.10 174.60 3k5f s ASP 228 N 1.65 3.77 0.40 3.32 2.15 -0.46 -4.41 116.67 123.09 3k5f s ASP 228 Ca 0.05 -1.42 0.28 0.00 0.43 0.00 0.00 52.55 51.89 3k5f s ASP 228 Cb -0.17 -0.83 1.34 0.00 -0.30 0.00 0.00 42.92 42.95 3k5f s ASP 228 CO 0.08 -0.38 1.86 0.77 -0.17 0.00 0.00 175.17 177.33 3k5f h SER 229 N 8.11 0.00 -0.05 -0.34 4.64 -1.84 -2.32 113.55 121.76 3k5f h SER 229 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 3k5f h SER 229 Cb 1.04 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.13 3k5f h SER 229 CO 0.44 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.01 3k5f n GLY 230 N -0.50 -0.33 3.18 -0.77 0.00 -1.25 -4.53 105.19 100.98 3k5f n GLY 230 Ca 0.00 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.37 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 -1.95 2.03 0.03 2.61 2.01 -0.87 -4.97 115.64 114.53 3k5f s THR 231 Ca 0.37 -0.97 -0.27 0.00 0.31 0.00 0.00 61.69 61.13 3k5f s THR 231 Cb 0.19 -1.79 -0.17 0.00 0.01 0.00 0.00 72.50 70.75 3k5f s THR 231 CO 0.31 0.55 1.32 0.74 -0.69 0.00 0.00 174.62 176.84 3k5f h THR 232 N 5.80 0.49 -4.02 -0.82 2.02 -1.85 0.36 112.91 114.90 3k5f h THR 232 Ca -0.29 -0.38 -0.46 0.00 0.77 0.00 0.00 66.41 66.05 3k5f h THR 232 Cb 1.20 0.65 0.12 0.00 -1.74 0.00 0.00 68.15 68.39 3k5f h THR 232 CO 0.53 0.06 0.36 0.20 0.37 0.00 0.00 175.52 177.04 3k5f s ASN 233 N -4.81 3.97 -0.33 4.18 0.01 -1.26 -1.34 114.94 115.36 3k5f s ASN 233 Ca -0.15 0.42 -0.16 0.00 -0.71 0.00 0.00 52.86 52.26 3k5f s ASN 233 Cb 0.02 -0.74 -0.01 0.00 0.41 0.00 0.00 41.25 40.93 3k5f s ASN 233 CO 0.54 -2.19 0.43 -0.22 -1.51 0.00 0.00 177.10 174.15 3k5f s LEU 234 N -5.62 4.32 -0.14 0.60 2.96 -0.75 -2.69 118.68 117.36 3k5f s LEU 234 Ca 0.67 -0.03 -0.05 0.00 -0.22 0.00 0.00 54.13 54.50 3k5f s LEU 234 Cb -0.08 -2.47 -0.03 0.00 0.50 0.00 0.00 46.19 44.11 3k5f s LEU 234 CO 0.50 -0.37 0.02 -0.13 -1.32 0.00 0.00 176.35 175.05 3k5f s ARG 235 N 2.19 3.59 0.09 1.98 0.52 0.02 -1.43 118.95 125.91 3k5f s ARG 235 Ca 0.16 -0.40 0.09 0.00 -0.52 0.00 0.00 55.73 55.05 3k5f s ARG 235 Cb -0.16 -3.01 -0.03 0.00 0.52 0.00 0.00 34.95 32.27 3k5f s ARG 235 CO 0.12 0.41 -0.22 -0.51 0.02 0.00 0.00 175.30 175.11 3k5f s LEU 236 N -0.05 2.25 0.61 2.53 1.43 -0.53 -0.11 118.68 124.80 3k5f s LEU 236 Ca 0.04 -0.64 -0.19 0.00 -1.03 0.00 0.00 54.13 52.31 3k5f s LEU 236 Cb -0.13 -1.01 -0.03 0.00 0.03 0.00 0.00 46.19 45.06 3k5f s LEU 236 CO 0.02 0.13 1.22 -2.65 0.23 0.00 0.00 176.35 175.30 3k5f n PRO 237 N 1.33 1.21 -0.36 1.29 -0.02 -1.26 0.15 135.00 137.35 3k5f n PRO 237 Ca -0.18 0.46 -0.09 0.00 -2.02 0.00 0.00 63.50 61.67 3k5f n PRO 237 Cb 0.53 -2.44 -0.08 0.00 -0.02 0.00 0.00 33.50 31.48 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 -1.42 -0.37 -0.22 -0.52 4.81 -1.09 -0.06 118.16 119.29 3k5f n LYS 238 Ca 0.14 1.29 0.01 0.00 -0.87 0.00 0.00 58.31 58.88 3k5f n LYS 238 Cb 0.47 -1.90 0.25 0.00 0.02 0.00 0.00 35.03 33.87 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 0.97 -0.02 1.64 3.64 -1.92 -1.11 116.57 119.77 3k5f h LYS 239 Ca 0.14 -0.06 -0.23 0.00 -1.27 0.00 0.00 60.65 59.22 3k5f h LYS 239 Cb 0.35 -0.22 0.01 0.00 -0.41 0.00 0.00 32.23 31.95 3k5f h LYS 239 CO -0.80 0.64 -0.93 0.28 -2.27 0.00 0.00 179.45 176.38 3k5f h VAL 240 N 1.00 1.35 -0.65 2.00 2.07 -1.45 -2.90 116.25 117.68 3k5f h VAL 240 Ca 0.28 -2.32 -0.00 0.00 0.82 0.00 0.00 66.70 65.48 3k5f h VAL 240 Cb -0.08 2.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.99 3k5f h VAL 240 CO -0.07 0.70 0.39 0.15 0.02 0.00 0.00 177.57 178.77 3k5f h PHE 241 N 0.31 0.87 -0.37 1.57 3.57 0.03 -0.26 116.94 122.65 3k5f h PHE 241 Ca -0.09 -0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 3k5f h PHE 241 Cb 1.57 -0.28 -0.02 0.00 2.79 0.00 0.00 35.95 40.01 3k5f h PHE 241 CO 0.07 0.59 0.14 0.93 -2.23 0.00 0.00 178.31 177.81 3k5f h GLU 242 N 0.89 0.56 -0.67 1.11 5.08 -1.23 -0.89 114.58 119.43 3k5f h GLU 242 Ca 0.23 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.41 3k5f h GLU 242 Cb -0.02 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.11 3k5f h GLU 242 CO -0.04 0.55 0.13 0.00 -1.00 0.00 0.00 179.01 178.64 3k5f h ALA 243 N 0.99 0.95 0.05 3.43 0.00 -1.29 -1.91 119.26 121.47 3k5f h ALA 243 Ca 0.12 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 3k5f h ALA 243 Cb 0.20 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3k5f h ALA 243 CO -0.01 0.66 -0.03 0.00 0.00 0.00 0.00 179.25 179.88 3k5f h ALA 244 N 1.10 -0.07 -1.00 0.00 0.00 -0.76 -2.06 119.26 116.46 3k5f h ALA 244 Ca 0.21 -0.10 0.05 0.00 0.00 0.00 0.00 54.91 55.07 3k5f h ALA 244 Cb 0.41 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 18.17 3k5f h ALA 244 CO 0.01 -0.45 0.65 0.28 0.00 0.00 0.00 179.25 179.75 3k5f h VAL 245 N -0.26 1.12 0.30 0.00 2.07 -1.10 0.84 116.25 119.22 3k5f h VAL 245 Ca -0.01 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.09 3k5f h VAL 245 Cb 0.23 -0.20 -0.00 0.00 -1.52 0.00 0.00 31.29 29.80 3k5f h VAL 245 CO 0.01 0.22 -0.17 0.50 0.02 0.00 0.00 177.57 178.15 3k5f h LYS 246 N 1.21 -0.43 -0.90 1.57 3.64 -1.16 0.29 116.57 120.79 3k5f h