#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k5g h PHE 47 N 0.00 0.00 -0.06 0.66 0.04 -1.97 -2.70 116.94 112.91 3k5g h PHE 47 Ca 0.00 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.79 3k5g h PHE 47 Cb 0.00 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.15 3k5g h PHE 47 CO 0.00 0.00 0.04 -0.24 -0.60 0.00 0.00 178.31 177.51 3k5g h VAL 48 N 0.00 0.97 0.00 -0.55 3.04 -2.01 0.21 116.25 117.92 3k5g h VAL 48 Ca -0.00 -0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3k5g h VAL 48 Cb 0.15 0.97 0.00 0.00 -2.01 0.00 0.00 31.29 30.40 3k5g h VAL 48 CO 0.00 0.00 0.00 -0.33 -1.01 0.00 0.00 177.57 176.23 3k5g h GLU 1 N 0.00 0.00 0.00 4.17 5.08 -1.89 -2.88 114.58 119.06 3k5g h GLU 1 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3k5g h GLU 1 Cb 0.11 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.36 3k5g h GLU 1 CO -0.00 0.00 -0.56 -1.33 -1.00 0.00 0.00 179.01 176.12 3k5g n MET 2 N -2.45 3.07 -1.70 2.33 2.81 0.74 -4.63 117.12 117.30 3k5g n MET 2 Ca -0.01 -0.00 -0.44 0.00 -1.81 0.00 0.00 57.70 55.44 3k5g n MET 2 Cb 0.09 -1.06 -0.02 0.00 -0.71 0.00 0.00 33.22 31.51 3k5g n MET 2 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 3k5g n VAL 3 N -1.28 1.13 -1.22 2.03 0.31 -1.09 -2.32 118.33 115.88 3k5g n VAL 3 Ca 0.02 -0.28 -0.08 0.00 -0.01 0.00 0.00 64.34 63.99 3k5g n VAL 3 Cb 0.19 -1.63 -0.03 0.00 -0.91 0.00 0.00 33.84 31.45 3k5g n VAL 3 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 3k5g n ASP 4 N 1.94 -3.96 -0.25 4.52 2.03 -1.20 -4.89 116.55 114.73 3k5g n ASP 4 Ca 0.10 0.19 0.06 0.00 0.52 0.00 0.00 54.79 55.66 3k5g n ASP 4 Cb 0.34 -2.14 0.29 0.00 -0.72 0.00 0.00 41.12 38.89 3k5g n ASP 4 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 3k5g n ASN 5 N 0.68 0.75 -4.56 1.67 6.94 -0.98 -4.77 115.26 114.97 3k5g n ASN 5 Ca -0.08 -1.75 -0.31 0.00 -0.02 0.00 0.00 54.58 52.43 3k5g n ASN 5 Cb 0.26 -0.07 -0.10 0.00 -2.36 0.00 0.00 39.78 37.50 3k5g n ASN 5 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3k5g s LEU 6 N -1.32 3.01 0.16 -4.53 1.43 -0.40 -4.35 118.68 112.68 3k5g s LEU 6 Ca 0.21 -0.31 -0.00 0.00 -1.03 0.00 0.00 54.13 53.00 3k5g s LEU 6 Cb 0.10 -1.78 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 3k5g s LEU 6 CO 0.16 0.23 0.05 -0.13 0.23 0.00 0.00 176.35 176.89 3k5g s ARG 7 N -1.82 1.03 0.00 1.70 1.81 -0.70 -2.51 118.95 118.46 3k5g s ARG 7 Ca 0.19 -1.50 0.00 0.00 -1.72 0.00 0.00 55.73 52.70 3k5g s ARG 7 Cb -0.11 0.08 0.00 0.00 -0.45 0.00 0.00 34.95 34.47 3k5g s ARG 7 CO 0.10 -0.24 0.00 0.41 -0.68 0.00 0.00 175.30 174.89 3k5g n GLY 8 N -0.17 0.36 3.70 -3.53 0.00 -0.86 0.03 105.19 104.72 3k5g n GLY 8 Ca -0.05 -0.83 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 3k5g n GLY 8 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k5g s LYS 9 N -2.00 2.82 0.14 1.61 1.02 -1.25 -0.76 119.74 121.33 3k5g s LYS 9 Ca 0.00 -0.59 -0.34 0.00 0.02 0.00 0.00 55.97 55.05 3k5g s LYS 9 Cb 0.00 -2.69 -0.15 0.00 -0.52 0.00 0.00 37.83 34.46 3k5g s LYS 9 CO 0.00 0.63 1.39 0.45 -0.92 0.00 0.00 175.35 176.90 3k5g n SER 10 N 1.36 2.18 0.00 2.83 2.88 -1.26 -0.91 113.62 120.71 3k5g n SER 10 Ca -0.14 1.12 0.00 0.00 -1.33 0.00 0.00 58.87 58.51 3k5g n SER 10 Cb 0.53 -1.30 0.00 0.00 -0.75 0.00 0.00 64.21 62.69 3k5g n SER 10 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3k5g n GLY 11 N 2.65 0.96 0.18 0.46 0.00 -1.26 -4.86 105.19 103.31 3k5g n GLY 11 Ca 0.16 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.26 3k5g n GLY 11 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 3k5g n GLN 12 N -2.06 1.01 0.00 1.61 6.02 -0.09 -4.85 117.38 119.02 3k5g n GLN 12 Ca 0.00 -2.25 0.00 0.00 -0.01 0.00 0.00 57.00 54.74 3k5g n GLN 12 Cb 0.00 -1.28 0.00 0.00 1.02 0.00 0.00 30.24 29.98 3k5g n GLN 12 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3k5g n GLY 13 N -1.12 -1.24 3.26 1.08 0.00 -1.25 -4.74 105.19 101.18 3k5g n GLY 13 Ca 0.13 -1.61 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 3k5g n GLY 13 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k5g s TYR 14 N -1.68 2.31 0.14 1.61 1.51 -1.26 -3.91 117.35 116.07 3k5g s TYR 14 Ca 0.00 -0.64 0.09 0.00 -1.01 0.00 0.00 57.07 55.51 3k5g s TYR 14 Cb 0.00 -1.52 -0.04 0.00 -0.11 0.00 0.00 41.96 40.30 3k5g s TYR 14 CO 0.00 -0.18 -0.20 1.52 -1.11 0.00 0.00 175.55 175.59 3k5g s TYR 15 N -0.23 1.83 0.15 2.71 -0.85 0.10 -0.11 117.35 120.96 3k5g s TYR 15 Ca -0.01 -0.45 0.11 0.00 -0.52 0.00 0.00 57.07 56.20 3k5g s TYR 15 Cb -0.13 -0.95 -0.04 0.00 0.38 0.00 0.00 41.96 41.23 3k5g s TYR 15 CO 0.03 0.29 -0.23 0.54 -1.52 0.00 0.00 175.55 174.66 3k5g s VAL 16 N -1.69 2.48 0.22 -3.49 0.11 0.10 -1.73 120.40 116.39 3k5g s VAL 16 Ca 0.12 -1.78 -0.30 0.00 -2.93 0.00 0.00 61.98 57.09 3k5g s VAL 16 Cb -0.07 -2.15 -0.08 0.00 -1.53 0.00 0.00 36.38 32.55 3k5g s VAL 16 CO 0.06 0.01 0.96 -0.70 -3.33 0.00 0.00 175.10 172.11 3k5g s GLU 17 N -2.32 4.80 0.10 1.54 2.12 -1.26 -0.47 118.70 123.21 3k5g s GLU 17 Ca 0.18 1.52 -0.00 0.00 0.36 0.00 0.00 54.97 57.02 3k5g s GLU 17 Cb -0.09 -3.29 -0.04 0.00 0.26 0.00 0.00 34.13 30.96 3k5g s GLU 17 CO 0.09 0.42 0.01 -1.64 -0.54 0.00 0.00 175.26 173.59 3k5g s MET 18 N -0.94 0.83 0.05 4.30 -1.94 0.05 -4.07 119.30 117.59 3k5g s MET 18 Ca 0.43 -1.36 0.08 0.00 -1.71 0.00 0.00 55.69 53.13 3k5g s MET 18 Cb -0.26 0.11 -0.03 0.00 2.01 0.00 0.00 34.83 36.66 3k5g s MET 18 CO 0.32 -0.16 -0.23 0.95 -0.01 0.00 0.00 175.02 175.89 3k5g s THR 19 N -3.90 1.87 -0.02 2.05 -4.23 -0.08 -0.81 115.64 110.52 3k5g s THR 19 Ca 0.17 -1.30 0.05 0.00 -1.18 0.00 0.00 61.69 59.43 3k5g s THR 19 Cb 0.07 -1.61 -0.01 0.00 1.34 0.00 0.00 72.50 72.29 3k5g s THR 19 CO -0.03 0.26 -0.17 0.68 -0.54 0.00 0.00 174.62 174.82 3k5g s VAL 20 N -0.82 1.32 0.00 2.29 -7.23 -0.24 -1.47 120.40 114.25 3k5g s VAL 20 Ca 0.09 -0.71 0.00 0.00 -1.81 0.00 0.00 61.98 59.56 3k5g s VAL 20 Cb -0.09 -1.10 0.00 0.00 0.56 0.00 0.00 36.38 35.74 3k5g s VAL 20 CO 0.02 0.37 0.00 0.61 -0.31 0.00 0.00 175.10 175.80 3k5g n GLY 21 N 2.74 -3.16 2.65 2.32 0.00 0.10 -0.90 105.19 108.94 3k5g n GLY 21 Ca -0.15 -1.81 -0.22 0.00 0.00 0.00 0.00 46.02 43.84 3k5g n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k5g s SER 22 N -1.34 1.58 0.74 1.61 0.01 -1.26 -2.89 113.70 112.14 3k5g s SER 22 Ca 0.00 -0.17 -0.12 0.00 1.31 0.00 0.00 55.95 56.96 3k5g s SER 22 Cb 0.00 -0.17 0.04 0.00 0.21 0.00 0.00 66.02 66.10 3k5g s SER 22 CO 0.00 -0.29 1.11 -2.16 0.41 0.00 0.00 173.24 172.31 3k5g s PRO 23 N 2.16 2.38 0.10 12.44 0.04 -1.26 -0.88 135.00 149.98 3k5g s PRO 23 Ca 0.04 1.30 -0.35 0.00 0.04 0.00 0.00 61.00 62.03 3k5g s PRO 23 Cb -0.13 -1.90 -0.14 0.00 0.04 0.00 0.00 34.50 32.36 3k5g s PRO 23 CO -0.05 -1.56 1.57 -2.30 0.04 0.00 0.00 177.00 174.69 3k5g n PRO 24 N -3.11 1.92 -3.84 0.56 -0.02 -1.14 -4.91 135.00 124.45 3k5g n PRO 24 Ca 0.10 0.69 -0.36 0.00 -2.02 0.00 0.00 63.50 61.91 3k5g n PRO 24 Cb 0.52 -2.44 -0.11 0.00 -0.02 0.00 0.00 33.50 31.45 3k5g n PRO 24 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3k5g s GLN 25 N 1.27 3.88 -0.01 -0.52 -0.21 -0.08 -4.90 119.66 119.08 3k5g s GLN 25 Ca 0.82 -0.38 -0.24 0.00 0.02 0.00 0.00 55.36 55.59 3k5g s GLN 25 Cb -0.75 -3.34 -0.05 0.00 1.00 0.00 0.00 33.01 29.87 3k5g s GLN 25 CO 0.42 0.05 0.71 0.99 -2.12 0.00 0.00 175.29 175.34 3k5g s THR 26 N 1.01 4.90 -0.02 -0.19 2.01 -1.26 -1.08 115.64 121.01 3k5g s THR 26 Ca 0.05 1.49 -0.07 0.00 0.31 0.00 0.00 61.69 63.48 3k5g s THR 26 Cb -0.14 -4.06 0.01 0.00 0.01 0.00 0.00 72.50 68.32 3k5g s THR 26 CO 0.03 0.32 0.15 -0.76 -0.69 0.00 0.00 174.62 173.67 3k5g s LEU 27 N 0.31 1.48 -0.08 4.42 1.43 0.01 -4.97 118.68 121.27 3k5g s LEU 27 Ca 0.37 -0.00 -0.20 0.00 -1.03 0.00 0.00 54.13 53.27 3k5g s LEU 27 Cb -0.19 0.64 -0.04 0.00 0.03 0.00 0.00 46.19 46.63 3k5g s LEU 27 CO 0.20 -0.26 0.56 0.20 0.23 0.00 0.00 176.35 177.28 3k5g s ASN 28 N -0.84 6.82 -0.14 2.29 0.01 -1.26 -0.77 114.94 121.06 3k5g s ASN 28 Ca -0.09 0.98 0.01 0.00 -0.71 0.00 0.00 52.86 53.05 3k5g s ASN 28 Cb -0.05 -2.33 0.02 0.00 0.41 0.00 0.00 41.25 39.29 3k5g s ASN 28 CO 0.01 -0.01 -0.15 -0.63 -1.51 0.00 0.00 177.10 174.81 3k5g s ILE 29 N 0.50 1.61 0.25 0.60 -1.09 0.38 -0.81 121.20 122.64 3k5g s ILE 29 Ca 0.30 -0.68 -0.30 0.00 -2.23 0.00 0.00 60.65 57.74 3k5g s ILE 29 Cb -0.16 -1.49 -0.10 0.00 -1.58 0.00 0.00 42.46 39.13 3k5g s ILE 29 CO 0.14 0.46 1.45 -0.22 -1.23 0.00 0.00 174.94 175.54 3k5g s LEU 30 N 1.25 4.38 -0.27 2.97 0.20 0.01 -0.72 118.68 126.51 3k5g s LEU 30 Ca 0.00 2.69 -0.16 0.00 0.69 0.00 0.00 54.13 57.35 3k5g s LEU 30 Cb -0.14 -3.62 -0.03 0.00 -0.43 0.00 0.00 46.19 41.97 3k5g s LEU 30 CO -0.07 -0.71 0.41 0.68 -0.29 0.00 0.00 176.35 176.37 3k5g s VAL 31 N -0.03 5.14 -0.32 1.68 -7.23 0.84 0.17 120.40 120.65 3k5g s VAL 31 Ca 0.59 0.63 -0.00 0.00 -1.81 0.00 0.00 61.98 61.39 3k5g s VAL 31 Cb -0.42 -3.74 0.10 0.00 0.56 0.00 0.00 36.38 32.88 3k5g s VAL 31 CO 0.44 0.12 0.10 -0.62 -0.31 0.00 0.00 175.10 174.83 3k5g s ASP 32 N 1.62 4.08 0.00 4.85 2.15 -0.25 -4.21 116.67 124.91 3k5g s ASP 32 Ca 0.17 -1.70 0.25 0.00 0.43 0.00 0.00 52.55 51.69 3k5g s ASP 32 Cb -0.16 -0.92 1.38 0.00 -0.30 0.00 0.00 42.92 42.92 3k5g s ASP 32 CO 0.10 -0.41 1.84 0.35 -0.17 0.00 0.00 175.17 176.88 3k5g n THR 33 N 4.77 0.10 0.46 1.71 -2.24 -1.26 -1.04 114.28 116.78 3k5g n THR 33 Ca -0.01 0.03 0.09 0.00 -2.27 0.00 0.00 64.05 61.89 3k5g n THR 33 Cb 0.42 -0.63 0.25 0.00 -2.10 0.00 0.00 70.33 68.27 3k5g n THR 33 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k5g n GLY 34 N 0.66 1.32 2.81 3.38 0.00 -1.26 -4.23 105.19 107.87 3k5g n GLY 34 Ca 0.16 -0.57 -0.09 0.00 0.00 0.00 0.00 46.02 45.52 3k5g n GLY 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k5g n SER 35 N 1.00 -1.52 0.00 1.61 3.41 -1.20 -5.00 113.62 111.91 3k5g n SER 35 Ca 0.18 -2.32 0.00 0.00 -0.26 0.00 0.00 58.87 56.46 3k5g n SER 35 Cb 0.45 2.62 0.00 0.00 -0.26 0.00 0.00 64.21 67.02 3k5g n SER 35 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 3k5g n SER 36 N -1.52 0.19 -4.85 4.04 7.64 -1.26 -0.69 113.62 117.17 3k5g n SER 36 Ca -0.04 -1.06 -0.37 0.00 1.01 0.00 0.00 58.87 58.41 3k5g n SER 36 Cb 0.46 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.60 3k5g n SER 36 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3k5g s ASN 37 N -0.06 6.39 -0.29 6.43 -0.87 -1.26 -4.51 114.94 120.77 3k5g s ASN 37 Ca 0.00 0.47 -0.14 0.00 -1.57 0.00 0.00 52.86 51.62 3k5g s ASN 37 Cb 0.00 -2.09 -0.03 0.00 -0.02 0.00 0.00 41.25 39.11 3k5g s ASN 37 CO 0.00 0.35 0.33 0.12 -2.57 0.00 0.00 177.10 175.33 3k5g s PHE 38 N -0.75 3.23 0.00 2.20 5.99 -1.26 -1.42 117.98 125.98 3k5g s PHE 38 Ca 0.15 0.23 -0.00 0.00 0.00 0.00 0.00 56.93 57.30 3k5g s PHE 38 Cb -0.12 -2.55 -0.00 0.00 0.00 0.00 0.00 43.02 40.34 3k5g s PHE 38 CO 0.04 -0.27 -0.00 0.00 -0.00 0.00 0.00 175.22 174.99 3k5g s ALA 39 N 1.99 0.01 0.01 11.12 0.00 -0.60 -0.89 121.76 133.39 3k5g s ALA 39 Ca 0.12 -0.04 0.02 0.00 0.00 0.00 0.00 51.96 52.06 3k5g s ALA 39 Cb -0.16 0.01 -0.01 0.00 0.00 0.00 0.00 23.12 22.96 3k5g s ALA 39 CO 0.11 -0.01 -0.06 0.14 0.00 0.00 0.00 175.76 175.94 3k5g s VAL 40 N -0.12 0.41 0.15 0.00 -7.23 -0.63 -0.04 120.40 112.94 3k5g s VAL 40 Ca -0.01 -0.53 -0.34 0.00 -1.81 0.00 0.00 61.98 59.29 3k5g s VAL 40 Cb -0.01 -0.41 -0.15 0.00 0.56 0.00 0.00 36.38 36.37 3k5g s VAL 40 CO -0.00 -0.09 1.41 0.61 -0.31 0.00 0.00 175.10 176.72 3k5g n GLY 41 N 2.40 0.68 0.51 2.32 0.00 0.32 -0.51 105.19 110.90 3k5g n GLY 41 Ca -0.17 0.63 0.03 0.00 0.00 0.00 0.00 46.02 46.51 3k5g n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5g n ALA 42 N 2.59 2.14 -3.27 4.61 0.00 -0.15 -1.03 120.51 125.41 3k5g n ALA 42 Ca 0.16 -1.56 -0.14 0.00 0.00 0.00 0.00 53.44 51.91 3k5g n ALA 42 Cb 0.25 -0.49 -0.06 0.00 0.00 0.00 0.00 19.45 19.15 3k5g n ALA 42 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k5g s ALA 43 N -0.73 -1.21 0.44 0.00 0.00 -1.19 -4.82 121.76 114.24 3k5g s ALA 43 Ca 0.11 0.55 -0.24 0.00 0.00 0.00 0.00 51.96 52.38 3k5g s ALA 43 Cb 0.11 0.31 -0.10 0.00 0.00 0.00 0.00 23.12 23.44 3k5g s ALA 43 CO -0.01 -0.45 1.04 -2.30 0.00 0.00 0.00 175.76 174.04 3k5g n PRO 44 N 0.57 1.39 -3.65 0.00 -0.02 -1.26 -4.95 135.00 127.07 3k5g n PRO 44 Ca -0.19 0.50 -0.15 0.00 -2.02 0.00 0.00 63.50 61.65 3k5g n PRO 44 Cb 0.59 -2.10 -0.08 0.00 -0.02 0.00 0.00 33.50 31.90 3k5g n PRO 44 CO 0.00 0.00 0.00 -1.58 1.98 0.00 0.00 175.50 175.90 3k5g s HIS 45 N -1.29 -0.55 0.55 6.00 2.46 -1.26 -5.05 115.29 116.16 3k5g s HIS 45 Ca 0.64 1.15 0.25 0.00 0.47 0.00 0.00 55.06 57.57 3k5g s HIS 45 Cb -0.54 0.25 1.47 0.00 -0.13 0.00 0.00 32.58 33.63 3k5g s HIS 45 CO 0.56 -0.41 2.05 -1.35 -2.47 0.00 0.00 174.74 173.12 3k5g h PRO 46 N 4.29 0.00 -0.02 2.88 0.11 -2.03 -1.47 132.00 135.77 3k5g h PRO 46 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 3k5g h PRO 46 Cb 1.16 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3k5g h PRO 46 CO 0.27 0.00 -0.31 1.19 -0.21 0.00 0.00 178.00 178.94 3k5g n PHE 47 N -4.17 0.00 -3.30 0.65 0.99 -1.26 -4.88 117.46 105.48 3k5g n PHE 47 Ca 0.05 0.00 -0.39 0.00 -0.00 0.00 0.00 57.45 57.11 3k5g n PHE 47 Cb 0.43 -0.01 -0.07 0.00 -1.00 0.00 0.00 39.48 38.83 3k5g n PHE 47 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 3k5g s LEU 48 N -2.34 4.13 0.24 4.37 1.43 -0.56 -4.58 118.68 121.38 3k5g s LEU 48 Ca 0.22 0.58 0.05 0.00 -1.03 0.00 0.00 54.13 53.96 3k5g s LEU 48 Cb 0.19 -2.62 0.26 0.00 0.03 0.00 0.00 46.19 44.05 3k5g s LEU 48 CO 0.49 -0.16 1.57 0.45 0.23 0.00 0.00 176.35 178.92 3k5g h HIS 49 N 7.53 0.27 -3.16 0.29 3.86 -1.86 -3.43 115.15 118.65 3k5g h HIS 49 Ca -0.34 -0.10 0.03 0.00 -1.16 0.00 0.00 60.37 58.80 3k5g h HIS 49 Cb 1.16 -0.05 -0.06 0.00 1.06 0.00 0.00 27.41 29.52 3k5g h HIS 49 CO 0.70 0.76 0.15 -0.98 0.86 0.00 0.00 177.93 179.42 3k5g s ARG 50 N -3.74 1.77 0.14 2.45 1.70 -1.26 -5.15 118.95 114.86 3k5g s ARG 50 Ca -0.04 -1.10 -0.23 0.00 -0.47 0.00 0.00 55.73 53.90 3k5g s ARG 50 Cb 0.12 0.58 0.07 0.00 -0.57 0.00 0.00 34.95 35.14 3k5g s ARG 50 CO 0.79 -0.80 0.58 1.52 -1.08 0.00 0.00 175.30 176.32 3k5g s TYR 51 N -3.80 -0.51 -0.00 5.89 -0.85 -1.26 -4.92 117.35 111.89 3k5g s TYR 51 Ca 0.14 0.34 -0.30 0.00 -0.52 0.00 0.00 57.07 56.73 3k5g s TYR 51 Cb -0.05 0.52 -0.07 0.00 0.38 0.00 0.00 41.96 42.74 3k5g s TYR 51 CO 0.08 -0.82 1.76 -0.47 -1.52 0.00 0.00 175.55 174.58 3k5g s TYR 52 N -3.57 1.82 -0.53 -3.49 5.04 -0.20 -4.94 117.35 111.47 3k5g s TYR 52 Ca 0.00 -0.00 -0.06 0.00 -2.44 0.00 0.00 57.07 54.57 3k5g s TYR 52 Cb -0.01 -4.03 0.14 0.00 0.35 0.00 0.00 41.96 38.41 3k5g s TYR 52 CO -0.11 -4.42 0.37 -0.65 -1.34 0.00 0.00 175.55 169.40 3k5g s GLN 53 N 3.95 2.48 0.46 4.97 -0.21 -1.26 -4.42 119.66 125.63 3k5g s GLN 53 Ca 0.78 -2.08 0.13 0.00 0.02 0.00 0.00 55.36 54.21 3k5g s GLN 53 Cb -0.37 -3.82 1.06 0.00 1.00 0.00 0.00 33.01 30.88 3k5g s GLN 53 CO 0.34 -1.17 2.07 0.00 -2.12 0.00 0.00 175.29 174.42 3k5g h ARG 54 N 7.85 0.17 -0.42 2.91 3.08 -1.93 -1.30 114.38 124.74 3k5g h ARG 54 Ca -0.10 -0.02 0.05 0.00 0.07 0.00 0.00 59.98 59.98 3k5g h ARG 54 Cb 1.03 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 31.02 3k5g h ARG 54 CO 0.76 0.17 0.28 -0.56 -1.07 0.00 0.00 179.97 179.55 3k5g h GLN 55 N 0.17 0.37 -0.06 0.04 -0.00 -2.00 -2.37 115.11 111.27 3k5g h GLN 55 Ca 0.04 -0.02 0.00 0.00 -0.00 0.00 0.00 58.65 58.67 3k5g h GLN 55 Cb 0.08 -0.08 0.00 0.00 -0.00 0.00 0.00 27.48 27.48 3k5g h GLN 55 CO -0.00 0.25 0.00 1.28 -0.00 0.00 0.00 178.83 180.36 3k5g n LEU 56 N -4.48 1.50 -4.39 0.06 4.77 -0.49 -4.83 117.00 109.14 3k5g n LEU 56 Ca 0.05 -0.54 -0.34 0.00 -0.03 0.00 0.00 56.01 55.15 3k5g n LEU 56 Cb 0.21 -0.03 -0.13 0.00 -2.33 0.00 0.00 43.42 41.13 3k5g n LEU 56 CO 0.35 0.27 -0.37 -0.55 -1.33 0.00 0.00 177.39 175.75 3k5g s SER 57 N -1.88 4.48 0.31 -1.43 0.15 -0.89 -4.26 113.70 110.18 3k5g s SER 57 Ca 0.37 -0.29 0.25 0.00 0.70 0.00 0.00 55.95 56.97 3k5g s SER 57 Cb 0.20 -1.75 0.56 0.00 -1.71 0.00 0.00 66.02 63.32 3k5g s SER 57 CO 0.32 0.06 1.67 0.77 1.20 0.00 0.00 173.24 177.25 3k5g h SER 58 N 7.52 0.00 -0.22 5.45 4.64 -1.31 -3.04 113.55 126.58 3k5g h SER 58 Ca -0.36 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.95 3k5g h SER 58 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3k5g h SER 58 CO 0.60 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.91 3k5g n THR 59 N -2.66 0.27 -2.03 2.95 -2.24 -1.26 -4.96 114.28 104.35 3k5g n THR 59 Ca 0.05 -0.60 -0.41 0.00 -2.27 0.00 0.00 64.05 60.81 3k5g n THR 59 Cb 0.48 1.09 -0.02 0.00 -2.10 0.00 0.00 70.33 69.77 3k5g n THR 59 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3k5g s TYR 60 N -1.73 3.03 -0.09 4.78 5.04 -1.15 -4.54 117.35 122.69 3k5g s TYR 60 Ca 0.34 1.05 0.02 0.00 -2.44 0.00 0.00 57.07 56.05 3k5g s TYR 60 Cb 0.21 -3.80 0.01 0.00 0.35 0.00 0.00 41.96 38.73 3k5g s TYR 60 CO 0.31 -2.59 -0.15 1.03 -1.34 0.00 0.00 175.55 172.81 3k5g s ARG 61 N -0.42 2.07 0.03 4.97 0.52 -0.17 -4.99 118.95 120.96 3k5g s ARG 61 Ca 0.59 -0.52 -0.28 0.00 -0.52 0.00 0.00 55.73 54.99 3k5g s ARG 61 Cb -0.41 -1.73 -0.04 0.00 0.52 0.00 0.00 34.95 33.28 3k5g s ARG 61 CO 0.43 -0.01 0.91 0.34 0.02 0.00 0.00 175.30 176.99 3k5g s ASP 62 N 0.83 7.34 0.00 0.23 -1.08 -1.26 -0.33 116.67 122.40 3k5g s ASP 62 Ca -0.10 1.62 0.24 0.00 -0.52 0.00 0.00 52.55 53.78 3k5g s ASP 62 Cb -0.15 -2.54 0.31 0.00 -1.46 0.00 0.00 42.92 39.07 3k5g s ASP 62 CO 0.01 -0.14 1.28 0.18 0.52 0.00 0.00 175.17 177.02 3k5g n LEU 63 N 3.37 1.03 -3.86 -1.34 4.77 -0.68 -4.90 117.00 115.38 3k5g n LEU 63 Ca 0.03 -0.32 -0.28 0.00 -0.03 0.00 0.00 56.01 55.40 3k5g n LEU 63 Cb 0.50 -0.11 0.03 0.00 -2.33 0.00 0.00 43.42 41.51 3k5g n LEU 63 CO 0.50 0.22 0.07 0.54 -1.33 0.00 0.00 177.39 177.39 3k5g n ARG 64 N -1.01 -5.42 -4.34 3.23 1.74 -1.24 -4.99 116.66 104.63 3k5g n ARG 64 Ca 0.08 0.60 -0.18 0.00 -0.77 0.00 0.00 57.85 57.58 3k5g n ARG 64 Cb 0.36 -5.41 -0.14 0.00 -1.02 0.00 0.00 32.46 26.25 3k5g n ARG 64 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3k5g s LYS 65 N -6.47 0.76 0.69 5.56 1.02 -1.26 -5.04 119.74 115.00 3k5g s LYS 65 Ca 0.50 -0.46 -0.07 0.00 0.02 0.00 0.00 55.97 55.96 3k5g s LYS 65 Cb -0.25 -0.72 0.05 0.00 -0.52 0.00 0.00 37.83 36.39 3k5g s LYS 65 CO 0.83 0.19 1.02 0.20 -0.92 0.00 0.00 175.35 176.66 3k5g s GLY 66 N -0.55 1.65 -0.15 -3.33 0.00 -1.26 -0.76 107.32 102.93 3k5g s GLY 66 Ca 0.02 -0.80 -0.29 0.00 0.00 0.00 0.00 44.72 43.65 3k5g s GLY 66 CO 0.00 -0.41 0.76 0.54 0.00 0.00 0.00 173.10 173.98 3k5g s VAL 67 N -3.24 0.00 0.03 1.40 0.11 -0.73 -4.76 120.40 113.22 3k5g s VAL 67 Ca 0.59 0.00 -0.11 0.00 -2.93 0.00 0.00 61.98 59.53 3k5g s VAL 67 Cb -0.11 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.75 3k5g s VAL 67 CO 0.46 0.00 0.23 -0.72 -3.33 0.00 0.00 175.10 171.74 3k5g s TYR 68 N -0.61 -0.01 -0.13 1.54 -0.85 -1.26 -0.66 117.35 115.36 3k5g s TYR 68 Ca -0.06 -0.13 -0.01 0.00 -0.52 0.00 0.00 57.07 56.35 3k5g s TYR 68 Cb -0.02 0.01 0.04 0.00 0.38 0.00 0.00 41.96 42.37 3k5g s TYR 68 CO 0.05 -0.43 -0.01 0.08 -1.52 0.00 0.00 175.55 173.72 3k5g s VAL 69 N -2.27 0.68 -0.29 -3.49 1.01 -0.57 -4.87 120.40 110.60 3k5g s VAL 69 Ca -0.07 -0.27 -0.15 0.00 0.00 0.00 0.00 61.98 