LYS 246 Ca 0.42 0.03 0.02 0.00 -1.27 0.00 0.00 60.65 59.85 3k5f h LYS 246 Cb 0.11 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 31.97 3k5f h LYS 246 CO -0.16 -0.28 0.59 1.03 -2.27 0.00 0.00 179.45 178.36 3k5f h SER 247 N -0.44 1.01 0.42 4.20 0.87 -0.89 -1.63 113.55 117.08 3k5f h SER 247 Ca -0.03 -0.02 -0.16 0.00 -1.23 0.00 0.00 61.79 60.35 3k5f h SER 247 Cb 0.36 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.06 3k5f h SER 247 CO 0.04 0.71 -0.68 0.40 -0.53 0.00 0.00 176.83 176.78 3k5f h ILE 248 N 1.18 1.42 -0.12 2.23 2.04 -0.48 -2.51 117.51 121.26 3k5f h ILE 248 Ca 0.34 -2.16 -0.02 0.00 1.00 0.00 0.00 64.86 64.03 3k5f h ILE 248 Cb -0.07 2.13 -0.00 0.00 -0.74 0.00 0.00 36.82 38.14 3k5f h ILE 248 CO -0.09 0.63 0.01 0.11 0.00 0.00 0.00 178.15 178.81 3k5f h LYS 249 N 0.16 0.21 0.24 2.37 1.57 0.18 -2.92 116.57 118.38 3k5f h LYS 249 Ca -0.02 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.70 3k5f h LYS 249 Cb 1.22 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.48 3k5f h LYS 249 CO 0.10 0.44 -0.27 0.00 -0.57 0.00 0.00 179.45 179.15 3k5f h ALA 250 N 0.77 -0.54 -0.53 3.86 0.00 -1.31 -1.62 119.26 119.88 3k5f h ALA 250 Ca 0.04 -0.08 0.15 0.00 0.00 0.00 0.00 54.91 55.02 3k5f h ALA 250 Cb 0.34 0.40 -0.02 0.00 0.00 0.00 0.00 17.79 18.51 3k5f h ALA 250 CO 0.01 -0.84 0.52 0.00 0.00 0.00 0.00 179.25 178.93 3k5f h ALA 251 N 0.09 2.29 -0.32 0.00 0.00 -1.47 0.21 119.26 120.05 3k5f h ALA 251 Ca 0.00 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 54.77 3k5f h ALA 251 Cb 0.53 0.04 -0.07 0.00 0.00 0.00 0.00 17.79 18.28 3k5f h ALA 251 CO -0.08 -0.79 -0.03 -1.13 0.00 0.00 0.00 179.25 177.22 3k5f n SER 252 N -3.79 2.98 -0.06 0.00 3.41 -0.78 -4.68 113.62 110.70 3k5f n SER 252 Ca 0.10 -3.49 0.22 0.00 -0.26 0.00 0.00 58.87 55.45 3k5f n SER 252 Cb 0.73 -0.60 0.69 0.00 -0.26 0.00 0.00 64.21 64.76 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 1.23 0.03 -0.59 4.04 4.64 0.33 -0.68 113.55 122.55 3k5f h SER 253 Ca 0.15 0.00 0.17 0.00 -0.47 0.00 0.00 61.79 61.64 3k5f h SER 253 Cb 1.60 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.66 3k5f h SER 253 CO 0.34 0.01 0.54 0.71 -0.87 0.00 0.00 176.83 177.56 3k5f h THR 254 N 0.03 0.42 -2.67 2.95 1.35 -1.84 -3.41 112.91 109.74 3k5f h THR 254 Ca 0.31 0.00 -0.50 0.00 -0.55 0.00 0.00 66.41 65.68 3k5f h THR 254 Cb 1.21 0.59 -0.14 0.00 -1.73 0.00 0.00 68.15 68.08 3k5f h THR 254 CO -0.01 0.00 -0.73 -1.61 -0.25 0.00 0.00 175.52 172.91 3k5f s GLU 255 N -4.73 1.45 -0.03 4.72 2.02 -0.26 -5.15 118.70 116.72 3k5f s GLU 255 Ca -0.04 -1.66 0.06 0.00 0.02 0.00 0.00 54.97 53.34 3k5f s GLU 255 Cb 0.17 -1.29 -0.01 0.00 0.10 0.00 0.00 34.13 33.10 3k5f s GLU 255 CO 0.62 0.20 -0.20 0.21 0.02 0.00 0.00 175.26 176.11 3k5f s LYS 256 N -3.62 1.79 0.07 1.61 2.20 -1.26 -4.94 119.74 115.59 3k5f s LYS 256 Ca 0.25 -0.72 0.06 0.00 -0.36 0.00 0.00 55.97 55.20 3k5f s LYS 256 Cb -0.01 -1.65 -0.03 0.00 -1.51 0.00 0.00 37.83 34.63 3k5f s LYS 256 CO 0.09 0.38 -0.16 -0.06 -0.36 0.00 0.00 175.35 175.25 3k5f s PHE 257 N -0.30 1.37 0.61 4.03 0.40 -1.26 -5.13 117.98 117.70 3k5f s PHE 257 Ca 0.03 -0.43 -0.18 0.00 -0.60 0.00 0.00 56.93 55.75 3k5f s PHE 257 Cb -0.10 -0.77 -0.04 0.00 0.51 0.00 0.00 43.02 42.62 3k5f s PHE 257 CO 0.01 0.09 1.00 -2.30 0.70 0.00 0.00 175.22 174.71 3k5f n PRO 258 N 1.37 0.90 0.29 0.24 -0.02 -1.26 -4.86 135.00 131.67 3k5f n PRO 258 Ca -0.20 0.35 0.15 0.00 -2.02 0.00 0.00 63.50 61.78 3k5f n PRO 258 Cb 0.54 -2.21 0.89 0.00 -0.02 0.00 0.00 33.50 32.71 3k5f n PRO 258 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 3k5f h ASP 259 N 0.46 0.00 0.52 2.55 3.58 -2.00 0.55 116.42 122.08 3k5f h ASP 259 Ca -0.49 0.00 -0.05 0.00 0.42 0.00 0.00 57.03 56.91 3k5f h ASP 259 Cb 1.36 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.40 3k5f h ASP 259 CO 0.51 0.00 -0.24 1.23 -2.88 0.00 0.00 179.24 177.86 3k5f h GLY 260 N 0.01 0.00 0.81 -0.78 0.00 -1.97 -2.82 103.07 98.32 3k5f h GLY 260 Ca -0.00 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.30 3k5f h GLY 260 CO 0.00 0.00 0.01 -2.75 0.00 0.00 0.00 176.54 173.80 3k5f h PHE 261 N 0.00 0.35 0.00 5.60 3.57 -1.14 -1.35 116.94 123.97 3k5f h PHE 261 Ca -0.00 -0.06 0.00 0.00 3.53 0.00 0.00 57.97 61.44 3k5f h PHE 261 Cb 0.56 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 39.21 3k5f h PHE 261 CO 0.00 0.52 0.00 0.91 -2.23 0.00 0.00 178.31 177.51 3k5f n TRP 262 N -4.72 0.00 -0.02 0.41 7.02 -1.07 -1.47 117.44 117.58 3k5f n TRP 262 Ca -0.05 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.51 3k5f n TRP 262 Cb 0.22 -0.08 0.16 0.00 -2.42 0.00 0.00 31.31 29.18 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 -1.08 2.94 0.00 -0.99 4.77 -0.93 -4.94 117.00 116.75 3k5f n LEU 263 Ca 0.10 -1.75 0.00 0.00 -0.03 0.00 0.00 56.01 54.33 3k5f n LEU 263 Cb 0.07 -0.22 0.00 0.00 -2.33 0.00 0.00 43.42 40.94 3k5f n LEU 263 CO 0.10 0.70 0.00 0.61 -1.33 0.00 0.00 177.39 177.46 3k5f n GLY 264 N 0.80 0.19 0.04 -0.72 0.00 -0.54 -4.86 105.19 100.09 3k5f n GLY 264 Ca 0.13 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.13 