61.49 3k5g s VAL 69 Cb -0.02 -0.90 -0.03 0.00 0.00 0.00 0.00 36.38 35.42 3k5g s VAL 69 CO -0.02 0.14 0.36 -2.16 0.00 0.00 0.00 175.10 173.41 3k5g s PRO 70 N 1.83 3.92 0.46 2.72 0.04 -1.26 -2.52 135.00 140.19 3k5g s PRO 70 Ca 0.03 -0.08 -0.02 0.00 0.04 0.00 0.00 61.00 60.97 3k5g s PRO 70 Cb -0.14 -3.69 0.09 0.00 0.04 0.00 0.00 34.50 30.81 3k5g s PRO 70 CO -0.07 -0.32 0.63 0.66 0.04 0.00 0.00 177.00 177.93 3k5g n TYR 71 N 5.33 -3.30 -0.34 0.56 4.01 -0.01 -4.98 117.16 118.43 3k5g n TYR 71 Ca -0.09 -0.96 -0.01 0.00 -0.16 0.00 0.00 57.90 56.68 3k5g n TYR 71 Cb 0.51 -0.46 0.15 0.00 -0.31 0.00 0.00 39.34 39.22 3k5g n TYR 71 CO 0.00 0.00 0.00 1.15 -0.46 0.00 0.00 176.86 177.55 3k5g h THR 72 N -0.70 1.23 -3.46 -0.72 2.02 -2.00 -3.39 112.91 105.88 3k5g h THR 72 Ca -0.21 -0.43 -0.37 0.00 0.77 0.00 0.00 66.41 66.17 3k5g h THR 72 Cb 0.71 -0.15 -0.34 0.00 -1.74 0.00 0.00 68.15 66.63 3k5g h THR 72 CO 0.20 0.23 -0.76 -1.10 0.37 0.00 0.00 175.52 174.47 3k5g s GLN 73 N -6.05 0.50 0.00 6.66 -0.21 -1.26 -5.11 119.66 114.20 3k5g s GLN 73 Ca -0.12 0.02 0.00 0.00 0.02 0.00 0.00 55.36 55.28 3k5g s GLN 73 Cb 0.18 -0.64 0.00 0.00 1.00 0.00 0.00 33.01 33.55 3k5g s GLN 73 CO 0.81 -0.13 0.00 0.41 -2.12 0.00 0.00 175.29 174.26 3k5g n GLY 74 N 4.20 1.80 3.37 3.09 0.00 -1.25 -4.91 105.19 111.48 3k5g n GLY 74 Ca -0.24 -1.73 -0.11 0.00 0.00 0.00 0.00 46.02 43.93 3k5g n GLY 74 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5g s LYS 75 N -3.83 1.15 0.08 1.61 -2.85 -0.79 -0.83 119.74 114.28 3k5g s LYS 75 Ca 0.00 -0.56 -0.04 0.00 -1.00 0.00 0.00 55.97 54.38 3k5g s LYS 75 Cb 0.00 0.52 -0.03 0.00 -2.06 0.00 0.00 37.83 36.26 3k5g s LYS 75 CO 0.00 -0.47 0.07 1.67 0.10 0.00 0.00 175.35 176.72 3k5g s TRP 76 N -3.61 0.47 0.13 1.78 1.48 -1.05 -0.77 118.94 117.37 3k5g s TRP 76 Ca 0.01 -0.94 0.04 0.00 -1.06 0.00 0.00 56.10 54.15 3k5g s TRP 76 Cb 0.00 -0.29 -0.04 0.00 -1.16 0.00 0.00 33.47 31.98 3k5g s TRP 76 CO -0.11 -0.48 -0.10 -1.83 -4.06 0.00 0.00 176.95 170.37 3k5g s GLU 77 N -3.93 1.00 0.00 3.25 -1.05 -0.29 -1.52 118.70 116.17 3k5g s GLU 77 Ca 0.10 -1.39 0.00 0.00 -0.15 0.00 0.00 54.97 53.53 3k5g s GLU 77 Cb 0.07 -0.57 0.00 0.00 -0.44 0.00 0.00 34.13 33.18 3k5g s GLU 77 CO -0.07 0.07 0.00 0.41 0.95 0.00 0.00 175.26 176.61 3k5g n GLY 78 N -0.04 1.68 3.07 -3.83 0.00 0.16 -1.34 105.19 104.89 3k5g n GLY 78 Ca -0.11 -0.42 -0.26 0.00 0.00 0.00 0.00 46.02 45.22 3k5g n GLY 78 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k5g s GLU 79 N 1.68 1.84 0.34 1.61 2.02 -0.44 -1.77 118.70 123.99 3k5g s GLU 79 Ca 0.00 -0.51 -0.21 0.00 0.02 0.00 0.00 54.97 54.27 3k5g s GLU 79 Cb 0.00 -1.52 -0.10 0.00 0.10 0.00 0.00 34.13 32.61 3k5g s GLU 79 CO 0.00 0.10 0.87 -0.51 0.02 0.00 0.00 175.26 175.74 3k5g s LEU 80 N 0.46 4.16 0.25 1.80 1.43 0.06 -0.83 118.68 126.01 3k5g s LEU 80 Ca -0.12 1.61 -0.20 0.00 -1.03 0.00 0.00 54.13 54.39 3k5g s LEU 80 Cb -0.15 -4.13 0.07 0.00 0.03 0.00 0.00 46.19 42.01 3k5g s LEU 80 CO 0.04 -0.17 0.94 -0.83 0.23 0.00 0.00 176.35 176.55 3k5g s GLY 81 N -1.93 0.16 0.22 -3.19 0.00 -0.70 -1.68 107.32 100.20 3k5g s GLY 81 Ca 0.54 -0.43 0.09 0.00 0.00 0.00 0.00 44.72 44.91 3k5g s GLY 81 CO 0.19 1.20 -0.16 -0.51 0.00 0.00 0.00 173.10 173.82 3k5g s THR 82 N -2.38 1.89 0.23 0.90 -4.23 0.55 -0.64 115.64 111.97 3k5g s THR 82 Ca 0.18 -2.24 -0.21 0.00 -1.18 0.00 0.00 61.69 58.24 3k5g s THR 82 Cb -0.03 -2.08 0.06 0.00 1.34 0.00 0.00 72.50 71.78 3k5g s THR 82 CO 0.07 -0.55 0.92 -0.62 -0.54 0.00 0.00 174.62 173.91 3k5g s ASP 83 N -3.32 -0.08 0.05 3.99 -1.08 -1.01 -0.99 116.67 114.21 3k5g s ASP 83 Ca 0.24 -0.69 -0.25 0.00 -0.52 0.00 0.00 52.55 51.32 3k5g s ASP 83 Cb -0.02 0.60 -0.05 0.00 -1.46 0.00 0.00 42.92 41.99 3k5g s ASP 83 CO 0.08 -1.16 0.77 -0.76 0.52 0.00 0.00 175.17 174.62 3k5g s LEU 84 N -3.13 4.45 -0.03 -1.34 1.43 -1.26 -1.34 118.68 117.46 3k5g s LEU 84 Ca 0.16 1.46 0.03 0.00 -1.03 0.00 0.00 54.13 54.75 3k5g s LEU 84 Cb -0.03 -3.24 0.00 0.00 0.03 0.00 0.00 46.19 42.95 3k5g s LEU 84 CO 0.06 0.01 -0.12 -0.69 0.23 0.00 0.00 176.35 175.84 3k5g s VAL 85 N -0.05 1.00 0.17 -1.59 1.01 0.14 -0.72 120.40 120.36 3k5g s VAL 85 Ca 0.39 -0.47 0.03 0.00 0.00 0.00 0.00 61.98 61.93 3k5g s VAL 85 Cb -0.21 -0.88 -0.05 0.00 0.00 0.00 0.00 36.38 35.24 3k5g s VAL 85 CO 0.23 0.30 -0.04 -0.44 0.00 0.00 0.00 175.10 175.16 3k5g s SER 86 N 0.21 1.57 -0.32 3.32 0.01 -0.54 -1.22 113.70 116.73 3k5g s SER 86 Ca -0.05 -1.11 0.02 0.00 1.31 0.00 0.00 55.95 56.12 3k5g s SER 86 Cb -0.10 0.04 0.10 0.00 0.21 0.00 0.00 66.02 66.27 3k5g s SER 86 CO 0.01 -0.46 0.06 -0.63 0.41 0.00 0.00 173.24 172.63 3k5g s ILE 87 N -3.48 1.59 0.22 1.44 1.01 -1.26 -0.90 121.20 119.82 3k5g s ILE 87 Ca 0.21 -1.82 -0.09 0.00 0.00 0.00 0.00 60.65 58.96 3k5g s ILE 87 Cb 0.05 -2.15 0.18 0.00 0.01 0.00 0.00 42.46 40.55 3k5g s ILE 87 CO 0.03 -0.58 1.70 -0.65 0.00 0.00 0.00 174.94 175.44 3k5g h PRO 88 N 7.85 0.25 -2.00 2.79 0.11 -1.90 -0.64 132.00 138.47 3k5g h PRO 88 Ca -0.10 -0.02 -0.76 0.00 0.11 0.00 0.00 66.00 65.24 3k5g h PRO 88 Cb 1.02 -0.06 -0.28 0.00 0.11 0.00 0.00 31.00 31.79 3k5g h PRO 88 CO 0.49 0.17 0.89 0.72 -0.21 0.00 0.00 178.00 180.06 3k5g n HIS 89 N -5.14 3.01 -2.78 0.65 8.25 -1.26 -4.91 115.22 113.04 3k5g n HIS 89 Ca 0.10 -2.44 0.00 0.00 -0.26 0.00 0.00 57.72 55.12 3k5g n HIS 89 Cb 0.35 -1.09 0.00 0.00 1.12 0.00 0.00 29.99 30.37 3k5g n HIS 89 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k5g n GLY 90 N -0.47 4.94 3.73 -1.41 0.00 -0.25 -4.46 105.19 107.26 3k5g n GLY 90 Ca 0.51 -1.31 -0.34 0.00 0.00 0.00 0.00 46.02 44.89 3k5g n GLY 90 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k5g s PRO 91 N 1.09 2.15 -1.27 1.61 0.04 -1.26 -4.87 135.00 132.50 3k5g s PRO 91 Ca 0.00 1.67 -0.13 0.00 0.04 0.00 0.00 61.00 62.58 3k5g s PRO 91 Cb 0.00 -1.84 0.14 0.00 0.04 0.00 0.00 34.50 32.84 3k5g s PRO 91 CO 0.00 -1.81 1.67 -1.71 0.04 0.00 0.00 177.00 175.20 3k5g n ASN 92 N -2.82 5.03 -4.05 6.66 4.05 -1.26 -4.62 115.26 118.26 3k5g n ASN 92 Ca 0.13 -2.99 -0.08 0.00 0.45 0.00 0.00 54.58 52.08 3k5g n ASN 92 Cb 0.51 -1.58 -0.09 0.00 1.23 0.00 0.00 39.78 39.84 3k5g n ASN 92 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 177.26 174.89 3k5g s VAL 93 N 1.83 0.17 -0.06 3.44 -7.23 -1.26 -5.15 120.40 112.14 3k5g s VAL 93 Ca 0.44 -1.67 0.03 0.00 -1.81 0.00 0.00 61.98 58.97 3k5g s VAL 93 Cb 0.03 -1.62 0.01 0.00 0.56 0.00 0.00 36.38 35.36 3k5g s VAL 93 CO 0.01 -0.76 -0.15 -0.89 -0.31 0.00 0.00 175.10 172.99 3k5g s THR 94 N -3.94 1.36 0.08 5.32 2.01 -1.26 -4.42 115.64 114.78 3k5g s THR 94 Ca 0.11 -0.63 0.07 0.00 0.31 0.00 0.00 61.69 61.54 3k5g s THR 94 Cb 0.07 -1.20 -0.03 0.00 0.01 0.00 0.00 72.50 71.35 3k5g s THR 94 CO -0.07 0.40 -0.18 0.68 -0.69 0.00 0.00 174.62 174.76 3k5g s VAL 95 N 0.39 1.44 -0.28 3.82 -7.23 -0.36 -4.90 120.40 113.28 3k5g s VAL 95 Ca -0.11 -1.36 -0.24 0.00 -1.81 0.00 0.00 61.98 58.45 3k5g s VAL 95 Cb -0.14 -1.32 -0.00 0.00 0.56 0.00 0.00 36.38 35.47 3k5g s VAL 95 CO 0.04 -0.08 0.82 -0.60 -0.31 0.00 0.00 175.10 174.98 3k5g s ARG 96 N -1.68 4.08 0.14 4.82 3.52 -1.26 0.24 118.95 128.81 3k5g s ARG 96 Ca 0.03 0.79 0.06 0.00 -0.13 0.00 0.00 55.73 56.49 3k5g s ARG 96 Cb -0.10 -3.69 -0.04 0.00 -1.56 0.00 0.00 34.95 29.57 3k5g s ARG 96 CO 0.03 -0.61 -0.15 0.00 -0.81 0.00 0.00 175.30 173.76 3k5g s ALA 97 N 2.94 1.64 0.32 6.12 0.00 -0.45 -4.93 121.76 127.40 3k5g s ALA 97 Ca 0.34 -1.37 -0.29 0.00 0.00 0.00 0.00 51.96 50.64 3k5g s ALA 97 Cb -0.15 -0.09 -0.10 0.00 0.00 0.00 0.00 23.12 22.78 3k5g s ALA 97 CO 0.10 0.11 1.36 -0.80 0.00 0.00 0.00 175.76 176.54 3k5g s ASN 98 N -2.61 6.68 -0.04 0.00 0.01 -1.26 -2.41 114.94 115.30 3k5g s ASN 98 Ca 0.12 2.75 -0.00 0.00 -0.71 0.00 0.00 52.86 55.01 3k5g s ASN 98 Cb -0.04 -2.65 0.03 0.00 0.41 0.00 0.00 41.25 39.00 3k5g s ASN 98 CO 0.04 -0.63 0.01 -0.63 -1.51 0.00 0.00 177.10 174.38 3k5g s ILE 99 N -0.90 0.18 -0.39 0.60 1.01 0.19 -4.65 121.20 117.25 3k5g s ILE 99 Ca 0.52 0.14 -0.21 0.00 0.00 0.00 0.00 60.65 61.09 3k5g s ILE 99 Cb -0.41 -0.32 0.01 0.00 0.01 0.00 0.00 42.46 41.75 3k5g s ILE 99 CO 0.53 0.18 0.69 0.00 0.00 0.00 0.00 174.94 176.33 3k5g s ALA 100 N 1.39 3.41 -0.57 9.38 0.00 -0.07 -1.72 121.76 133.58 3k5g s ALA 100 Ca -0.04 -0.91 -0.28 0.00 0.00 0.00 0.00 51.96 50.73 3k5g s ALA 100 Cb -0.13 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.74 3k5g s ALA 100 CO -0.03 -1.54 1.27 0.00 0.00 0.00 0.00 175.76 175.47 3k5g s ALA 101 N 2.89 2.94 -0.09 0.00 0.00 -0.01 -1.61 121.76 125.87 3k5g s ALA 101 Ca 0.26 -0.75 -0.30 0.00 0.00 0.00 0.00 51.96 51.18 3k5g s ALA 101 Cb -0.14 -4.06 -0.04 0.00 0.00 0.00 0.00 23.12 18.89 3k5g s ALA 101 CO 0.17 -2.74 1.40 0.42 0.00 0.00 0.00 175.76 175.01 3k5g s ILE 102 N 5.33 3.96 -0.07 0.00 1.01 0.33 -1.33 121.20 130.44 3k5g s ILE 102 Ca 0.47 1.21 0.13 0.00 0.00 0.00 0.00 60.65 62.45 3k5g s ILE 102 Cb -0.09 -3.78 -0.19 0.00 0.01 0.00 0.00 42.46 38.42 3k5g s ILE 102 CO 0.26 -0.08 0.18 0.35 0.00 0.00 0.00 174.94 175.65 3k5g n THR 103 N 5.21 0.39 -3.90 2.92 -2.24 -0.45 -0.97 114.28 115.23 3k5g n THR 103 Ca 0.15 -0.41 -0.10 0.00 -2.27 0.00 0.00 64.05 61.41 3k5g n THR 103 Cb 0.44 -0.20 -0.09 0.00 -2.10 0.00 0.00 70.33 68.38 3k5g n THR 103 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3k5g s GLU 104 N -2.65 0.57 0.13 -0.78 2.02 -1.06 -4.84 118.70 112.08 3k5g s GLU 104 Ca -0.06 -0.64 -0.17 0.00 0.02 0.00 0.00 54.97 54.12 3k5g s GLU 104 Cb 0.06 0.23 0.04 0.00 0.10 0.00 0.00 34.13 34.56 3k5g s GLU 104 CO 0.54 -0.14 0.41 -1.54 0.02 0.00 0.00 175.26 174.55 3k5g s SER 105 N -1.92 -0.26 -0.15 -0.19 1.04 -1.26 -1.14 113.70 109.83 3k5g s SER 105 Ca -0.08 -0.29 -0.04 0.00 0.48 0.00 0.00 55.95 56.02 3k5g s SER 105 Cb -0.03 0.48 0.06 0.00 0.10 0.00 0.00 66.02 66.63 3k5g s SER 105 CO -0.03 -0.86 0.07 -0.62 0.98 0.00 0.00 173.24 172.79 3k5g s ASP 106 N -2.78 2.25 -1.46 7.02 3.68 0.05 -4.86 116.67 120.58 3k5g s ASP 106 Ca 0.03 -0.54 -0.10 0.00 2.13 0.00 0.00 52.55 54.07 3k5g s ASP 106 Cb 0.02 -0.29 0.05 0.00 -1.45 0.00 0.00 42.92 41.24 3k5g s ASP 106 CO -0.12 -0.33 0.90 0.29 0.13 0.00 0.00 175.17 176.04 3k5g n LYS 107 N 5.24 -5.80 -0.03 4.34 5.02 -1.26 -1.89 118.16 123.78 3k5g n LYS 107 Ca -0.07 0.71 -0.04 0.00 -2.02 0.00 0.00 58.31 56.90 3k5g n LYS 107 Cb 0.49 -5.62 -0.01 0.00 -0.02 0.00 0.00 35.03 29.86 3k5g n LYS 107 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 3k5g n PHE 108 N -4.65 0.00 -1.96 2.13 7.35 -1.26 -3.94 117.46 115.13 3k5g n PHE 108 Ca -0.01 0.00 -0.34 0.00 -0.76 0.00 0.00 57.45 56.34 3k5g n PHE 108 Cb 0.56 -0.21 0.03 0.00 0.35 0.00 0.00 39.48 40.20 3k5g n PHE 108 CO 0.00 0.00 0.00 -0.06 -0.76 0.00 0.00 176.76 175.94 3k5g s PHE 109 N -1.91 2.58 -0.09 -5.13 0.40 -1.26 -5.02 117.98 107.55 3k5g s PHE 109 Ca -0.12 1.55 0.04 0.00 -0.60 0.00 0.00 56.93 57.79 3k5g s PHE 109 Cb 0.02 -3.27 -0.01 0.00 0.51 0.00 0.00 43.02 40.27 3k5g s PHE 109 CO 0.18 -1.76 -0.20 0.42 0.70 0.00 0.00 175.22 174.56 3k5g s ILE 110 N -2.02 2.46 0.09 0.64 1.01 -1.26 -5.03 121.20 117.09 3k5g s ILE 110 Ca 0.71 -0.90 -0.35 0.00 0.00 0.00 0.00 60.65 60.11 3k5g s ILE 110 Cb -0.23 -1.96 -0.14 0.00 0.01 0.00 0.00 42.46 40.14 3k5g s ILE 110 CO 0.35 0.56 1.60 -3.20 0.00 0.00 0.00 174.94 174.25 3k5g n ASN 111 N 3.16 2.89 0.00 3.58 5.15 -1.26 -0.79 115.26 128.00 3k5g n ASN 111 Ca -0.18 1.07 0.00 0.00 -0.60 0.00 0.00 54.58 54.87 3k5g n ASN 111 Cb 0.52 -1.37 0.00 0.00 -0.53 0.00 0.00 39.78 38.41 3k5g n ASN 111 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k5g n GLY 112 N 3.48 0.70 3.78 8.20 0.00 -1.26 -4.98 105.19 115.10 3k5g n GLY 112 Ca 0.19 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.85 3k5g n GLY 112 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3k5g s SER 113 N -2.58 5.84 -0.00 1.61 0.15 0.03 -4.96 113.70 113.78 3k5g s SER 113 Ca 0.00 2.17 0.19 0.00 0.70 0.00 0.00 55.95 59.01 3k5g s SER 113 Cb 0.00 -2.58 0.56 0.00 -1.71 0.00 0.00 66.02 62.29 3k5g s SER 113 CO 0.00 -1.14 1.47 -3.20 1.20 0.00 0.00 173.24 171.57 3k5g n ASN 114 N -1.17 3.72 -4.66 5.45 4.05 -1.26 -4.77 115.26 116.61 3k5g n ASN 114 Ca 0.11 -2.02 -0.28 0.00 0.45 0.00 0.00 54.58 52.84 3k5g n ASN 114 Cb 0.51 -0.43 -0.08 0.00 1.23 0.00 0.00 39.78 41.01 3k5g n ASN 114 CO 0.00 0.00 0.00 -1.66 -3.05 0.00 0.00 177.26 172.55 3k5g s TRP 115 N -1.03 2.89 0.00 1.20 1.48 -1.26 -4.57 118.94 117.64 3k5g s TRP 115 Ca 0.42 -0.10 0.00 0.00 -1.06 0.00 0.00 56.10 55.37 3k5g s TRP 115 Cb 0.22 -1.45 0.00 0.00 -1.16 0.00 0.00 33.47 31.08 3k5g s TRP 115 CO 0.28 0.49 0.47 0.39 -4.06 0.00 0.00 176.95 174.52 3k5g n GLU 116 N 0.27 -0.49 -3.07 3.25 4.71 0.01 -4.91 120.64 120.42 3k5g n GLU 116 Ca -0.11 -0.51 -0.05 0.00 -0.01 0.00 0.00 57.16 56.49 3k5g n GLU 116 Cb 0.53 -0.92 0.02 0.00 -1.01 0.00 0.00 31.44 30.07 3k5g n GLU 116 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3k5g n GLY 117 N -0.04 1.08 2.89 0.62 0.00 -1.18 -0.52 105.19 108.04 3k5g n GLY 117 Ca 0.00 -1.15 -0.14 0.00 0.00 0.00 0.00 46.02 44.74 3k5g n GLY 117 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3k5g s ILE 118 N -2.29 0.14 -0.41 -0.61 2.07 0.94 -0.81 121.20 120.23 3k5g s ILE 118 Ca 0.13 -0.05 -0.04 0.00 -1.41 0.00 0.00 60.65 59.28 3k5g s ILE 118 Cb -0.03 -0.14 0.10 0.00 0.13 0.00 0.00 42.46 42.52 3k5g s ILE 118 CO 0.07 0.05 0.20 -0.22 -1.91 0.00 0.00 174.94 173.13 3k5g s LEU 119 N 0.10 5.17 -0.30 8.50 2.96 0.13 -1.55 118.68 133.68 3k5g s LEU 119 Ca -0.01 -1.92 -0.29 0.00 -0.22 0.00 0.00 54.13 51.70 3k5g s LEU 119 Cb -0.02 -1.85 0.00 0.00 0.50 0.00 0.00 46.19 44.82 3k5g s LEU 119 CO -0.00 -0.53 1.24 -0.83 -1.32 0.00 0.00 176.35 174.90 3k5g s GLY 120 N 1.87 1.45 0.00 7.98 0.00 -0.50 -1.09 107.32 117.02 3k5g s GLY 120 Ca 0.06 0.08 0.23 0.00 0.00 0.00 0.00 44.72 45.10 3k5g s GLY 120 CO -0.03 2.50 1.18 1.04 0.00 0.00 0.00 173.10 177.78 3k5g n LEU 121 N 7.36 2.39 0.00 0.66 4.77 -0.21 -4.30 117.00 127.66 3k5g n LEU 121 Ca 0.14 -0.84 0.00 0.00 -0.03 0.00 0.00 56.01 55.28 3k5g n LEU 121 Cb 0.47 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 3k5g n LEU 121 CO 0.62 0.42 0.00 0.00 -1.33 0.00 0.00 177.39 177.10 3k5g n ALA 122 N 0.52 0.00 -2.40 -1.18 0.00 0.14 -4.92 120.51 112.67 3k5g n ALA 122 Ca 0.11 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.34 3k5g n ALA 122 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 3k5g n ALA 122 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3k5g s TYR 123 N -0.49 3.19 0.59 0.00 1.51 -0.49 -4.62 117.35 117.04 3k5g s TYR 123 Ca 0.00 0.05 0.29 0.00 -1.01 0.00 0.00 57.07 56.40 3k5g s TYR 123 Cb 0.00 -2.17 1.81 0.00 -0.11 0.00 0.00 41.96 41.49 3k5g s TYR 123 CO 0.00 -0.20 2.25 0.00 -1.11 0.00 0.00 175.55 176.49 3k5g h ALA 124 N 0.61 1.54 -0.32 3.71 0.00 -1.86 -2.75 119.26 120.19 3k5g h ALA 124 Ca -0.46 -0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.53 3k5g h ALA 124 Cb 1.25 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.03 3k5g h ALA 124 CO 0.56 0.00 0.22 1.49 0.00 0.00 0.00 179.25 181.52 3k5g h GLU 125 N 0.00 0.04 -0.33 0.00 4.57 -1.86 -1.28 114.58 115.73 3k5g h GLU 125 Ca -0.00 -0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3k5g h GLU 125 Cb 0.00 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.58 3k5g h GLU 125 CO 0.00 0.03 0.00 0.44 -1.18 0.00 0.00 179.01 178.30 3k5g n ILE 126 N -4.45 1.72 -2.38 2.32 -5.35 -1.04 -4.71 119.36 105.47 3k5g n ILE 126 Ca 0.04 -1.46 -0.36 0.00 -0.27 0.00 0.00 62.75 60.70 3k5g n ILE 126 Cb 0.36 0.09 -0.02 0.00 -1.74 0.00 0.00 39.64 38.33 3k5g n ILE 126 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3k5g s ALA 127 N -1.99 2.98 0.10 -1.28 0.00 -0.48 -4.64 121.76 116.45 3k5g s ALA 127 Ca 0.35 0.82 0.04 0.00 0.00 0.00 0.00 51.96 53.16 3k5g s ALA 127 Cb 0.25 -3.33 -0.04 0.00 0.00 0.00 0.00 23.12 20.00 3k5g s ALA 127 CO 0.13 -0.48 0.07 1.03 0.00 0.00 0.00 175.76 176.50 3k5g s ARG 128 N -2.72 2.79 0.48 0.00 1.81 -1.26 -3.18 118.95 116.87 3k5g s ARG 128 Ca 0.62 -0.76 0.27 0.00 -1.72 0.00 0.00 55.73 54.15 3k5g s ARG 128 Cb -0.25 -2.66 0.92 0.00 -0.45 0.00 0.00 34.95 32.51 3k5g s ARG 128 CO 0.30 0.55 1.82 -1.00 -0.68 0.00 0.00 175.30 176.29 3k5g h PRO 129 N 3.19 0.00 0.00 3.54 0.13 -1.89 -3.47 132.00 133.50 3k5g h PRO 129 Ca -0.47 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.60 3k5g h PRO 129 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 3k5g h PRO 129 CO 0.64 0.09 0.19 -0.40 -0.23 0.00 0.00 178.00 178.28 3k5g n ASP 130 N -3.18 -1.90 0.00 1.44 5.75 -1.19 -5.04 116.55 112.43 3k5g n ASP 130 Ca 0.01 -2.44 0.07 0.00 -0.01 0.00 0.00 54.79 52.42 3k5g n ASP 130 Cb 0.42 3.20 0.40 0.00 -1.03 0.00 0.00 41.12 44.11 3k5g n ASP 130 CO 0.00 0.00 0.00 -0.90 -0.11 0.00 0.00 177.20 176.19 3k5g n ASP 131 N -1.50 0.00 0.05 -1.12 5.68 -1.25 -2.30 116.55 116.10 3k5g n ASP 131 Ca -0.07 -1.49 0.13 0.00 -0.50 0.00 0.00 54.79 52.86 3k5g n ASP 131 Cb 0.52 0.00 0.34 0.00 -1.14 0.00 0.00 41.12 40.84 3k5g n ASP 131 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3k5g n SER 132 N -0.72 0.56 -4.52 -1.12 3.41 -1.26 -4.65 113.62 105.32 3k5g n SER 132 Ca 0.10 0.25 -0.42 0.00 -0.26 0.00 0.00 58.87 58.55 3k5g n SER 132 Cb 0.05 -0.21 -0.03 0.00 -0.26 0.00 0.00 64.21 63.75 3k5g n SER 132 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 3k5g s LEU 133 N -3.86 3.56 0.12 1.04 2.96 -0.97 -4.97 118.68 116.56 3k5g s LEU 133 Ca 0.10 -0.67 -0.33 0.00 -0.22 0.00 0.00 54.13 53.01 3k5g s LEU 133 Cb 0.15 -2.52 -0.12 0.00 0.50 0.00 0.00 46.19 44.20 3k5g s LEU 133 CO 0.65 -1.70 1.71 1.21 -1.32 0.00 0.00 176.35 176.90 3k5g n GLU 134 N 8.83 2.40 -1.60 1.98 2.13 -1.26 -4.87 120.64 128.23 3k5g n GLU 134 Ca 0.02 0.87 -0.32 0.00 0.66 0.00 0.00 57.16 58.40 3k5g n GLU 134 Cb 0.48 -2.69 0.05 0.00 0.27 0.00 0.00 31.44 29.55 3k5g n GLU 134 CO 0.00 0.00 0.00 -2.14 -0.41 0.00 0.00 177.13 174.58 3k5g s PRO 135 N 1.93 2.79 0.20 5.31 0.02 -1.26 -4.54 135.00 139.44 3k5g s PRO 135 Ca 0.81 1.14 -0.12 0.00 0.02 0.00 0.00 61.00 62.85 3k5g s PRO 135 Cb -0.61 -1.97 0.24 0.00 0.02 0.00 0.00 34.50 32.18 3k5g s PRO 135 CO 0.39 -1.22 1.70 0.35 -0.33 0.00 0.00 177.00 177.89 3k5g h PHE 136 N -0.49 0.13 -0.20 6.54 3.57 -1.81 -2.24 116.94 122.43 3k5g h PHE 136 Ca -0.45 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.01 3k5g h PHE 136 Cb 1.22 0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.97 3k5g h PHE 136 CO 0.59 -0.04 -0.22 0.35 -2.23 0.00 0.00 178.31 176.75 3k5g h PHE 137 N 0.22 0.40 -0.78 0.41 3.57 -1.91 0.71 116.94 119.55 3k5g h PHE 137 Ca 0.28 -0.07 -0.05 0.00 3.53 0.00 0.00 57.97 61.65 3k5g h PHE 137 Cb 0.40 -0.10 -0.03 0.00 2.79 0.00 0.00 35.95 39.01 3k5g h PHE 137 CO -0.26 0.57 0.28 -0.44 -2.23 0.00 0.00 178.31 176.24 3k5g h ASP 138 N 0.33 1.11 -0.57 0.41 3.32 -1.80 -1.36 116.42 117.85 3k5g h ASP 138 Ca 0.05 -0.19 -0.09 0.00 0.02 0.00 0.00 57.03 56.83 3k5g h ASP 138 Cb 0.58 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.82 3k5g h ASP 138 CO 0.04 1.00 0.01 0.28 -1.72 0.00 0.00 179.24 178.85 3k5g h SER 139 N 1.15 0.98 -0.14 6.45 0.02 -0.75 -0.53 113.55 120.73 3k5g h SER 139 Ca 0.26 -0.30 0.02 0.00 -0.84 0.00 0.00 61.79 60.93 3k5g h SER 