3k5f n GLY 264 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3k5f h GLU 265 N 0.41 0.00 0.00 1.61 5.08 -1.56 -3.45 114.58 116.67 3k5f h GLU 265 Ca 0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 57.99 3k5f h GLU 265 Cb 0.59 0.00 0.17 0.00 0.50 0.00 0.00 28.75 30.01 3k5f h GLU 265 CO 0.00 0.00 0.20 1.04 -1.00 0.00 0.00 179.01 179.25 3k5f n GLN 266 N -3.57 -2.35 -3.89 2.33 6.02 -0.58 -4.96 117.38 110.37 3k5f n GLN 266 Ca -0.03 -1.67 -0.11 0.00 -0.01 0.00 0.00 57.00 55.18 3k5f n GLN 266 Cb 0.12 -1.40 -0.11 0.00 1.02 0.00 0.00 30.24 29.87 3k5f n GLN 266 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 3k5f s LEU 267 N 0.00 1.73 -0.10 1.08 2.34 -1.26 -4.59 118.68 117.88 3k5f s LEU 267 Ca 0.65 -0.18 0.02 0.00 0.06 0.00 0.00 54.13 54.68 3k5f s LEU 267 Cb -0.05 0.46 -0.02 0.00 -0.56 0.00 0.00 46.19 46.02 3k5f s LEU 267 CO 0.49 -0.28 -0.14 0.54 -1.06 0.00 0.00 176.35 175.90 3k5f s VAL 268 N -1.07 3.00 0.36 1.48 0.11 -0.69 -4.90 120.40 118.68 3k5f s VAL 268 Ca -0.12 -0.71 0.08 0.00 -2.93 0.00 0.00 61.98 58.31 3k5f s VAL 268 Cb -0.07 -2.22 -0.04 0.00 -1.53 0.00 0.00 36.38 32.52 3k5f s VAL 268 CO 0.01 0.55 0.19 0.00 -3.33 0.00 0.00 175.10 172.51 3k5f s TRP 270 N -2.45 -0.01 0.08 0.00 0.51 -0.65 -4.94 118.94 111.48 3k5f s TRP 270 Ca 0.40 -0.34 -0.31 0.00 -2.12 0.00 0.00 56.10 53.73 3k5f s TRP 270 Cb -0.02 0.30 -0.08 0.00 -0.81 0.00 0.00 33.47 32.87 3k5f s TRP 270 CO 0.24 -0.88 1.47 -1.14 -0.51 0.00 0.00 176.95 176.13 3k5f s GLN 271 N -3.89 4.27 -0.68 4.98 0.74 -1.26 0.16 119.66 123.97 3k5f s GLN 271 Ca 0.11 2.14 -0.33 0.00 0.05 0.00 0.00 55.36 57.33 3k5f s GLN 271 Cb -0.00 -3.40 -0.18 0.00 1.10 0.00 0.00 33.01 30.53 3k5f s GLN 271 CO -0.02 -0.56 2.16 0.00 -0.55 0.00 0.00 175.29 176.31 3k5f n ALA 272 N 4.70 0.23 -0.06 1.58 0.00 -0.70 0.11 120.51 126.37 3k5f n ALA 272 Ca 0.13 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3k5f n ALA 272 Cb 0.42 -1.92 0.00 0.00 0.00 0.00 0.00 19.45 17.94 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 6.13 0.86 0.45 0.00 0.00 -1.26 -4.96 105.19 106.41 3k5f n GLY 273 Ca 0.54 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.61 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 -2.05 1.37 -1.67 2.61 -2.24 0.29 -5.02 114.28 107.58 3k5f n THR 274 Ca 0.00 -1.34 -0.42 0.00 -2.27 0.00 0.00 64.05 60.02 3k5f n THR 274 Cb 0.00 0.26 -0.03 0.00 -2.10 0.00 0.00 70.33 68.46 3k5f n THR 274 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3k5f s THR 275 N -1.60 3.00 -1.27 4.28 2.01 -1.26 -4.82 115.64 115.98 3k5f s THR 275 Ca 0.22 0.02 -0.18 0.00 0.31 0.00 0.00 61.69 62.05 3k5f s THR 275 Cb 0.15 -3.01 0.02 0.00 0.01 0.00 0.00 72.50 69.67 3k5f s THR 275 CO 0.08 -0.00 1.88 -0.81 -0.69 0.00 0.00 174.62 175.08 3k5f n PRO 276 N 7.51 2.72 0.15 4.92 -0.04 -1.26 -4.76 135.00 144.24 3k5f n PRO 276 Ca 0.20 -2.91 0.01 0.00 -0.04 0.00 0.00 63.50 60.76 3k5f n PRO 276 Cb 0.41 -3.47 0.33 0.00 -0.04 0.00 0.00 33.50 30.73 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 7.71 0.12 0.00 0.54 4.06 -1.94 -2.96 115.95 123.49 3k5f h TRP 277 Ca 0.43 -0.02 -0.00 0.00 2.06 0.00 0.00 58.89 61.35 3k5f h TRP 277 Cb 0.83 -0.03 -0.00 0.00 -1.00 0.00 0.00 29.16 28.96 3k5f h TRP 277 CO 1.38 0.43 -0.01 -2.95 -3.56 0.00 0.00 178.44 173.74 3k5f h ASN 278 N 0.10 0.00 0.98 -3.49 7.08 -2.01 -2.04 115.58 116.19 3k5f h ASN 278 Ca 0.01 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.23 3k5f h ASN 278 Cb 0.64 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.88 3k5f h ASN 278 CO 0.05 0.01 -0.48 2.30 -2.08 0.00 0.00 177.43 177.23 3k5f n ILE 279 N -3.14 0.39 -3.60 6.14 -5.35 -1.12 -4.76 119.36 107.93 3k5f n ILE 279 Ca -0.02 -0.26 -0.39 0.00 -0.27 0.00 0.00 62.75 61.81 3k5f n ILE 279 Cb 0.15 -0.22 -0.11 0.00 -1.74 0.00 0.00 39.64 37.72 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 -3.14 3.20 0.71 4.28 0.08 -0.77 -3.21 117.98 119.13 3k5f s PHE 280 Ca 0.07 -0.17 -0.12 0.00 0.12 0.00 0.00 56.93 56.83 3k5f s PHE 280 Cb 0.13 -2.39 0.02 0.00 -0.57 0.00 0.00 43.02 40.22 3k5f s PHE 280 CO 0.69 -0.30 1.08 -1.25 -0.10 0.00 0.00 175.22 175.34 3k5f s PRO 281 N 1.70 2.67 0.37 0.24 0.04 -1.26 -4.61 135.00 134.15 3k5f s PRO 281 Ca 0.06 1.12 -0.10 0.00 0.04 0.00 0.00 61.00 62.12 3k5f s PRO 281 Cb -0.17 -1.95 -0.07 0.00 0.04 0.00 0.00 34.50 32.36 3k5f s PRO 281 CO 0.09 -1.32 0.72 0.14 0.04 0.00 0.00 177.00 176.67 3k5f s VAL 282 N -2.85 4.82 -0.14 -0.36 -7.23 -1.26 -4.39 120.40 108.99 3k5f s VAL 282 Ca 0.61 0.56 0.01 0.00 -1.81 0.00 0.00 61.98 61.34 3k5f s VAL 282 Cb -0.16 -3.71 -0.01 0.00 0.56 0.00 0.00 36.38 33.06 3k5f s VAL 282 CO 0.52 -0.43 -0.15 -0.63 -0.31 0.00 0.00 175.10 174.10 3k5f s ILE 283 N -2.25 2.74 -0.18 -0.62 1.01 0.27 -1.49 121.20 120.68 3k5f s ILE 283 Ca 0.50 -0.76 -0.04 0.00 0.00 0.00 0.00 60.65 60.35 3k5f s ILE 283 Cb -0.10 -2.14 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 3k5f s ILE 283 CO 0.29 0.52 -0.03 -0.44 0.00 0.00 0.00 174.94 175.28 3k5f s SER 284 N 0.60 4.66 -0.22 3.58 0.01 0.30 0.90 113.70 123.53 3k5f s SER 284 Ca -0.09 -0.22 -0.03 0.00 1.31 0.00 0.00 55.95 56.93 3k5f s SER 284 Cb -0.16 -1.78 0.00 0.00 0.21 0.00 0.00 66.02 64.30 3k5f s SER 284 CO 0.03 0.09 -0.08 -0.76 0.41 0.00 0.00 173.24 172.94 3k5f s LEU 285 N 0.82 2.79 -0.12 2.44 1.43 -0.04 -0.95 118.68 125.05 3k5f s LEU 285 Ca -0.01 -0.53 -0.16 0.00 -1.03 0.00 0.00 54.13 52.40 3k5f s LEU 285 Cb -0.14 -1.67 -0.04 0.00 0.03 0.00 0.00 46.19 44.36 3k5f s LEU 285 CO 0.02 -0.04 0.40 -0.31 0.23 0.00 0.00 176.35 176.66 3k5f s TYR 286 N 1.42 3.51 0.05 0.29 1.51 0.08 -1.32 117.35 122.89 3k5f s TYR 286 Ca 0.05 0.79 0.06 0.00 -1.01 0.00 0.00 57.07 56.96 3k5f s TYR 286 Cb -0.14 -2.45 -0.03 0.00 -0.11 0.00 0.00 41.96 39.22 3k5f s TYR 286 CO -0.05 0.23 -0.15 -0.51 -1.11 0.00 0.00 175.55 173.96 3k5f s LEU 287 N 0.43 2.80 0.26 -1.29 1.43 0.65 -0.76 118.68 122.19 3k5f s LEU 287 Ca 0.22 -0.37 -0.30 0.00 -1.03 0.00 0.00 54.13 52.65 3k5f s LEU 287 Cb -0.14 -1.63 -0.14 0.00 0.03 0.00 0.00 46.19 44.31 3k5f s LEU 287 CO 0.08 0.24 1.24 0.80 0.23 0.00 0.00 176.35 178.94 3k5f n MET 288 N 1.36 1.70 0.00 1.70 0.00 -0.79 -2.08 117.12 119.01 3k5f n MET 288 Ca -0.16 0.60 0.00 0.00 -0.00 0.00 0.00 57.70 58.15 3k5f n MET 288 Cb 0.52 -2.14 0.00 0.00 0.00 0.00 0.00 33.22 31.60 3k5f n MET 288 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3k5f n GLY 289 N 1.64 1.53 0.24 -5.12 0.00 0.82 -4.18 105.19 100.12 3k5f n GLY 289 Ca 0.11 -1.94 0.06 0.00 0.00 0.00 0.00 46.02 44.25 3k5f n GLY 289 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3k5f n GLU 290 N 0.00 2.11 -4.36 1.61 -0.58 -1.25 -4.43 120.64 113.73 3k5f n GLU 290 Ca 0.00 -0.57 -0.19 0.00 -0.42 0.00 0.00 57.16 55.98 3k5f n GLU 290 Cb 0.00 -1.15 -0.10 0.00 -0.57 0.00 0.00 31.44 29.62 3k5f n GLU 290 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 3k5f s VAL 291 N -1.68 1.63 -0.05 2.62 -7.23 -1.26 -5.07 120.40 109.35 3k5f s VAL 291 Ca 0.09 -2.17 -0.39 0.00 -1.81 0.00 0.00 61.98 57.71 3k5f s VAL 291 Cb 0.10 -2.15 -0.18 0.00 0.56 0.00 0.00 36.38 34.72 3k5f s VAL 291 CO 0.35 -0.52 1.38 0.41 -0.31 0.00 0.00 175.10 176.41 3k5f n THR 292 N -0.42 0.06 -1.70 5.32 -1.04 -1.26 -1.50 114.28 113.74 3k5f n THR 292 Ca -0.07 -0.01 -0.17 0.00 -2.04 0.00 0.00 64.05 61.76 3k5f n THR 292 Cb 0.61 -0.68 -0.06 0.00 -1.82 0.00 0.00 70.33 68.38 3k5f n THR 292 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 3k5f n ASN 293 N 2.96 -4.56 -4.53 8.00 3.02 -1.26 -4.96 115.26 113.93 3k5f n ASN 293 Ca 0.21 0.34 -0.34 0.00 -0.03 0.00 0.00 54.58 54.77 3k5f n ASN 293 Cb 0.13 -4.06 -0.12 0.00 -0.61 0.00 0.00 39.78 35.13 3k5f n ASN 293 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 3k5f s GLN 294 N -3.79 3.11 0.33 3.52 -0.44 -0.56 -1.12 119.66 120.70 3k5f s GLN 294 Ca 0.00 -0.56 0.06 0.00 -2.50 0.00 0.00 55.36 52.36 3k5f s GLN 294 Cb 0.00 -2.69 -0.02 0.00 -1.64 0.00 0.00 33.01 28.66 3k5f s GLN 294 CO 0.00 0.48 0.22 -1.13 0.50 0.00 0.00 175.29 175.36 3k5f n SER 295 N 2.77 -0.01 -3.78 6.67 3.41 -0.24 -0.12 113.62 122.32 3k5f n SER 295 Ca -0.18 -3.01 -0.10 0.00 -0.26 0.00 0.00 58.87 55.32 3k5f n SER 295 Cb 0.53 1.34 -0.05 0.00 -0.26 0.00 0.00 64.21 65.77 3k5f n SER 295 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 3k5f s PHE 296 N -3.15 0.53 0.06 7.33 -0.12 -0.88 -1.44 117.98 120.30 3k5f s PHE 296 Ca 0.31 -0.88 0.02 0.00 -0.05 0.00 0.00 56.93 56.32 3k5f s PHE 296 Cb 0.01 0.14 -0.03 0.00 -0.63 0.00 0.00 43.02 42.52 3k5f s PHE 296 CO 0.22 -1.05 -0.07 -0.98 -0.05 0.00 0.00 175.22 173.29 3k5f s ARG 297 N -3.70 0.61 -0.02 1.99 1.70 -0.22 -0.25 118.95 119.06 3k5f s ARG 297 Ca 0.24 -0.96 0.08 0.00 -0.47 0.00 0.00 55.73 54.62 3k5f s ARG 297 Cb -0.01 -0.19 -0.02 0.00 -0.57 0.00 0.00 34.95 34.16 3k5f s ARG 297 CO 0.12 0.01 -0.25 0.96 -1.08 0.00 0.00 175.30 175.05 3k5f s ILE 298 N -2.28 1.99 -0.16 4.99 -4.36 -0.43 -1.34 121.20 119.61 3k5f s ILE 298 Ca -0.02 -1.09 -0.03 0.00 -0.26 0.00 0.00 60.65 59.25 3k5f s ILE 298 Cb -0.04 -1.65 -0.02 0.00 1.25 0.00 0.00 42.46 41.99 3k5f s ILE 298 CO -0.02 0.56 -0.05 -0.89 0.24 0.00 0.00 174.94 174.78 3k5f s THR 299 N -0.60 3.76 -0.22 8.37 2.01 -0.34 -0.86 115.64 127.76 3k5f s THR 299 Ca 0.10 -0.40 -0.07 0.00 0.31 0.00 0.00 61.69 61.63 3k5f s THR 299 Cb -0.10 -2.64 -0.03 0.00 0.01 0.00 0.00 72.50 69.74 3k5f s THR 299 CO -0.01 0.49 0.05 -0.63 -0.69 0.00 0.00 174.62 173.83 3k5f s ILE 300 N 0.44 4.35 0.35 1.82 -1.09 0.26 -3.57 121.20 123.76 3k5f s ILE 300 Ca -0.04 -0.17 -0.04 0.00 -2.23 0.00 0.00 60.65 58.17 3k5f s ILE 300 Cb -0.14 -3.00 -0.04 0.00 -1.58 0.00 0.00 42.46 37.69 3k5f s ILE 300 CO 0.03 0.39 0.62 -0.76 -1.23 0.00 0.00 174.94 173.99 3k5f s LEU 301 N 1.13 3.94 0.56 2.97 1.43 -1.26 -0.56 118.68 126.88 3k5f s LEU 301 Ca 0.04 0.72 0.24 0.00 -1.03 0.00 0.00 54.13 54.10 3k5f s LEU 301 Cb -0.14 -3.59 1.52 0.00 0.03 0.00 0.00 46.19 44.01 3k5f s LEU 301 CO 0.03 -0.32 2.12 1.55 0.23 0.00 0.00 176.35 179.95 3k5f h PRO 302 N 1.08 0.00 0.00 1.29 0.13 -1.82 0.45 132.00 133.14 3k5f h PRO 302 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 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 0.64 