139 Cb 0.26 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.51 3k5g h SER 139 CO -0.02 1.04 0.02 0.25 -1.14 0.00 0.00 176.83 176.98 3k5g h LEU 140 N 0.89 -0.02 -0.80 5.07 5.85 -0.64 -0.34 115.31 125.32 3k5g h LEU 140 Ca 0.16 0.03 -0.12 0.00 0.84 0.00 0.00 57.88 58.79 3k5g h LEU 140 Cb 0.53 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 3k5g h LEU 140 CO 0.03 0.01 -0.42 0.58 -0.34 0.00 0.00 178.44 178.30 3k5g h VAL 141 N 0.07 1.31 -0.35 1.05 2.07 -1.14 -1.05 116.25 118.21 3k5g h VAL 141 Ca 0.07 -1.58 -0.16 0.00 0.82 0.00 0.00 66.70 65.85 3k5g h VAL 141 Cb 0.07 1.65 -0.01 0.00 -1.52 0.00 0.00 31.29 31.48 3k5g h VAL 141 CO -0.10 0.48 -0.42 0.50 0.02 0.00 0.00 177.57 178.05 3k5g h LYS 142 N 0.32 0.88 0.00 1.57 3.64 -0.76 -3.32 116.57 118.91 3k5g h LYS 142 Ca 0.03 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 58.92 3k5g h LYS 142 Cb 0.88 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 32.72 3k5g h LYS 142 CO 0.07 1.13 -0.94 1.04 -2.27 0.00 0.00 179.45 178.49 3k5g n GLN 143 N -4.04 0.26 -3.63 1.90 6.02 -0.17 -4.95 117.38 112.77 3k5g n GLN 143 Ca -0.03 0.01 -0.17 0.00 -0.01 0.00 0.00 57.00 56.80 3k5g n GLN 143 Cb 0.56 -1.60 -0.05 0.00 1.02 0.00 0.00 30.24 30.17 3k5g n GLN 143 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 3k5g n THR 144 N -1.94 0.00 -0.52 5.09 -2.24 -0.41 -5.04 114.28 109.22 3k5g n THR 144 Ca 0.02 -1.61 0.10 0.00 -2.27 0.00 0.00 64.05 60.29 3k5g n THR 144 Cb 0.43 0.58 0.33 0.00 -2.10 0.00 0.00 70.33 69.57 3k5g n THR 144 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3k5g n HIS 145 N -0.62 1.24 -1.68 4.78 8.25 -1.26 -4.73 115.22 121.20 3k5g n HIS 145 Ca -0.04 -0.57 -0.46 0.00 -0.26 0.00 0.00 57.72 56.38 3k5g n HIS 145 Cb 0.42 -0.15 -0.04 0.00 1.12 0.00 0.00 29.99 31.33 3k5g n HIS 145 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 3k5g n VAL 146 N 1.22 0.38 -1.53 1.59 0.31 -1.26 -4.94 118.33 114.09 3k5g n VAL 146 Ca 0.24 -0.07 -0.36 0.00 -0.01 0.00 0.00 64.34 64.15 3k5g n VAL 146 Cb 0.77 -1.83 0.09 0.00 -0.91 0.00 0.00 33.84 31.96 3k5g n VAL 146 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3k5g n PRO 147 N 5.53 0.82 -1.70 5.55 -0.02 -1.26 -4.66 135.00 139.26 3k5g n PRO 147 Ca 0.20 0.34 -0.41 0.00 -2.02 0.00 0.00 63.50 61.62 3k5g n PRO 147 Cb 0.31 -2.49 -0.01 0.00 -0.02 0.00 0.00 33.50 31.29 3k5g n PRO 147 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3k5g n ASN 148 N -2.27 6.56 -3.48 2.55 5.15 -1.26 -4.27 115.26 118.24 3k5g n ASN 148 Ca 0.15 -2.82 -0.11 0.00 -0.60 0.00 0.00 54.58 51.20 3k5g n ASN 148 Cb 0.49 -1.55 -0.03 0.00 -0.53 0.00 0.00 39.78 38.16 3k5g n ASN 148 CO 0.00 0.00 0.00 -1.48 1.40 0.00 0.00 177.26 177.18 3k5g s LEU 149 N 0.42 -0.47 0.09 1.20 2.34 -1.26 -1.24 118.68 119.76 3k5g s LEU 149 Ca 0.56 0.13 -0.07 0.00 0.06 0.00 0.00 54.13 54.80 3k5g s LEU 149 Cb 0.16 2.26 -0.01 0.00 -0.56 0.00 0.00 46.19 48.04 3k5g s LEU 149 CO -0.07 -0.71 0.16 0.72 -1.06 0.00 0.00 176.35 175.39 3k5g s PHE 150 N -2.90 0.27 0.04 3.48 -0.71 -0.98 -0.34 117.98 116.85 3k5g s PHE 150 Ca 0.01 -0.72 0.03 0.00 -1.04 0.00 0.00 56.93 55.21 3k5g s PHE 150 Cb -0.01 -0.14 -0.02 0.00 -1.21 0.00 0.00 43.02 41.64 3k5g s PHE 150 CO -0.07 -0.53 -0.08 -1.54 -1.34 0.00 0.00 175.22 171.65 3k5g s SER 151 N -2.89 0.95 -0.10 1.98 1.04 -0.30 0.09 113.70 114.47 3k5g s SER 151 Ca 0.07 -0.54 0.01 0.00 0.48 0.00 0.00 55.95 55.98 3k5g s SER 151 Cb 0.05 0.02 0.02 0.00 0.10 0.00 0.00 66.02 66.21 3k5g s SER 151 CO -0.09 -0.17 -0.13 -0.76 0.98 0.00 0.00 173.24 173.06 3k5g s LEU 152 N -1.53 1.62 -0.40 2.42 1.43 0.29 -0.90 118.68 121.61 3k5g s LEU 152 Ca -0.08 -0.38 -0.01 0.00 -1.03 0.00 0.00 54.13 52.62 3k5g s LEU 152 Cb -0.10 -0.99 0.11 0.00 0.03 0.00 0.00 46.19 45.24 3k5g s LEU 152 CO 0.01 -0.00 0.18 -1.58 0.23 0.00 0.00 176.35 175.18 3k5g s GLN 153 N 1.02 1.90 -0.22 1.70 0.74 0.21 -1.39 119.66 123.63 3k5g s GLN 153 Ca -0.07 -1.87 -0.13 0.00 0.05 0.00 0.00 55.36 53.34 3k5g s GLN 153 Cb -0.15 -3.50 -0.04 0.00 1.10 0.00 0.00 33.01 30.42 3k5g s GLN 153 CO -0.01 -1.05 0.28 -0.51 -0.55 0.00 0.00 175.29 173.45 3k5g s LEU 154 N 1.02 4.14 -0.11 3.68 1.43 -1.26 -0.67 118.68 126.91 3k5g s LEU 154 Ca 0.09 0.32 -0.03 0.00 -1.03 0.00 0.00 54.13 53.49 3k5g s LEU 154 Cb -0.22 -2.31 -0.03 0.00 0.03 0.00 0.00 46.19 43.65 3k5g s LEU 154 CO -0.05 -0.00 0.01 0.00 0.23 0.00 0.00 176.35 176.53 3k5g n GLY 156 N 2.60 -2.26 3.74 0.00 0.00 -1.26 -4.00 105.19 104.01 3k5g n GLY 156 Ca -0.18 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 43.88 3k5g n GLY 156 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5g s ALA 157 N -3.32 3.68 0.00 4.61 0.00 -1.26 -4.29 121.76 121.18 3k5g s ALA 157 Ca 0.49 1.38 0.00 0.00 0.00 0.00 0.00 51.96 53.83 3k5g s ALA 157 Cb -0.04 -3.59 0.00 0.00 0.00 0.00 0.00 23.12 19.50 3k5g s ALA 157 CO 0.37 -0.79 0.00 0.41 0.00 0.00 0.00 175.76 175.75 3k5g n GLY 158 N 2.57 1.92 3.11 0.00 0.00 -1.26 -5.13 105.19 106.41 3k5g n GLY 158 Ca 0.09 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.94 3k5g n GLY 158 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k5g s PHE 159 N -1.92 1.00 -1.02 1.61 0.08 -1.26 -5.21 117.98 111.26 3k5g s PHE 159 Ca 0.00 -0.41 -0.25 0.00 0.12 0.00 0.00 56.93 56.39 3k5g s PHE 159 Cb 0.00 -0.58 -0.14 0.00 -0.57 0.00 0.00 43.02 41.73 3k5g s PHE 159 CO 0.00 0.00 2.10 -1.25 -0.10 0.00 0.00 175.22 175.97 3k5g s PRO 160 N -1.40 1.88 0.58 0.24 0.04 -1.26 -4.88 135.00 130.20 3k5g s PRO 160 Ca -0.03 -0.42 0.29 0.00 0.04 0.00 0.00 61.00 60.88 3k5g s PRO 160 Cb -0.09 -5.03 1.75 0.00 0.04 0.00 0.00 34.50 31.17 3k5g s PRO 160 CO 0.01 -4.48 2.23 0.00 0.04 0.00 0.00 177.00 174.79 3k5g h ALA 168 N 11.25 1.51 0.00 8.56 0.00 -1.89 -3.50 119.26 135.19 3k5g h ALA 168 Ca 0.08 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.97 3k5g h ALA 168 Cb 0.98 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3k5g h ALA 168 CO 1.11 0.02 -0.49 0.45 0.00 0.00 0.00 179.25 180.34 3k5g n SER 169 N -3.85 1.02 -4.54 0.00 2.88 -0.84 -5.03 113.62 103.26 3k5g n SER 169 Ca -0.03 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.26 3k5g n SER 169 Cb 0.11 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.46 3k5g n SER 169 CO 0.00 0.00 0.00 0.68 -1.23 0.00 0.00 175.04 174.49 3k5g s VAL 170 N -1.73 1.86 0.17 2.46 -7.23 0.07 -4.53 120.40 111.46 3k5g s VAL 170 Ca 0.00 -2.07 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 3k5g s VAL 170 Cb 0.00 -2.80 -0.00 0.00 0.56 0.00 0.00 36.38 34.14 3k5g s VAL 170 CO 0.00 -0.09 0.22 0.61 -0.31 0.00 0.00 175.10 175.53 3k5g n GLY 171 N -0.82 2.85 0.00 2.32 0.00 -1.26 -2.02 105.19 106.27 3k5g n GLY 171 Ca -0.05 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.40 3k5g n GLY 171 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5g n GLY 172 N -0.30 -1.20 2.99 -0.02 0.00 -1.04 -1.12 105.19 104.50 3k5g n GLY 172 Ca 0.01 -1.00 -0.20 0.00 0.00 0.00 0.00 46.02 44.84 3k5g n GLY 172 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k5g s SER 173 N -4.00 1.13 -0.36 1.61 0.01 0.16 -1.27 113.70 110.98 3k5g s SER 173 Ca 0.00 -0.17 -0.05 0.00 1.31 0.00 0.00 55.95 57.04 3k5g s SER 173 Cb 0.00 -0.29 0.07 0.00 0.21 0.00 0.00 66.02 66.01 3k5g s SER 173 CO 0.00 0.06 0.14 -0.32 0.41 0.00 0.00 173.24 173.53 3k5g s MET 174 N 0.17 2.42 -0.44 12.44 1.75 -1.26 -0.62 119.30 133.76 3k5g s MET 174 Ca -0.03 -1.42 -0.22 0.00 -1.25 0.00 0.00 55.69 52.78 3k5g s MET 174 Cb -0.08 -3.50 0.02 0.00 2.84 0.00 0.00 34.83 34.12 3k5g s MET 174 CO 0.00 -0.82 0.71 0.42 -0.65 0.00 0.00 175.02 174.69 3k5g s ILE 175 N 1.31 4.74 -0.35 10.11 -1.09 -0.08 -4.87 121.20 130.98 3k5g s ILE 175 Ca 0.01 0.27 -0.20 0.00 -2.23 0.00 0.00 60.65 58.50 3k5g s ILE 175 Cb -0.21 -4.26 0.00 0.00 -1.58 0.00 0.00 42.46 36.41 3k5g s ILE 175 CO 0.00 -0.65 0.62 -0.63 -1.23 0.00 0.00 174.94 173.04 3k5g s ILE 176 N 3.04 4.91 0.00 2.92 1.01 -1.26 -1.15 121.20 130.68 3k5g s ILE 176 Ca 0.26 0.58 0.00 0.00 0.00 0.00 0.00 60.65 61.49 3k5g s ILE 176 Cb -0.13 -4.05 0.00 0.00 0.01 0.00 0.00 42.46 38.29 3k5g s ILE 176 CO 0.21 -0.28 0.00 0.61 0.00 0.00 0.00 174.94 175.48 3k5g n GLY 177 N 4.66 0.90 0.00 6.18 0.00 0.54 -4.76 105.19 112.71 3k5g n GLY 177 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3k5g n GLY 177 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k5g n GLY 178 N -2.01 -0.56 3.02 -0.02 0.00 -1.21 -4.40 105.19 100.01 3k5g n GLY 178 Ca 0.00 -0.81 -0.28 0.00 0.00 0.00 0.00 46.02 44.93 3k5g n GLY 178 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k5g s ILE 179 N -3.00 1.42 -0.35 -0.61 1.01 -1.26 -3.98 121.20 114.43 3k5g s ILE 179 Ca 0.00 -0.58 -0.13 0.00 0.00 0.00 0.00 60.65 59.94 3k5g s ILE 179 Cb 0.00 -1.32 -0.01 0.00 0.01 0.00 0.00 42.46 41.14 3k5g s ILE 179 CO 0.00 0.43 0.24 -0.62 0.00 0.00 0.00 174.94 174.99 3k5g s ASP 180 N 1.18 5.98 0.09 3.58 3.68 -1.26 -4.97 116.67 124.95 3k5g s ASP 180 Ca -0.03 -0.55 0.17 0.00 2.13 0.00 0.00 52.55 54.27 3k5g s ASP 180 Cb -0.14 -2.12 0.72 0.00 -1.45 0.00 0.00 42.92 39.94 3k5g s ASP 180 CO -0.04 -0.28 1.53 1.41 0.13 0.00 0.00 175.17 177.92 3k5g n HIS 181 N 5.09 0.27 0.33 -5.34 8.25 -1.26 -2.00 115.22 120.56 3k5g n HIS 181 Ca -0.12 0.11 0.15 0.00 -0.26 0.00 0.00 57.72 57.60 3k5g n HIS 181 Cb 0.49 -0.68 0.60 0.00 1.12 0.00 0.00 29.99 31.52 3k5g n HIS 181 CO 0.00 0.00 0.00 1.03 0.64 0.00 0.00 176.34 178.01 3k5g h SER 182 N 0.00 0.00 -0.01 0.41 0.87 -2.04 -3.29 113.55 109.50 3k5g h SER 182 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 3k5g h SER 182 Cb 0.27 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.23 