0.00 0.00 1.04 -0.23 0.00 0.00 178.00 179.45 3k5f n GLN 303 N -4.14 0.00 -0.11 0.86 3.00 -1.26 -1.20 117.38 114.54 3k5f n GLN 303 Ca 0.01 0.41 -0.16 0.00 -0.01 0.00 0.00 57.00 57.25 3k5f n GLN 303 Cb 0.28 -1.51 -0.06 0.00 0.00 0.00 0.00 30.24 28.96 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 -1.51 0.55 0.00 -1.09 6.02 0.16 -4.53 117.38 116.97 3k5f n GLN 304 Ca 0.01 0.26 0.06 0.00 -0.01 0.00 0.00 57.00 57.32 3k5f n GLN 304 Cb 0.07 -1.48 0.33 0.00 1.02 0.00 0.00 30.24 30.18 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 -4.40 0.00 -3.83 1.08 0.18 -1.10 -4.15 117.16 104.94 3k5f n TYR 305 Ca -0.28 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.17 3k5f n TYR 305 Cb 0.63 0.00 -0.12 0.00 -0.38 0.00 0.00 39.34 39.47 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 -1.35 4.79 -0.04 -3.48 1.43 -0.34 -0.17 118.68 119.51 3k5f s LEU 306 Ca 0.17 -3.01 -0.30 0.00 -1.03 0.00 0.00 54.13 49.96 3k5f s LEU 306 Cb 0.08 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 3k5f s LEU 306 CO 0.13 -0.28 1.23 -0.60 0.23 0.00 0.00 176.35 177.05 3k5f s ARG 307 N -0.29 4.35 0.23 1.70 3.52 -0.47 -4.74 118.95 123.25 3k5f s ARG 307 Ca 0.18 1.71 -0.30 0.00 -0.13 0.00 0.00 55.73 57.19 3k5f s ARG 307 Cb -0.22 -3.55 -0.09 0.00 -1.56 0.00 0.00 34.95 29.54 3k5f s ARG 307 CO -0.02 -0.45 1.20 -1.25 -0.81 0.00 0.00 175.30 173.97 3k5f s PRO 308 N 2.17 4.50 0.26 5.12 0.04 -1.26 0.21 135.00 146.04 3k5f s PRO 308 Ca 0.57 1.92 0.05 0.00 0.04 0.00 0.00 61.00 63.58 3k5f s PRO 308 Cb -0.26 -3.20 -0.06 0.00 0.04 0.00 0.00 34.50 31.02 3k5f s PRO 308 CO 0.23 -0.05 -0.01 0.14 0.04 0.00 0.00 177.00 177.35 3k5f s VAL 309 N -0.42 1.26 0.30 -0.36 -7.23 -0.16 -4.90 120.40 108.88 3k5f s VAL 309 Ca 0.51 -2.06 -0.29 0.00 -1.81 0.00 0.00 61.98 58.33 3k5f s VAL 309 Cb -0.34 -2.45 -0.13 0.00 0.56 0.00 0.00 36.38 34.02 3k5f s VAL 309 CO 0.40 -0.26 1.29 -0.62 -0.31 0.00 0.00 175.10 175.59 3k5f n GLU 310 N -0.52 1.96 -2.24 4.82 -0.58 -1.26 -4.17 120.64 118.65 3k5f n GLU 310 Ca -0.05 0.69 -0.40 0.00 -0.42 0.00 0.00 57.16 56.98 3k5f n GLU 310 Cb 0.64 -2.27 -0.03 0.00 -0.57 0.00 0.00 31.44 29.22 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 -0.14 6.89 -0.03 1.62 -1.08 -1.26 -4.86 116.67 117.81 3k5f s ASP 311 Ca 0.60 2.52 -0.12 0.00 -0.52 0.00 0.00 52.55 55.04 3k5f s ASP 311 Cb -0.62 -2.64 -0.07 0.00 -1.46 0.00 0.00 42.92 38.13 3k5f s ASP 311 CO 0.58 -0.43 0.58 0.58 0.52 0.00 0.00 175.17 177.00 3k5f h VAL 312 N 2.97 0.00 0.00 1.11 2.07 -1.91 -3.42 116.25 117.07 3k5f h VAL 312 Ca -0.48 -0.47 0.00 0.00 0.82 0.00 0.00 66.70 66.57 3k5f h VAL 312 Cb 1.22 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 3k5f h VAL 312 CO 0.65 0.00 0.00 0.00 0.02 0.00 0.00 177.57 178.24 3k5f n ALA 313 N -2.58 0.00 -3.06 1.67 0.00 -1.26 -5.00 120.51 110.27 3k5f n ALA 313 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.28 3k5f n ALA 313 Cb 0.17 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.57 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 -0.74 0.06 -0.70 0.00 2.01 -1.26 -5.08 115.64 109.93 3k5f s THR 314 Ca 0.00 -0.52 -0.25 0.00 0.31 0.00 0.00 61.69 61.23 3k5f s THR 314 Cb 0.00 -1.11 -0.14 0.00 0.01 0.00 0.00 72.50 71.26 3k5f s THR 314 CO 0.00 -0.28 2.44 -1.20 -0.69 0.00 0.00 174.62 174.89 3k5f n SER 315 N -0.08 1.52 0.00 3.53 7.64 -1.26 -3.72 113.62 121.25 3k5f n SER 315 Ca -0.17 -0.65 0.00 0.00 1.01 0.00 0.00 58.87 59.06 3k5f n SER 315 Cb 0.63 -1.40 0.00 0.00 -1.01 0.00 0.00 64.21 62.43 3k5f n SER 315 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k5f n GLN 316 N 8.57 0.00 -4.98 1.43 10.64 -1.26 -5.13 117.38 126.65 3k5f n GLN 316 Ca 0.47 0.00 -0.27 0.00 -1.83 0.00 0.00 57.00 55.37 3k5f n GLN 316 Cb 0.40 0.00 -0.16 0.00 -0.86 0.00 0.00 30.24 29.62 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 2.42 -0.47 2.61 1.01 -1.24 -1.72 116.67 119.29 3k5f s ASP 317 Ca 0.00 -0.39 -0.23 0.00 0.71 0.00 0.00 52.55 52.64 3k5f s ASP 317 Cb 0.00 -0.51 0.03 0.00 1.01 0.00 0.00 42.92 43.45 3k5f s ASP 317 CO 0.00 0.21 0.82 -1.81 0.21 0.00 0.00 175.17 174.60 3k5f s ASP 318 N -0.21 6.40 0.04 0.27 1.01 0.12 -4.66 116.67 119.65 3k5f s ASP 318 Ca 0.01 -0.15 -0.01 0.00 0.71 0.00 0.00 52.55 53.11 3k5f s ASP 318 Cb -0.10 -2.40 -0.04 0.00 1.01 0.00 0.00 42.92 41.39 3k5f s ASP 318 CO 0.01 -0.97 0.20 0.00 0.21 0.00 0.00 175.17 174.62 3k5f s TYR 320 N -1.45 1.27 -0.00 0.00 1.51 0.33 -0.99 117.35 118.02 3k5f s TYR 320 Ca 0.32 -1.30 0.02 0.00 -1.01 0.00 0.00 57.07 55.11 3k5f s TYR 320 Cb -0.13 -0.67 -0.01 0.00 -0.11 0.00 0.00 41.96 41.04 3k5f s TYR 320 CO 0.25 -0.53 -0.08 0.15 -1.11 0.00 0.00 175.55 174.23 3k5f s LYS 321 N -4.11 0.64 -0.40 -0.62 1.02 0.13 -1.71 119.74 114.70 3k5f s LYS 321 Ca 0.38 -0.31 -0.28 0.00 0.02 0.00 0.00 55.97 55.78 3k5f s LYS 321 Cb 0.07 -0.62 -0.02 0.00 -0.52 0.00 0.00 37.83 36.74 3k5f s LYS 321 CO 0.12 0.17 1.88 0.12 -0.92 0.00 0.00 175.35 176.72 3k5f s PHE 322 N -0.24 1.68 -0.19 3.18 5.36 -1.26 -1.37 117.98 125.15 3k5f s PHE 322 Ca 0.03 0.73 -0.00 0.00 -0.96 0.00 0.00 56.93 56.73 3k5f s PHE 322 Cb -0.03 -4.07 0.16 0.00 -0.34 0.00 0.00 43.02 38.73 3k5f s PHE 322 CO -0.00 -2.82 1.83 0.00 -1.46 0.00 0.00 175.22 172.77 3k5f n ALA 323 N 11.38 4.41 -3.84 11.12 0.00 0.76 -4.19 120.51 140.15 3k5f n ALA 323 Ca 0.24 -1.03 -0.25 0.00 0.00 0.00 0.00 53.44 52.40 3k5f n ALA 323 Cb 0.49 -1.22 -0.17 0.00 0.00 0.00 0.00 19.45 18.55 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 -1.37 0.71 0.34 0.00 1.01 -1.26 -1.81 121.20 118.82 3k5f s ILE 324 Ca 0.19 -0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.77 3k5f s ILE 324 Cb 0.15 -0.82 -0.06 0.00 0.01 0.00 0.00 42.46 41.74 3k5f s ILE 324 CO 0.01 0.29 0.05 -0.94 0.00 0.00 0.00 174.94 174.35 3k5f s SER 325 N 1.83 2.58 0.35 3.58 1.04 -0.51 -4.68 113.70 117.89 3k5f s SER 325 Ca 0.05 -1.38 -0.18 0.00 0.48 0.00 0.00 55.95 54.92 3k5f s SER 325 Cb -0.13 -0.11 -0.10 0.00 0.10 0.00 0.00 66.02 65.79 3k5f s SER 325 CO -0.07 -0.60 0.81 -1.58 0.98 0.00 0.00 173.24 172.79 3k5f s GLN 326 N -3.87 4.11 0.06 4.02 0.74 -1.26 -1.46 119.66 122.00 3k5f s GLN 326 Ca 0.36 0.85 0.03 0.00 0.05 0.00 0.00 55.36 56.65 3k5f s GLN 326 Cb 0.09 -2.40 -0.03 0.00 1.10 0.00 0.00 33.01 31.77 3k5f s GLN 326 CO 0.16 0.12 -0.10 0.45 -0.55 0.00 0.00 175.29 175.37 3k5f s SER 327 N -2.18 1.17 0.00 6.67 0.15 0.12 -4.72 113.70 114.92 3k5f s SER 327 Ca 0.56 -0.59 0.06 0.00 0.70 0.00 0.00 55.95 56.68 3k5f s SER 327 Cb -0.11 0.01 0.09 0.00 -1.71 0.00 0.00 66.02 64.30 3k5f s SER 327 CO 0.16 -0.17 0.85 -1.54 1.20 0.00 0.00 173.24 173.75 3k5f n SER 328 N 1.33 1.87 -1.34 5.45 3.41 -1.26 -2.67 113.62 120.41 3k5f n SER 328 Ca -0.22 -1.51 -0.04 0.00 -0.26 0.00 0.00 58.87 56.84 3k5f n SER 328 Cb 0.55 -0.04 0.11 0.00 -0.26 0.00 0.00 64.21 64.57 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 0.27 1.98 0.00 6.66 -2.24 -1.26 -4.84 114.28 114.84 3k5f n THR 329 Ca 0.05 -3.27 0.00 0.00 -2.27 0.00 0.00 64.05 58.55 3k5f n THR 329 Cb 0.22 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.19 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 -0.76 0.07 3.75 3.38 0.00 -1.21 -4.54 105.19 105.87 3k5f n GLY 330 Ca 0.25 -1.98 -0.40 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.07 3.91 -0.17 2.61 2.01 0.19 -4.33 115.64 118.80 3k5f s THR 331 Ca 0.00 1.81 0.00 0.00 0.31 0.00 0.00 61.69 63.82 3k5f s THR 331 Cb 0.00 -4.16 0.04 0.00 0.01 0.00 0.00 72.50 68.39 3k5f s THR 331 CO 0.00 0.39 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.54 3k5f s VAL 332 N -0.81 1.36 -0.83 3.82 1.01 0.84 -1.58 120.40 124.21 3k5f s VAL 332 Ca 0.45 -0.73 -0.18 0.00 0.00 0.00 0.00 61.98 61.51 3k5f s VAL 332 Cb -0.28 -1.45 0.14 0.00 0.00 0.00 0.00 36.38 34.79 3k5f s VAL 332 CO 0.35 0.22 0.97 -0.04 0.00 0.00 0.00 175.10 176.60 3k5f s MET 333 N 1.53 3.46 0.00 2.72 -1.94 0.11 -0.80 119.30 124.38 3k5f s MET 333 Ca 0.01 -1.73 0.00 0.00 -1.71 0.00 0.00 55.69 52.26 3k5f s MET 333 Cb -0.15 -4.65 0.00 0.00 2.01 0.00 0.00 34.83 32.04 3k5f s MET 333 CO -0.08 -1.65 0.00 0.41 -0.01 0.00 0.00 175.02 173.69 3k5f n GLY 334 N 5.15 -0.42 0.22 -0.03 0.00 -1.09 -1.36 105.19 107.66 3k5f n GLY 334 Ca 0.14 -1.73 -0.02 0.00 0.00 0.00 0.00 46.02 44.40 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 -1.66 0.69 -0.09 4.61 0.00 0.17 -1.28 119.26 121.71 3k5f h ALA 335 Ca 0.00 0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.00 3k5f h ALA 335 Cb 0.00 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 3k5f h ALA 335 CO 0.00 -0.17 0.09 -0.39 0.00 0.00 0.00 179.25 178.78 3k5f h VAL 336 N 0.42 0.56 0.22 0.00 -1.51 -1.47 0.42 116.25 114.89 3k5f h VAL 336 Ca 0.26 0.00 -0.31 0.00 -1.23 0.00 0.00 66.70 65.42 3k5f h VAL 336 Cb 0.27 0.93 0.03 0.00 -2.13 0.00 0.00 31.29 30.39 3k5f h VAL 336 CO -0.25 0.00 -1.41 0.40 -1.23 0.00 0.00 177.57 175.09 3k5f h ILE 337 N 0.00 1.25 0.00 7.19 1.08 -1.53 -3.33 117.51 122.17 3k5f h ILE 337 Ca 0.04 -2.63 -0.11 0.00 -0.39 0.00 0.00 64.86 61.78 3k5f h ILE 337 Cb 0.23 3.02 -0.02 0.00 -3.07 0.00 0.00 36.82 36.98 3k5f h ILE 337 CO -0.00 0.80 -0.50 0.24 -0.69 0.00 0.00 178.15 177.99 3k5f h MET 338 N 0.03 0.00 -0.80 2.37 2.86 -0.21 -3.31 114.93 115.86 3k5f h MET 338 Ca -0.25 0.00 0.17 0.00 -2.06 0.00 0.00 59.70 57.56 3k5f h MET 338 Cb 2.05 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 33.60 3k5f h MET 338 CO 0.23 0.50 0.31 0.93 1.06 0.00 0.00 176.91 179.94 3k5f h GLU 339 N 0.00 0.39 0.00 1.72 5.08 -0.33 0.02 114.58 121.46 3k5f h GLU 339 Ca -0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3k5f h GLU 339 Cb 0.94 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 30.10 3k5f h GLU 339 CO 0.07 0.26 0.00 0.41 -1.00 0.00 0.00 179.01 178.74 3k5f n GLY 340 N -1.34 -0.94 3.34 -3.84 0.00 -1.25 -4.68 105.19 96.48 3k5f n GLY 340 Ca 0.17 -0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 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 -2.72 1.59 -0.25 1.61 0.40 -0.01 -2.37 117.98 116.25 3k5f s PHE 341 Ca 0.14 -1.04 -0.09 0.00 -0.60 0.00 0.00 56.93 55.33 3k5f s PHE 341 Cb 0.12 -0.95 -0.04 0.00 0.51 0.00 0.00 43.02 42.65 3k5f s PHE 341 CO 0.28 -0.16 0.13 -0.47 0.70 0.00 0.00 175.22 175.70 3k5f s TYR 342 N -3.55 3.21 -0.20 0.36 5.04 0.15 -4.40 117.35 117.96 3k5f s TYR 342 Ca 0.33 -0.01 -0.03 0.00 -2.44 0.00 0.00 57.07 54.92 3k5f s TYR 342 Cb 0.07 -2.27 -0.01 0.00 0.35 0.00 0.00 41.96 40.10 3k5f s TYR 342 CO 0.11 -0.12 -0.05 0.08 -1.34 0.00 0.00 175.55 174.23 3k5f s VAL 343 N 1.36 3.41 -0.28 3.14 1.01 -0.12 -2.04 120.40 126.87 3k5f s VAL 343 Ca 0.06 -0.50 -0.09 0.00 0.00 0.00 0.00 61.98 61.46 3k5f s VAL 343 Cb -0.15 -2.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.69 3k5f s VAL 343 CO 0.06 0.45 0.13 -0.69 0.00 0.00 0.00 175.10 175.04 3k5f s VAL 344 N 1.13 4.57 -0.95 2.92 1.01 0.76 -0.26 120.40 129.58 3k5f s VAL 344 Ca 0.02 -0.27 -0.15 0.00 0.00 0.00 0.00 61.98 61.57 3k5f s VAL 344 Cb -0.15 -3.24 0.18 0.00 0.00 0.00 0.00 36.38 33.17 3k5f s VAL 344 CO -0.01 0.19 1.03 -0.36 0.00 0.00 0.00 175.10 175.95 3k5f s PHE 345 N 1.63 3.52 -1.23 5.22 0.08 0.27 -0.08 117.98 127.40 3k5f s PHE 345 Ca 0.05 -1.84 -0.12 0.00 0.12 0.00 0.00 56.93 55.14 3k5f s PHE 345 Cb -0.16 -4.07 0.17 0.00 -0.57 0.00 0.00 43.02 38.39 3k5f s PHE 345 CO 0.06 -1.24 1.55 -3.47 -0.10 0.00 0.00 175.22 172.02 3k5f n ASP 346 N 5.09 5.21 -0.34 1.36 -0.08 -0.06 -2.26 116.55 125.47 3k5f n ASP 346 Ca 0.22 -3.02 0.00 0.00 -1.51 0.00 0.00 54.79 50.48 3k5f n ASP 346 Cb 0.47 -1.54 0.14 0.00 2.34 0.00 0.00 41.12 42.53 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 6.73 1.10 -0.73 -0.67 3.08 -1.75 -0.92 114.38 121.23 3k5f h ARG 347 Ca 0.34 -0.07 0.12 0.00 0.07 0.00 0.00 59.98 60.44 3k5f h ARG 347 Cb 0.80 -0.25 -0.05 0.00 0.08 0.00 0.00 29.97 30.56 3k5f h ARG 347 CO 1.34 0.73 0.49 0.00 -1.07 0.00 0.00 179.97 181.46 3k5f h ALA 348 N 1.41 2.00 -0.19 0.04 0.00 -1.57 -1.74 119.26 119.19 3k5f h ALA 348 Ca 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.30 3k5f h ALA 348 Cb 0.08 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.78 3k5f h ALA 348 CO -0.15 -0.18 0.00 0.54 0.00 0.00 0.00 179.25 179.47 3k5f n ARG 349 N -4.49 2.52 -3.95 0.00 1.74 -0.85 -5.00 116.66 106.63 3k5f n ARG 349 Ca 0.13 -2.64 -0.31 0.00 -0.77 0.00 0.00 57.85 54.27 3k5f n ARG 349 Cb 0.44 -1.66 -0.01 0.00 -1.02 0.00 0.00 32.46 30.21 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 -0.63 -2.01 -3.63 5.56 5.02 -0.42 -4.92 118.16 117.13 3k5f n LYS 350 Ca 0.18 0.33 -0.10 0.00 -2.02 0.00 0.00 58.31 56.69 3k5f n LYS 350 Cb 0.75 -4.00 -0.04 0.00 -0.02 0.00 0.00 35.03 31.72 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 -6.65 1.08 -0.11 1.97 1.70 -0.79 -1.55 118.95 114.60 3k5f s ARG 351 Ca 0.19 -0.71 0.02 0.00 -0.47 0.00 0.00 55.73 54.77 3k5f s ARG 351 Cb -0.08 0.47 0.01 0.00 -0.57 0.00 0.00 34.95 34.78 3k5f s ARG 351 CO 0.91 -0.43 -0.18 0.42 -1.08 0.00 0.00 175.30 174.94 3k5f s ILE 352 N -3.80 1.70 -0.00 4.99 1.01 0.12 -0.88 121.20 124.33 3k5f s ILE 352 Ca 0.03 -0.77 -0.01 0.00 0.00 0.00 0.00 60.65 59.89 3k5f s ILE 352 Cb 0.02 -1.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.93 3k5f s ILE 352 CO -0.12 0.48 0.13 -0.83 0.00 0.00 0.00 174.94 174.60 3k5f s GLY 353 N 0.80 2.09 -0.02 6.18 0.00 0.89 -0.92 107.32 116.33 3k5f s GLY 353 Ca -0.10 -0.83 0.04 0.00 0.00 0.00 0.00 44.72 43.84 3k5f s GLY 353 CO 0.01 -0.71 -0.15 -1.36 0.00 0.00 0.00 173.10 170.89 3k5f s PHE 354 N -1.26 1.39 0.04 1.90 0.40 0.95 -0.17 117.98 121.23 3k5f s PHE 354 Ca 0.25 -0.33 -0.16 0.00 -0.60 0.00 0.00 56.93 56.09 3k5f s PHE 354 Cb -0.12 -0.93 0.03 0.00 0.51 0.00 0.00 43.02 42.51 3k5f s PHE 354 CO 0.16 -0.08 0.36 0.00 0.70 0.00 0.00 175.22 176.36 3k5f s ALA 355 N -0.13 -0.85 0.17 5.36 0.00 -0.87 -0.64 121.76 124.80 3k5f s ALA 355 Ca 0.01 0.19 -0.32 0.00 0.00 0.00 0.00 51.96 51.84 3k5f s ALA 355 Cb -0.08 0.31 -0.12 0.00 0.00 0.00 0.00 23.12 23.23 3k5f s ALA 355 CO 0.00 -0.42 1.76 0.28 0.00 0.00 0.00 175.76 177.38 3k5f n VAL 356 N 0.61 0.14 -2.46 0.00 0.31 -1.23 0.30 118.33 115.99 3k5f n VAL 356 Ca -0.19 -0.02 -0.35 0.00 -0.01 0.00 0.00 64.34 63.77 3k5f n VAL 356 Cb 0.59 -1.99 -0.03 0.00 -0.91 0.00 0.00 33.84 31.50 3k5f n VAL 356 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 3k5f s SER 357 N 1.75 6.26 0.27 4.52 0.15 -1.00 -1.11 113.70 124.53 3k5f s SER 357 Ca 0.78 2.03 0.26 0.00 0.70 0.00 0.00 55.95 59.71 3k5f s SER 357 Cb -0.51 -2.57 0.82 0.00 -1.71 0.00 0.00 66.02 62.05 3k5f s SER 357 CO 0.35 -0.84 1.75 0.00 1.20 0.00 0.00 173.24 175.70 3k5f h ALA 358 N 1.66 1.00 -1.89 5.45 0.00 -0.60 -3.43 119.26 121.44 3k5f h ALA 358 Ca -0.49 0.00 -0.60 0.00 0.00 0.00 0.00 54.91 53.82 3k5f h ALA 358 Cb 1.23 0.00 -0.11 0.00 0.00 0.00 0.00 17.79 18.91 3k5f h ALA 358 CO 0.59 0.00 0.60 0.00 0.00 0.00 0.00 179.25 180.44 3k5f h HIS 360 N 9.12 -0.04 0.00 0.00 2.76 -1.98 -3.45 115.15 121.56 3k5f h HIS 360 Ca -0.24 -0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.93 3k5f h HIS 360 Cb 1.07 0.01 0.00 0.00 1.55 0.00 0.00 27.41 30.05 3k5f h HIS 360 CO 0.88 0.65 0.00 1.55 -1.30 0.00 0.00 177.93 179.71 3k5f n VAL 361 N -4.73 0.00 -0.56 5.26 3.14 -1.26 -5.01 118.33 115.17 3k5f n VAL 361 Ca -0.08 0.00 0.01 0.00 -2.96 0.00 0.00 64.34 61.31 3k5f n VAL 361 Cb 