3k5g h SER 182 CO 0.00 0.00 -0.24 0.18 -0.53 0.00 0.00 176.83 176.24 3k5g n LEU 183 N -2.75 2.37 -3.88 2.23 4.77 -0.85 -4.80 117.00 114.09 3k5g n LEU 183 Ca 0.01 -0.82 -0.09 0.00 -0.03 0.00 0.00 56.01 55.08 3k5g n LEU 183 Cb 0.28 -0.01 -0.08 0.00 -2.33 0.00 0.00 43.42 41.29 3k5g n LEU 183 CO 0.25 0.41 -0.13 -0.72 -1.33 0.00 0.00 177.39 175.87 3k5g s TYR 184 N -2.25 0.17 0.28 -1.77 1.13 -1.24 -0.32 117.35 113.35 3k5g s TYR 184 Ca 0.24 -0.56 0.11 0.00 -1.41 0.00 0.00 57.07 55.45 3k5g s TYR 184 Cb 0.19 -0.09 -0.05 0.00 -1.10 0.00 0.00 41.96 40.91 3k5g s TYR 184 CO 0.44 -0.49 -0.11 0.95 -2.51 0.00 0.00 175.55 173.83 3k5g s THR 185 N -3.51 2.84 0.00 -3.49 -4.23 -0.37 -4.82 115.64 102.05 3k5g s THR 185 Ca 0.02 -2.19 0.00 0.00 -1.18 0.00 0.00 61.69 58.34 3k5g s THR 185 Cb 0.04 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.33 3k5g s THR 185 CO -0.09 -0.37 0.00 0.61 -0.54 0.00 0.00 174.62 174.23 3k5g n GLY 186 N -0.75 -0.88 3.89 3.99 0.00 -1.26 -3.67 105.19 106.51 3k5g n GLY 186 Ca -0.05 -1.16 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 3k5g n GLY 186 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k5g s SER 187 N -4.00 6.53 0.09 1.61 0.01 -1.26 -4.96 113.70 111.72 3k5g s SER 187 Ca 0.00 0.79 -0.28 0.00 1.31 0.00 0.00 55.95 57.77 3k5g s SER 187 Cb 0.00 -2.17 -0.06 0.00 0.21 0.00 0.00 66.02 64.00 3k5g s SER 187 CO 0.00 -0.10 0.88 -0.76 0.41 0.00 0.00 173.24 173.67 3k5g s LEU 188 N -3.08 4.49 -0.08 2.44 1.43 -1.26 -4.48 118.68 118.13 3k5g s LEU 188 Ca 0.45 1.66 0.03 0.00 -1.03 0.00 0.00 54.13 55.25 3k5g s LEU 188 Cb -0.11 -3.45 -0.01 0.00 0.03 0.00 0.00 46.19 42.65 3k5g s LEU 188 CO 0.25 -0.02 -0.19 0.26 0.23 0.00 0.00 176.35 176.88 3k5g s TRP 189 N -0.07 2.62 -0.06 0.29 0.52 -0.18 -4.90 118.94 117.16 3k5g s TRP 189 Ca 0.43 -0.59 0.02 0.00 0.02 0.00 0.00 56.10 55.99 3k5g s TRP 189 Cb -0.22 -1.69 -0.03 0.00 -1.15 0.00 0.00 33.47 30.38 3k5g s TRP 189 CO 0.27 -0.13 -0.11 0.71 0.02 0.00 0.00 176.95 177.71 3k5g s TYR 190 N -0.11 2.81 0.02 -1.98 1.51 -1.26 -0.14 117.35 118.19 3k5g s TYR 190 Ca -0.03 -0.11 0.07 0.00 -1.01 0.00 0.00 57.07 55.99 3k5g s TYR 190 Cb -0.14 -1.68 -0.02 0.00 -0.11 0.00 0.00 41.96 40.01 3k5g s TYR 190 CO 0.04 0.23 -0.21 -0.08 -1.11 0.00 0.00 175.55 174.41 3k5g s THR 191 N -0.70 1.72 0.42 -0.71 -1.32 -0.07 -3.36 115.64 111.61 3k5g s THR 191 Ca 0.11 -1.11 -0.25 0.00 -1.21 0.00 0.00 61.69 59.23 3k5g s THR 191 Cb -0.11 -1.47 -0.08 0.00 -1.51 0.00 0.00 72.50 69.33 3k5g s THR 191 CO 0.01 0.32 1.22 -2.84 -2.21 0.00 0.00 174.62 171.13 3k5g s PRO 192 N -0.92 3.91 -0.31 7.08 0.02 -1.26 -0.24 135.00 143.28 3k5g s PRO 192 Ca 0.08 1.95 -0.29 0.00 0.02 0.00 0.00 61.00 62.76 3k5g s PRO 192 Cb -0.09 -2.62 0.01 0.00 0.02 0.00 0.00 34.50 31.83 3k5g s PRO 192 CO 0.01 -0.48 1.12 0.42 -0.33 0.00 0.00 177.00 177.74 3k5g s ILE 193 N -1.38 4.44 0.13 2.83 1.01 -0.20 -4.56 121.20 123.47 3k5g s ILE 193 Ca 0.59 1.66 -0.15 0.00 0.00 0.00 0.00 60.65 62.75 3k5g s ILE 193 Cb -0.33 -4.35 -0.01 0.00 0.01 0.00 0.00 42.46 37.78 3k5g s ILE 193 CO 0.42 -0.46 1.62 -0.09 0.00 0.00 0.00 174.94 176.43 3k5g h ARG 194 N 8.28 0.67 -2.67 2.79 2.43 -1.21 -3.45 114.38 121.22 3k5g h ARG 194 Ca -0.22 -0.17 -0.11 0.00 -0.81 0.00 0.00 59.98 58.67 3k5g h ARG 194 Cb 1.07 -0.08 -0.24 0.00 -0.42 0.00 0.00 29.97 30.29 3k5g h ARG 194 CO 1.03 0.70 -0.21 0.50 -1.51 0.00 0.00 179.97 180.47 3k5g s ARG 195 N -5.25 0.50 -1.17 0.20 3.52 -1.26 -5.08 118.95 110.41 3k5g s ARG 195 Ca -0.13 0.63 -0.19 0.00 -0.13 0.00 0.00 55.73 55.91 3k5g s ARG 195 Cb 0.10 0.21 0.08 0.00 -1.56 0.00 0.00 34.95 33.78 3k5g s ARG 195 CO 0.78 -0.07 1.57 -1.21 -0.81 0.00 0.00 175.30 175.55 3k5g s GLU 196 N 0.39 3.83 0.00 5.12 2.02 -1.26 -4.12 118.70 124.68 3k5g s GLU 196 Ca -0.01 -1.73 0.00 0.00 0.02 0.00 0.00 54.97 53.25 3k5g s GLU 196 Cb -0.04 -5.39 0.00 0.00 0.10 0.00 0.00 34.13 28.80 3k5g s GLU 196 CO -0.01 -2.17 0.00 -2.67 0.02 0.00 0.00 175.26 170.43 3k5g n TRP 197 N 8.21 0.00 -1.02 1.61 4.27 -1.26 -4.57 117.44 124.68 3k5g n TRP 197 Ca 0.41 0.00 -0.29 0.00 -3.89 0.00 0.00 57.50 53.73 3k5g n TRP 197 Cb 0.48 0.00 0.19 0.00 -1.36 0.00 0.00 31.31 30.62 3k5g n TRP 197 CO 0.00 0.00 0.00 0.71 -2.29 0.00 0.00 177.69 176.11 3k5g s TYR 198 N 0.00 1.93 -1.21 -2.67 2.02 -1.26 -1.39 117.35 114.77 3k5g s TYR 198 Ca 0.00 1.07 -0.20 0.00 -0.37 0.00 0.00 57.07 57.57 3k5g s TYR 198 Cb 0.00 -3.22 0.05 0.00 -0.40 0.00 0.00 41.96 38.40 3k5g s TYR 198 CO 0.00 -3.09 1.68 0.71 -1.57 0.00 0.00 175.55 173.28 3k5g s TYR 199 N -2.84 2.64 -0.05 2.71 1.51 -1.26 -4.81 117.35 115.25 3k5g s TYR 199 Ca 0.66 -1.25 -0.23 0.00 -1.01 0.00 0.00 57.07 55.23 3k5g s TYR 199 Cb -0.20 -4.68 -0.04 0.00 -0.11 0.00 0.00 41.96 36.93 3k5g s TYR 199 CO 0.59 -1.81 0.70 -2.00 -1.11 0.00 0.00 175.55 171.93 3k5g s GLU 200 N 4.62 4.44 0.39 -0.62 2.12 -1.26 -1.92 118.70 126.47 3k5g s GLU 200 Ca 0.53 0.89 0.04 0.00 0.36 0.00 0.00 54.97 56.78 3k5g s GLU 200 Cb 0.02 -3.43 -0.04 0.00 0.26 0.00 0.00 34.13 30.94 3k5g s GLU 200 CO 0.03 0.10 0.08 0.14 -0.54 0.00 0.00 175.26 175.07 3k5g s VAL 201 N 0.68 0.99 -0.15 3.70 -7.23 -0.21 -0.66 120.40 117.52 3k5g s VAL 201 Ca 0.37 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.56 3k5g s VAL 201 Cb -0.18 -2.53 0.02 0.00 0.56 0.00 0.00 36.38 34.24 3k5g s VAL 201 CO 0.18 0.00 -0.19 -0.63 -0.31 0.00 0.00 175.10 174.15 3k5g s ILE 202 N -3.17 1.92 -0.11 -0.62 1.01 -1.26 -4.01 121.20 114.96 3k5g s ILE 202 Ca 0.27 -0.87 -0.19 0.00 0.00 0.00 0.00 60.65 59.86 3k5g s ILE 202 Cb 0.05 -1.73 -0.04 0.00 0.01 0.00 0.00 42.46 40.75 3k5g s ILE 202 CO 0.13 0.52 0.51 -0.63 0.00 0.00 0.00 174.94 175.47 3k5g s ILE 203 N 1.13 5.17 -0.46 2.92 1.01 -1.26 -1.71 121.20 127.99 3k5g s ILE 203 Ca -0.00 1.03 0.06 0.00 0.00 0.00 0.00 60.65 61.73 3k5g s ILE 203 Cb -0.14 -3.85 -0.02 0.00 0.01 0.00 0.00 42.46 38.46 3k5g s ILE 203 CO -0.08 0.32 0.41 1.33 0.00 0.00 0.00 174.94 176.92 3k5g n VAL 204 N 3.69 0.00 -3.60 2.92 0.24 -0.12 -4.76 118.33 116.70 3k5g n VAL 204 Ca -0.06 -0.42 -0.11 0.00 -2.04 0.00 0.00 64.34 61.71 3k5g n VAL 204 Cb 0.52 1.05 -0.06 0.00 -1.47 0.00 0.00 33.84 33.88 3k5g n VAL 204 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3k5g s ARG 205 N -1.14 0.61 -0.04 7.34 3.52 -1.24 -4.68 118.95 123.32 3k5g s ARG 205 Ca 0.04 0.38 0.02 0.00 -0.13 0.00 0.00 55.73 56.04 3k5g s ARG 205 Cb 0.05 0.29 0.01 0.00 -1.56 0.00 0.00 34.95 33.74 3k5g s ARG 205 CO 0.17 -0.14 -0.08 0.08 -0.81 0.00 0.00 175.30 174.52 3k5g s VAL 206 N -0.50 0.74 0.04 7.11 1.01 -1.26 -1.10 120.40 126.43 3k5g s VAL 206 Ca -0.01 -0.29 0.05 0.00 0.00 0.00 0.00 61.98 61.74 3k5g s VAL 206 Cb -0.02 -0.69 -0.02 0.00 0.00 0.00 0.00 36.38 35.64 3k5g s VAL 206 CO -0.01 0.25 -0.16 -1.61 0.00 0.00 0.00 175.10 173.58 3k5g s GLU 207 N 0.53 1.06 -0.15 2.72 2.02 -0.43 -1.09 118.70 123.36 3k5g s GLU 207 Ca -0.08 -0.79 0.00 0.00 0.02 0.00 0.00 54.97 54.12 3k5g s GLU 207 Cb -0.12 -1.09 0.02 0.00 0.10 0.00 0.00 34.13 33.04 3k5g s GLU 207 CO 0.01 0.27 -0.14 0.42 0.02 0.00 0.00 175.26 175.84 3k5g s ILE 208 N -0.81 1.57 -1.59 -1.63 1.01 -0.13 -0.11 121.20 119.52 3k5g s ILE 208 Ca 0.03 -0.63 -0.10 0.00 0.00 0.00 0.00 60.65 59.95 3k5g s ILE 208 Cb -0.08 -1.48 0.09 0.00 0.01 0.00 0.00 42.46 41.00 3k5g s ILE 208 CO 0.01 0.46 0.56 0.59 0.00 0.00 0.00 174.94 176.56 3k5g n ASN 209 N 4.76 -1.68 0.00 3.58 3.02 -0.24 -1.64 115.26 123.05 3k5g n ASN 209 Ca -0.17 -1.05 0.00 0.00 -0.03 0.00 0.00 54.58 53.33 3k5g n ASN 209 Cb 0.50 -2.70 0.00 0.00 -0.61 0.00 0.00 39.78 36.97 3k5g n ASN 209 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k5g n GLY 210 N -1.73 0.73 3.40 7.41 0.00 -1.26 -5.01 105.19 108.72 3k5g n GLY 210 Ca -0.11 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.57 3k5g n GLY 210 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k5g s GLN 211 N -0.13 3.49 0.17 1.61 2.00 -0.65 -5.06 119.66 121.08 3k5g s GLN 211 Ca 0.00 -0.61 -0.30 0.00 -2.00 0.00 0.00 55.36 52.45 3k5g s GLN 211 Cb 0.00 -2.84 -0.08 0.00 0.80 0.00 0.00 33.01 30.89 3k5g s GLN 211 CO 0.00 0.11 1.29 0.34 -0.50 0.00 0.00 175.29 176.53 3k5g s ASP 212 N 0.67 6.94 0.44 6.67 -1.08 -1.26 -0.96 116.67 128.09 3k5g s ASP 212 Ca -0.04 2.32 0.15 0.00 -0.52 0.00 0.00 52.55 54.46 3k5g s ASP 212 Cb -0.15 -2.60 0.98 0.00 -1.46 0.00 0.00 42.92 39.69 3k5g s ASP 212 CO 0.02 -0.52 1.96 -0.07 0.52 0.00 0.00 175.17 177.08 3k5g h LEU 213 N 5.77 0.00 0.49 -1.34 3.38 -1.48 -3.47 115.31 118.66 3k5g h LEU 213 Ca -0.44 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.32 3k5g h LEU 213 Cb 1.21 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.88 3k5g h LEU 213 CO 0.79 0.22 -0.19 0.29 0.09 0.00 0.00 178.44 179.64 3k5g n LYS 214 N -4.18 -0.88 -1.87 1.13 5.02 -1.26 -5.00 118.16 111.11 3k5g n LYS 214 Ca -0.02 0.84 -0.32 0.00 -2.02 0.00 0.00 58.31 56.79 3k5g n LYS 214 Cb 0.29 -4.83 0.02 0.00 -0.02 0.00 0.00 35.03 30.49 3k5g n LYS 214 CO 0.00 0.00 0.00 -1.64 -0.52 0.00 0.00 177.40 175.24 3k5g s MET 215 N -2.76 3.33 -0.05 1.97 -1.94 -1.26 -4.99 119.30 113.60 3k5g s MET 215 Ca 0.00 0.97 -0.35 0.00 -1.71 0.00 0.00 55.69 54.60 3k5g s MET 215 Cb 0.00 -2.04 -0.13 0.00 2.01 0.00 0.00 34.83 34.67 3k5g s MET 215 CO 0.00 -0.79 1.75 -3.47 -0.01 0.00 0.00 175.02 172.50 3k5g n ASP 216 N -2.55 3.09 0.20 3.03 -0.08 -1.26 -4.82 116.55 114.17 3k5g n ASP 216 Ca 0.07 1.02 0.14 0.00 -1.51 0.00 0.00 54.79 54.52 3k5g n ASP 216 Cb 0.54 -1.34 0.64 0.00 2.34 0.00 0.00 41.12 43.29 3k5g n ASP 216 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3k5g h LYS 218 N 0.00 0.11 -0.08 0.00 1.57 -1.74 -1.78 116.57 114.65 3k5g h LYS 218 Ca 0.00 -0.01 -0.05 0.00 -1.87 0.00 0.00 60.65 58.72 3k5g h LYS 218 Cb 0.32 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.59 3k5g h LYS 218 CO 0.00 0.07 -0.19 0.93 -0.57 0.00 0.00 179.45 179.70 3k5g h GLU 219 N 0.11 0.13 0.00 3.15 4.39 -1.00 -1.96 114.58 119.40 3k5g h GLU 219 Ca 0.15 -0.03 -0.03 0.00 0.34 0.00 0.00 59.36 59.80 3k5g h GLU 219 Cb 0.46 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.09 3k5g h GLU 219 CO -0.02 0.31 -0.13 1.88 -1.16 0.00 0.00 179.01 179.90 3k5g h TYR 220 N 0.12 0.00 -0.01 4.33 0.99 -1.46 -3.06 116.97 117.88 3k5g h TYR 220 Ca 0.02 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.74 3k5g h TYR 220 Cb 0.40 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 38.11 3k5g h TYR 220 CO 0.00 0.13 -0.53 0.09 -0.00 0.00 0.00 178.16 177.85 3k5g n ASN 221 N -3.38 1.70 -4.52 3.88 3.02 -0.78 -4.44 115.26 110.75 3k5g n ASN 221 Ca -0.01 -3.83 -0.41 0.00 -0.03 0.00 0.00 54.58 50.31 3k5g n ASN 221 Cb 0.32 -0.52 -0.10 0.00 -0.61 0.00 0.00 39.78 38.87 3k5g n ASN 221 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 3k5g s TYR 222 N -3.11 3.21 -2.27 3.10 5.04 -0.98 -1.34 117.35 121.00 3k5g s TYR 222 Ca 0.38 -0.17 0.21 0.00 -2.44 0.00 0.00 57.07 55.05 3k5g s TYR 222 Cb 0.37 -2.64 0.38 0.00 0.35 0.00 0.00 41.96 40.42 3k5g s TYR 222 CO -0.07 -0.46 1.34 -0.40 -1.34 0.00 0.00 175.55 174.61 3k5g n ASP 223 N 5.32 3.30 -3.59 4.32 5.75 -1.26 -3.40 116.55 126.98 3k5g n ASP 223 Ca -0.10 -1.95 -0.07 0.00 -0.01 0.00 0.00 54.79 52.65 3k5g n ASP 223 Cb 0.49 -0.22 -0.02 0.00 -1.03 0.00 0.00 41.12 40.34 3k5g n ASP 223 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 3k5g s LYS 224 N -1.41 1.10 -0.07 0.11 -2.85 -0.45 -4.77 119.74 111.39 3k5g s LYS 224 Ca 0.35 -0.50 0.03 0.00 -1.00 0.00 0.00 55.97 54.86 3k5g s LYS 224 Cb 0.21 0.45 0.00 0.00 -2.06 0.00 0.00 37.83 36.43 3k5g s LYS 224 CO 0.29 -0.49 -0.18 -1.12 0.10 0.00 0.00 175.35 173.95 3k5g s SER 225 N -2.71 2.37 0.12 0.03 0.01 -1.26 0.22 113.70 112.50 3k5g s SER 225 Ca 0.07 -0.41 0.04 0.00 1.31 0.00 0.00 55.95 56.96 3k5g s SER 225 Cb -0.02 -1.00 -0.04 0.00 0.21 0.00 0.00 66.02 65.18 3k5g s SER 225 CO -0.05 0.11 -0.11 0.27 0.41 0.00 0.00 173.24 173.87 3k5g s ILE 226 N 0.40 1.09 -0.26 1.44 -4.36 -0.68 -1.05 121.20 117.78 3k5g s ILE 226 Ca -0.14 -1.85 -0.09 0.00 -0.26 0.00 0.00 60.65 58.30 3k5g s ILE 226 Cb -0.16 -1.62 -0.04 0.00 1.25 0.00 0.00 42.46 41.89 3k5g s ILE 226 CO 0.05 -0.64 0.14 -0.69 0.24 0.00 0.00 174.94 174.04 3k5g s VAL 227 N -2.84 4.86 -0.33 8.37 1.01 -0.81 -0.63 120.40 130.03 3k5g s VAL 227 Ca 0.11 0.02 -0.01 0.00 0.00 0.00 0.00 61.98 62.10 3k5g s VAL 227 Cb -0.00 -3.30 0.12 0.00 0.00 0.00 0.00 36.38 33.20 3k5g s VAL 227 CO 0.01 0.29 0.16 -0.62 0.00 0.00 0.00 175.10 174.94 3k5g s ASP 228 N 1.67 3.46 0.00 3.32 -1.08 -0.53 -4.35 116.67 119.16 3k5g s ASP 228 Ca 0.07 -1.79 0.19 0.00 -0.52 0.00 0.00 52.55 50.49 3k5g s ASP 228 Cb -0.16 -0.54 0.82 0.00 -1.46 0.00 0.00 42.92 41.58 3k5g s ASP 228 CO 0.08 -0.37 1.60 -1.54 0.52 0.00 0.00 175.17 175.45 3k5g n SER 229 N 4.59 0.00 -0.89 -0.34 3.41 -1.26 -2.53 113.62 116.61 3k5g n SER 229 Ca 0.02 0.47 0.08 0.00 -0.26 0.00 0.00 58.87 59.18 3k5g n SER 229 Cb 0.40 -0.49 0.22 0.00 -0.26 0.00 0.00 64.21 64.08 3k5g n SER 229 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3k5g n GLY 230 N 0.44 1.24 3.07 5.00 0.00 -1.26 -4.69 105.19 108.99 3k5g n GLY 230 Ca 0.05 -0.52 -0.27 0.00 0.00 0.00 0.00 46.02 45.28 3k5g n GLY 230 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5g s THR 231 N -1.37 1.37 -0.01 2.61 2.01 -1.05 -4.97 115.64 114.24 3k5g s THR 231 Ca 0.32 -0.62 -0.25 0.00 0.31 0.00 0.00 61.69 61.45 3k5g s THR 231 Cb 0.17 -1.23 -0.19 0.00 0.01 0.00 0.00 72.50 71.25 3k5g s THR 231 CO 0.22 0.41 1.31 0.74 -0.69 0.00 0.00 174.62 176.61 3k5g h THR 232 N 5.91 1.25 -4.03 -0.82 2.02 -1.87 0.35 112.91 115.72 3k5g h THR 232 Ca -0.28 -0.94 -0.50 0.00 0.77 0.00 0.00 66.41 65.46 3k5g h THR 232 Cb 1.20 1.88 0.05 0.00 -1.74 0.00 0.00 68.15 69.54 3k5g h THR 232 CO 0.47 0.24 0.29 0.20 0.37 0.00 0.00 175.52 177.09 3k5g s ASN 233 N -5.56 6.19 -0.05 4.18 -0.87 -1.26 -0.90 114.94 116.67 3k5g s ASN 233 Ca -0.15 1.19 -0.30 0.00 -1.57 0.00 0.00 52.86 52.03 3k5g s ASN 233 Cb 0.02 -2.33 -0.04 0.00 -0.02 0.00 0.00 41.25 38.88 3k5g s ASN 233 CO 0.65 -0.78 1.29 -0.22 -2.57 0.00 0.00 177.10 175.47 3k5g s LEU 234 N -5.01 4.28 -0.11 0.60 2.96 -0.73 -2.80 118.68 117.88 3k5g s LEU 234 Ca 0.52 1.92 0.01 0.00 -0.22 0.00 0.00 54.13 56.36 3k5g s LEU 234 Cb -0.11 -3.56 -0.02 0.00 0.50 0.00 0.00 46.19 43.01 3k5g s LEU 234 CO 0.50 -0.66 -0.14 -0.13 -1.32 0.00 0.00 176.35 174.60 3k5g s ARG 235 N 2.46 3.11 0.01 1.98 0.52 -0.51 -0.49 118.95 126.03 3k5g s ARG 235 Ca 0.59 -0.71 0.06 0.00 -0.52 0.00 0.00 55.73 55.15 3k5g s ARG 235 Cb -0.27 -2.53 -0.02 0.00 0.52 0.00 0.00 34.95 32.65 3k5g s ARG 235 CO 0.23 0.32 -0.18 -0.51 0.02 0.00 0.00 175.30 175.18 3k5g s LEU 236 N 0.05 2.09 0.55 2.53 1.43 -0.11 -0.43 118.68 124.79 3k5g s LEU 236 Ca -0.05 -0.39 -0.20 0.00 -1.03 0.00 0.00 54.13 52.45 3k5g s LEU 236 Cb -0.15 -0.90 -0.07 0.00 0.03 0.00 0.00 46.19 45.11 3k5g s LEU 236 CO 0.04 0.18 0.94 -2.65 0.23 0.00 0.00 176.35 175.10 3k5g n PRO 237 N 2.33 1.01 -0.32 1.29 -0.02 -1.26 0.24 135.00 138.26 3k5g n PRO 237 Ca -0.16 0.38 -0.09 0.00 -2.02 0.00 0.00 63.50 61.61 3k5g n PRO 237 Cb 0.54 -2.10 -0.06 0.00 -0.02 0.00 0.00 33.50 31.86 3k5g n PRO 237 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3k5g h LYS 238 N 0.77 -0.11 -0.94 -0.52 3.64 -1.88 0.42 116.57 117.96 3k5g h LYS 238 Ca -0.47 0.01 0.04 0.00 -1.27 0.00 0.00 60.65 58.95 3k5g h LYS 238 Cb 1.36 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 33.15 3k5g h LYS 238 CO 0.52 -0.07 0.61 0.87 -2.27 0.00 0.00 179.45 179.12 3k5g h LYS 239 N -0.11 1.15 -0.12 1.90 1.57 -1.92 -1.05 116.57 117.98 3k5g h LYS 239 Ca 0.19 -0.07 -0.19 0.00 -1.87 0.00 0.00 60.65 58.71 3k5g h LYS 239 Cb 0.51 -0.26 0.01 0.00 0.08 0.00 0.00 32.23 32.57 3k5g h LYS 239 CO -0.84 0.76 -0.65 0.28 -0.57 0.00 0.00 179.45 178.42 3k5g h VAL 240 N 1.18 1.32 -0.52 0.50 2.07 -1.18 -2.94 116.25 116.68 3k5g h VAL 240 Ca 0.37 -1.91 0.08 0.00 0.82 0.00 0.00 66.70 66.06 3k5g h VAL 240 Cb 0.01 2.11 -0.06 0.00 -1.52 0.00 0.00 31.29 31.82 3k5g h VAL 240 CO -0.11 0.59 0.17 0.15 0.02 0.00 0.00 177.57 178.39 3k5g h PHE 241 N 0.33 0.29 -0.47 1.57 3.57 0.11 -0.25 116.94 122.09 3k5g h PHE 241 Ca -0.05 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.43 3k5g h PHE 241 Cb 1.29 -0.05 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 3k5g h PHE 241 CO 0.10 0.07 0.08 0.93 -2.23 0.00 0.00 178.31 177.27 3k5g h GLU 242 N 0.33 0.77 -0.74 1.11 5.08 -1.21 0.03 114.58 119.95 3k5g h GLU 242 Ca 0.26 -0.20 -0.03 0.00 -1.00 0.00 0.00 59.36 58.39 3k5g h GLU 242 Cb 0.31 -0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 3k5g h GLU 242 CO -0.28 0.77 0.34 0.00 -1.00 0.00 0.00 179.01 178.84 3k5g h ALA 243 N 0.96 0.96 -0.24 3.43 0.00 -1.29 -0.93 119.26 122.15 3k5g h ALA 243 Ca 0.14 -0.16 -0.07 0.00 0.00 0.00 0.00 54.91 54.82 3k5g h ALA 243 Cb 0.37 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3k5g h ALA 243 CO 0.01 0.54 -0.13 0.00 0.00 0.00 0.00 179.25 179.67 3k5g h ALA 244 N 1.17 0.34 -0.56 0.00 0.00 -0.75 -1.99 119.26 117.48 3k5g h ALA 244 Ca 0.25 -0.31 -0.05 0.00 0.00 0.00 0.00 54.91 54.80 3k5g h ALA 244 Cb 0.15 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 3k5g h ALA 244 CO -0.03 0.21 0.14 0.28 0.00 0.00 0.00 179.25 179.85 3k5g h VAL 245 N 0.23 1.24 -0.87 0.00 2.07 -0.92 0.14 116.25 118.15 3k5g h VAL 245 Ca 0.05 -0.87 0.09 0.00 0.82 0.00 0.00 66.70 66.79 3k5g h VAL 245 Cb 0.63 0.75 -0.07 0.00 -1.52 0.00 0.00 31.29 31.08 3k5g h VAL 245 CO 0.04 0.32 0.52 0.50 0.02 0.00 0.00 177.57 178.97 3k5g h LYS 246 N 0.79 0.87 -0.17 1.57 3.64 -1.11 0.25 116.57 122.41 3k5g h LYS 246 Ca 0.18 -0.05 -0.21 0.00 -1.27 0.00 0.00 60.65 59.29 3k5g h LYS 246 Cb 0.33 -0.20 0.01 0.00 -0.41 0.00 0.00 32.23 31.96 3k5g h LYS 246 CO 0.00 0.57 -0.73 1.03 -2.27 0.00 0.00 179.45 178.06 3k5g h SER 247 N 0.89 0.91 -0.44 4.20 0.87 -1.03 -2.28 113.55 116.67 3k5g h SER 247 Ca 0.40 -0.57 -0.14 0.00 -1.23 0.00 0.00 61.79 60.25 3k5g h SER 247 Cb 0.31 -0.27 -0.01 0.00 -0.44 0.00 0.00 62.40 61.99 3k5g h SER 247 CO -0.22 1.37 -0.28 0.40 -0.53 0.00 0.00 176.83 177.56 3k5g h ILE 248 N 0.54 1.27 -0.25 2.23 2.04 -0.49 -1.94 117.51 120.91 3k5g h ILE 248 Ca -0.04 -1.45 0.04 0.00 1.00 0.00 0.00 64.86 64.41 3k5g h ILE 248 Cb 1.35 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 38.63 3k5g h ILE 248 CO 0.15 0.49 0.02 0.11 0.00 0.00 0.00 178.15 178.92 3k5g h LYS 249 N 0.81 0.10 -0.56 2.37 1.57 -0.55 -2.26 116.57 118.04 3k5g h LYS 249 Ca 0.09 -0.01 0.02 0.00 -1.87 0.00 0.00 60.65 58.88 3k5g h LYS 249 Cb 0.87 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 33.12 3k5g h LYS 249 CO 0.08 0.06 0.35 0.00 -0.57 0.00 0.00 179.45 179.37 3k5g h ALA 250 N 1.20 0.72 -0.04 3.86 0.00 -1.28 -0.42 119.26 123.30 3k5g h ALA 250 Ca 0.12 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 3k5g h ALA 250 Cb 0.14 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3k5g h ALA 250 CO -0.18 0.08 -0.14 0.00 0.00 0.00 0.00 179.25 179.01 3k5g h ALA 251 N 1.24 1.69 -0.35 0.00 0.00 -1.12 -3.08 119.26 117.63 3k5g h ALA 251 Ca 0.22 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3k5g h ALA 251 Cb -0.00 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.75 