0.34 0.00 -0.01 0.00 -1.06 0.00 0.00 33.84 33.12 3k5f n VAL 361 CO 0.00 0.00 0.00 0.54 -6.46 0.00 0.00 176.83 170.91 3k5f n ARG 366 N 0.00 -0.22 -3.56 1.45 5.12 -1.26 -5.10 116.66 113.09 3k5f n ARG 366 Ca 0.00 0.17 -0.12 0.00 -1.93 0.00 0.00 57.85 55.98 3k5f n ARG 366 Cb 0.00 -0.72 -0.05 0.00 -1.16 0.00 0.00 32.46 30.53 3k5f n ARG 366 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 3k5f s THR 367 N -4.46 0.00 1.07 0.55 -1.32 -1.26 -5.17 115.64 105.05 3k5f s THR 367 Ca 0.00 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.32 3k5f s THR 367 Cb 0.00 -1.00 0.23 0.00 -1.51 0.00 0.00 72.50 70.22 3k5f s THR 367 CO 0.00 0.00 1.16 0.00 -2.21 0.00 0.00 174.62 173.57 3k5f s ALA 368 N -1.24 1.21 0.07 11.08 0.00 -1.26 -4.99 121.76 126.63 3k5f s ALA 368 Ca -0.03 -0.84 -0.04 0.00 0.00 0.00 0.00 51.96 51.05 3k5f s ALA 368 Cb -0.00 -2.92 -0.02 0.00 0.00 0.00 0.00 23.12 20.17 3k5f s ALA 368 CO 0.03 -3.00 0.07 0.00 0.00 0.00 0.00 175.76 172.85 3k5f s ALA 369 N -3.23 0.20 -0.15 0.00 0.00 -1.23 -4.93 121.76 112.41 3k5f s ALA 369 Ca 0.69 -0.96 -0.01 0.00 0.00 0.00 0.00 51.96 51.68 3k5f s ALA 369 Cb -0.11 0.39 0.04 0.00 0.00 0.00 0.00 23.12 23.45 3k5f s ALA 369 CO 0.55 -0.44 -0.02 0.08 0.00 0.00 0.00 175.76 175.94 3k5f s VAL 370 N -3.90 0.79 0.07 0.00 1.01 -1.26 -1.20 120.40 115.91 3k5f s VAL 370 Ca 0.07 -0.46 0.06 0.00 0.00 0.00 0.00 61.98 61.65 3k5f s VAL 370 Cb 0.07 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.36 3k5f s VAL 370 CO -0.10 0.06 -0.15 -1.61 0.00 0.00 0.00 175.10 173.29 3k5f s GLU 371 N 1.77 0.90 0.04 2.72 2.02 -0.45 -4.95 118.70 120.75 3k5f s GLU 371 Ca 0.01 -0.95 -0.28 0.00 0.02 0.00 0.00 54.97 53.77 3k5f s GLU 371 Cb -0.15 -0.95 0.10 0.00 0.10 0.00 0.00 34.13 33.22 3k5f s GLU 371 CO -0.07 0.22 1.20 0.20 0.02 0.00 0.00 175.26 176.82 3k5f s GLY 372 N -1.64 -0.25 0.50 -1.39 0.00 -1.26 -1.05 107.32 102.22 3k5f s GLY 372 Ca 0.00 0.32 -0.03 0.00 0.00 0.00 0.00 44.72 45.01 3k5f s GLY 372 CO 0.02 1.46 0.77 2.56 0.00 0.00 0.00 173.10 177.92 3k5f s PRO 373 N -2.46 3.15 0.18 2.90 0.04 -1.26 -5.10 135.00 132.46 3k5f s PRO 373 Ca 0.18 -0.14 0.05 0.00 0.04 0.00 0.00 61.00 61.13 3k5f s PRO 373 Cb 0.02 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 32.09 3k5f s PRO 373 CO -0.01 -0.38 -0.09 -0.06 0.04 0.00 0.00 177.00 176.50 3k5f s PHE 374 N -2.74 1.46 -0.09 0.56 0.40 -0.52 -4.98 117.98 112.06 3k5f s PHE 374 Ca 0.49 -0.75 0.01 0.00 -0.60 0.00 0.00 56.93 56.08 3k5f s PHE 374 Cb -0.10 -0.75 -0.02 0.00 0.51 0.00 0.00 43.02 42.65 3k5f s PHE 374 CO 0.42 0.13 -0.10 0.54 0.70 0.00 0.00 175.22 176.90 3k5f s VAL 375 N -3.25 3.36 -0.12 -0.44 0.11 -1.26 -1.08 120.40 117.72 3k5f s VAL 375 Ca 0.21 -0.59 -0.07 0.00 -2.93 0.00 0.00 61.98 58.61 3k5f s VAL 375 Cb 0.03 -2.38 0.05 0.00 -1.53 0.00 0.00 36.38 32.54 3k5f s VAL 375 CO 0.04 0.56 0.29 -0.89 -3.33 0.00 0.00 175.10 171.78 3k5f s THR 376 N -0.35 -0.03 0.42 5.04 2.01 -0.28 -4.92 115.64 117.53 3k5f s THR 376 Ca 0.04 0.12 -0.05 0.00 0.31 0.00 0.00 61.69 62.11 3k5f s THR 376 Cb -0.12 -0.44 -0.04 0.00 0.01 0.00 0.00 72.50 71.90 3k5f s THR 376 CO 0.02 0.05 0.71 -0.76 -0.69 0.00 0.00 174.62 173.95 3k5f s LEU 377 N 1.21 3.79 -1.55 4.42 1.43 -1.26 -4.27 118.68 122.45 3k5f s LEU 377 Ca -0.09 0.86 -0.03 0.00 -1.03 0.00 0.00 54.13 53.85 3k5f s LEU 377 Cb -0.09 -3.77 0.03 0.00 0.03 0.00 0.00 46.19 42.39 3k5f s LEU 377 CO -0.09 -0.44 0.20 0.47 0.23 0.00 0.00 176.35 176.72 3k5f n ASP 378 N -1.79 0.17 -0.29 2.29 10.43 -1.26 -4.84 116.55 121.25 3k5f n ASP 378 Ca -0.00 -1.19 0.00 0.00 2.57 0.00 0.00 54.79 56.17 3k5f n ASP 378 Cb 0.55 -2.05 0.13 0.00 1.84 0.00 0.00 41.12 41.59 3k5f n ASP 378 CO 0.00 0.00 0.00 0.24 -1.07 0.00 0.00 177.20 176.37 3k5f h MET 379 N -1.71 0.89 -0.28 -1.24 2.86 -1.99 -2.02 114.93 111.44 3k5f h MET 379 Ca -0.64 -0.05 0.07 0.00 -2.06 0.00 0.00 59.70 57.01 3k5f h MET 379 Cb 1.39 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 32.84 3k5f h MET 379 CO 0.71 0.59 0.20 0.93 1.06 0.00 0.00 176.91 180.39 3k5f h GLU 380 N 0.91 0.07 0.00 1.72 4.39 -1.97 -1.16 114.58 118.54 3k5f h GLU 380 Ca 0.36 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.06 3k5f h GLU 380 Cb 0.18 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.82 3k5f h GLU 380 CO -0.18 0.04 0.00 -0.25 -1.16 0.00 0.00 179.01 177.47 3k5f n ASP 381 N -4.47 0.05 0.24 1.42 8.00 -0.76 -2.06 116.55 118.98 3k5f n ASP 381 Ca 0.03 0.51 0.15 0.00 0.71 0.00 0.00 54.79 56.19 3k5f n ASP 381 Cb 0.31 -0.52 0.45 0.00 -0.02 0.00 0.00 41.12 41.34 3k5f n ASP 381 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k5f s GLY 383 N -4.15 2.88 0.16 0.00 0.00 -0.88 -3.84 107.32 101.50 3k5f s GLY 383 Ca 0.04 0.84 -0.17 0.00 0.00 0.00 0.00 44.72 45.43 3k5f s GLY 383 CO 0.59 1.35 0.62 -0.47 0.00 0.00 0.00 173.10 175.19 3k5f s TYR 384 N -1.43 3.65 0.00 1.90 5.04 -1.26 -4.97 117.35 120.28 3k5f s TYR 384 Ca 0.53 1.21 0.00 0.00 -2.44 0.00 0.00 57.07 56.37 3k5f s TYR 384 Cb -0.28 -2.48 0.00 0.00 0.35 0.00 0.00 41.96 39.56 3k5f s TYR 384 CO 0.35 0.42 0.18 0.09 -1.34 0.00 0.00 175.55 175.24