3k5g h ALA 251 CO -0.09 0.23 0.00 -1.13 0.00 0.00 0.00 179.25 178.27 3k5g n SER 252 N -4.34 3.22 0.11 0.00 3.41 -0.82 -4.66 113.62 110.55 3k5g n SER 252 Ca -0.02 -2.23 0.08 0.00 -0.26 0.00 0.00 58.87 56.44 3k5g n SER 252 Cb 0.23 -0.32 0.42 0.00 -0.26 0.00 0.00 64.21 64.28 3k5g n SER 252 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3k5g n SER 253 N 0.34 0.40 -0.33 4.04 3.41 -0.23 -1.35 113.62 119.90 3k5g n SER 253 Ca 0.14 0.68 0.27 0.00 -0.26 0.00 0.00 58.87 59.71 3k5g n SER 253 Cb 0.55 -0.74 0.59 0.00 -0.26 0.00 0.00 64.21 64.35 3k5g n SER 253 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3k5g h THR 254 N 0.00 0.46 -1.98 6.66 2.02 -1.85 -3.42 112.91 114.79 3k5g h THR 254 Ca 0.00 -0.09 -0.57 0.00 0.77 0.00 0.00 66.41 66.52 3k5g h THR 254 Cb 0.01 0.19 -0.10 0.00 -1.74 0.00 0.00 68.15 66.51 3k5g h THR 254 CO 0.00 0.05 -0.62 -1.61 0.37 0.00 0.00 175.52 173.71 3k5g s GLU 255 N -5.32 2.14 -0.06 6.66 2.02 -0.46 -5.14 118.70 118.55 3k5g s GLU 255 Ca -0.08 -1.66 0.02 0.00 0.02 0.00 0.00 54.97 53.27 3k5g s GLU 255 Cb 0.25 -2.00 -0.03 0.00 0.10 0.00 0.00 34.13 32.45 3k5g s GLU 255 CO 0.80 0.19 -0.09 0.21 0.02 0.00 0.00 175.26 176.39 3k5g s LYS 256 N -3.72 2.68 -0.03 1.61 2.20 -1.26 -5.03 119.74 116.19 3k5g s LYS 256 Ca 0.34 -0.59 0.07 0.00 -0.36 0.00 0.00 55.97 55.43 3k5g s LYS 256 Cb -0.02 -2.53 -0.01 0.00 -1.51 0.00 0.00 37.83 33.76 3k5g s LYS 256 CO 0.20 0.65 -0.24 -0.06 -0.36 0.00 0.00 175.35 175.54 3k5g s PHE 257 N -0.77 2.19 1.11 4.03 0.40 -1.26 -5.10 117.98 118.58 3k5g s PHE 257 Ca 0.12 -0.52 -0.18 0.00 -0.60 0.00 0.00 56.93 55.75 3k5g s PHE 257 Cb -0.11 -1.43 0.11 0.00 0.51 0.00 0.00 43.02 42.10 3k5g s PHE 257 CO 0.01 -0.11 0.04 -2.30 0.70 0.00 0.00 175.22 173.56 3k5g n PRO 258 N 2.71 -1.56 -2.35 0.24 -0.02 -1.26 -4.89 135.00 127.86 3k5g n PRO 258 Ca -0.16 -0.44 -0.41 0.00 -2.02 0.00 0.00 63.50 60.47 3k5g n PRO 258 Cb 0.52 -1.72 -0.03 0.00 -0.02 0.00 0.00 33.50 32.25 3k5g n PRO 258 CO 0.00 0.00 0.00 0.16 1.98 0.00 0.00 175.50 177.64 3k5g s ASP 259 N -1.86 7.08 0.00 2.55 -4.77 -1.26 -3.14 116.67 115.27 3k5g s ASP 259 Ca 0.56 2.33 0.00 0.00 -3.30 0.00 0.00 52.55 52.14 3k5g s ASP 259 Cb -0.12 -2.62 0.00 0.00 -1.09 0.00 0.00 42.92 39.09 3k5g s ASP 259 CO 0.66 -0.34 0.00 0.61 0.70 0.00 0.00 175.17 176.80 3k5g n GLY 260 N 1.68 1.32 0.05 2.12 0.00 -1.26 -4.49 105.19 104.61 3k5g n GLY 260 Ca 0.02 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.92 3k5g n GLY 260 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 3k5g h PHE 261 N 0.00 0.03 0.00 1.61 3.57 -1.67 0.18 116.94 120.66 3k5g h PHE 261 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 3k5g h PHE 261 Cb 0.00 -0.01 0.00 0.00 2.79 0.00 0.00 35.95 38.73 3k5g h PHE 261 CO 0.00 0.15 0.00 0.91 -2.23 0.00 0.00 178.31 177.14 3k5g n TRP 262 N -5.01 0.00 1.29 0.41 7.02 -1.26 -0.83 117.44 119.06 3k5g n TRP 262 Ca -0.07 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.54 3k5g n TRP 262 Cb 0.09 -0.45 0.36 0.00 -2.42 0.00 0.00 31.31 28.89 3k5g n TRP 262 CO 0.00 0.00 0.00 1.28 -2.02 0.00 0.00 177.69 176.95 3k5g n LEU 263 N -1.45 1.46 0.00 -0.99 4.77 -0.98 -4.94 117.00 114.88 3k5g n LEU 263 Ca 0.05 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.58 3k5g n LEU 263 Cb 0.20 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.23 3k5g n LEU 263 CO 0.16 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 3k5g n GLY 264 N 1.29 1.50 0.13 -0.72 0.00 -0.01 -4.91 105.19 102.47 3k5g n GLY 264 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.12 3k5g n GLY 264 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3k5g h GLU 265 N 2.87 -0.27 -6.16 1.61 5.08 -1.19 -3.44 114.58 113.07 3k5g h GLU 265 Ca 0.00 0.02 -0.58 0.00 -1.00 0.00 0.00 59.36 57.80 3k5g h GLU 265 Cb 0.00 0.06 -0.05 0.00 0.50 0.00 0.00 28.75 29.26 3k5g h GLU 265 CO 0.00 -0.18 -0.06 -1.14 -1.00 0.00 0.00 179.01 176.62 3k5g s GLN 266 N -2.50 4.17 0.48 2.33 2.00 -0.62 -4.95 119.66 120.58 3k5g s GLN 266 Ca -0.04 0.67 -0.03 0.00 -2.00 0.00 0.00 55.36 53.96 3k5g s GLN 266 Cb 0.00 -3.26 -0.02 0.00 0.80 0.00 0.00 33.01 30.54 3k5g s GLN 266 CO 0.12 0.60 0.75 -0.48 -0.50 0.00 0.00 175.29 175.78 3k5g s LEU 267 N -0.92 3.59 0.03 3.68 2.34 -1.26 -3.97 118.68 122.17 3k5g s LEU 267 Ca 0.28 0.63 0.06 0.00 0.06 0.00 0.00 54.13 55.16 3k5g s LEU 267 Cb -0.19 -3.52 -0.02 0.00 -0.56 0.00 0.00 46.19 41.90 3k5g s LEU 267 CO 0.18 -0.69 -0.17 0.54 -1.06 0.00 0.00 176.35 175.15 3k5g s VAL 268 N -2.69 1.32 0.13 1.48 0.11 -0.31 -4.85 120.40 115.59 3k5g s VAL 268 Ca 0.48 -1.00 0.06 0.00 -2.93 0.00 0.00 61.98 58.59 3k5g s VAL 268 Cb -0.10 -1.16 -0.04 0.00 -1.53 0.00 0.00 36.38 33.55 3k5g s VAL 268 CO 0.42 0.14 -0.14 0.00 -3.33 0.00 0.00 175.10 172.19 3k5g s TRP 270 N -2.30 0.89 0.19 0.00 0.51 0.46 -4.98 118.94 113.73 3k5g s TRP 270 Ca 0.11 -0.76 -0.33 0.00 -2.12 0.00 0.00 56.10 53.00 3k5g s TRP 270 Cb -0.04 -0.51 -0.14 0.00 -0.81 0.00 0.00 33.47 31.97 3k5g s TRP 270 CO 0.03 -0.09 1.45 0.94 -0.51 0.00 0.00 176.95 178.76 3k5g n GLN 271 N 0.42 1.94 -1.56 4.98 7.27 -1.26 -0.47 117.38 128.70 3k5g n GLN 271 Ca -0.15 0.70 -0.54 0.00 0.07 0.00 0.00 57.00 57.07 3k5g n GLN 271 Cb 0.59 -2.38 -0.06 0.00 2.41 0.00 0.00 30.24 30.79 3k5g n GLN 271 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 3k5g n ALA 272 N 2.47 -1.79 -0.81 1.69 0.00 -1.25 -0.73 120.51 120.09 3k5g n ALA 272 Ca 0.14 0.54 0.00 0.00 0.00 0.00 0.00 53.44 54.12 3k5g n ALA 272 Cb 0.29 -1.97 0.00 0.00 0.00 0.00 0.00 19.45 17.77 3k5g n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k5g n GLY 273 N 2.18 0.89 0.37 0.00 0.00 -1.26 -4.89 105.19 102.48 3k5g n GLY 273 Ca 0.19 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.26 3k5g n GLY 273 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3k5g n THR 274 N -2.04 1.41 -1.68 2.61 -2.24 0.09 -5.01 114.28 107.42 3k5g n THR 274 Ca 0.00 -1.41 -0.46 0.00 -2.27 0.00 0.00 64.05 59.92 3k5g n THR 274 Cb 0.00 0.22 -0.04 0.00 -2.10 0.00 0.00 70.33 68.41 3k5g n THR 274 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 3k5g n THR 275 N -0.38 0.41 -1.23 4.28 -1.04 -1.26 -4.84 114.28 110.22 3k5g n THR 275 Ca 0.10 -0.07 -0.36 0.00 -2.04 0.00 0.00 64.05 61.68 3k5g n THR 275 Cb 0.50 -1.89 -0.02 0.00 -1.82 0.00 0.00 70.33 67.09 3k5g n THR 275 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 3k5g n PRO 276 N 5.72 3.14 -0.19 -2.82 -0.04 -1.26 -4.74 135.00 134.80 3k5g n PRO 276 Ca 0.20 -2.07 0.21 0.00 -0.04 0.00 0.00 63.50 61.80 3k5g n PRO 276 Cb 0.32 -2.79 0.59 0.00 -0.04 0.00 0.00 33.50 31.58 3k5g n PRO 276 CO 0.00 0.00 0.00 -1.49 -0.04 0.00 0.00 175.50 173.97 3k5g h TRP 277 N 5.55 0.33 0.00 0.54 4.06 -1.96 -2.29 115.95 122.19 3k5g h TRP 277 Ca 0.73 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 61.68 3k5g h TRP 277 Cb 0.32 -0.10 -0.00 0.00 -1.00 0.00 0.00 29.16 28.37 3k5g h TRP 277 CO 1.82 0.09 -0.08 -2.95 -3.56 0.00 0.00 178.44 173.76 3k5g h ASN 278 N 0.25 0.00 0.29 -3.49 7.08 -2.01 -1.76 115.58 115.95 3k5g h ASN 278 Ca 0.43 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.65 3k5g h ASN 278 Cb 1.27 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 37.51 3k5g h ASN 278 CO -0.11 0.08 -0.21 2.30 -2.08 0.00 0.00 177.43 177.42 3k5g n ILE 279 N -3.53 0.00 -3.63 6.14 -5.35 -0.86 -4.77 119.36 107.36 3k5g n ILE 279 Ca -0.02 -0.10 -0.36 0.00 -0.27 0.00 0.00 62.75 62.00 3k5g n ILE 279 Cb 0.21 0.22 -0.08 0.00 -1.74 0.00 0.00 39.64 38.25 3k5g n ILE 279 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 3k5g s PHE 280 N -2.51 3.41 0.62 4.28 0.08 -0.66 -3.30 117.98 119.90 3k5g s PHE 280 Ca 0.25 0.43 -0.15 0.00 0.12 0.00 0.00 56.93 57.59 3k5g s PHE 280 Cb 0.19 -2.27 -0.03 0.00 -0.57 0.00 0.00 43.02 40.35 3k5g s PHE 280 CO 0.51 0.22 1.07 -1.25 -0.10 0.00 0.00 175.22 175.67 3k5g s PRO 281 N 0.55 3.18 0.36 0.24 0.04 -1.26 -4.73 135.00 133.38 3k5g s PRO 281 Ca 0.12 1.22 -0.23 0.00 0.04 0.00 0.00 61.00 62.15 3k5g s PRO 281 Cb -0.12 -2.01 -0.10 0.00 0.04 0.00 0.00 34.50 32.30 3k5g s PRO 281 CO 0.02 -0.93 0.93 0.14 0.04 0.00 0.00 177.00 177.20 3k5g s VAL 282 N -2.48 4.32 -0.18 -0.36 -7.23 -1.26 -4.31 120.40 108.91 3k5g s VAL 282 Ca 0.64 1.63 -0.04 0.00 -1.81 0.00 0.00 61.98 62.40 3k5g s VAL 282 Cb -0.17 -3.82 -0.02 0.00 0.56 0.00 0.00 36.38 32.93 3k5g s VAL 282 CO 0.39 -0.06 -0.02 -0.63 -0.31 0.00 0.00 175.10 174.47 3k5g s ILE 283 N -1.86 3.88 -0.24 -0.62 1.01 -0.61 -1.08 121.20 121.68 3k5g s ILE 283 Ca 0.55 -0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.79 3k5g s ILE 283 Cb -0.14 -2.72 -0.02 0.00 0.01 0.00 0.00 42.46 39.58 3k5g s ILE 283 CO 0.19 0.46 0.03 -0.44 0.00 0.00 0.00 174.94 175.18 3k5g s SER 284 N 0.67 4.84 -0.27 3.58 0.01 0.84 -0.16 113.70 123.21 3k5g s SER 284 Ca -0.01 -0.28 -0.09 0.00 1.31 0.00 0.00 55.95 56.87 3k5g s SER 284 Cb -0.14 -1.86 -0.04 0.00 0.21 0.00 0.00 66.02 64.19 3k5g s SER 284 CO 0.02 -0.03 0.14 -0.76 0.41 0.00 0.00 173.24 173.02 3k5g s LEU 285 N 1.56 3.80 -0.17 2.44 1.43 -0.48 -1.32 118.68 125.94 3k5g s LEU 285 Ca 0.06 -0.13 -0.18 0.00 -1.03 0.00 0.00 54.13 52.85 3k5g s LEU 285 Cb -0.15 -2.03 -0.04 0.00 0.03 0.00 0.00 46.19 44.00 3k5g s LEU 285 CO 0.01 -0.06 0.47 -0.31 0.23 0.00 0.00 176.35 176.69 3k5g s TYR 286 N 1.69 3.43 -0.05 0.29 1.51 -0.26 -1.00 117.35 122.95 3k5g s TYR 286 Ca 0.07 0.77 -0.01 0.00 -1.01 0.00 0.00 57.07 56.89 3k5g s TYR 286 Cb -0.16 -2.58 -0.03 0.00 -0.11 0.00 0.00 41.96 39.08 3k5g s TYR 286 CO 0.08 0.03 0.00 -0.51 -1.11 0.00 0.00 175.55 174.04 3k5g s LEU 287 N 1.15 3.57 0.27 -1.29 1.43 0.43 -0.95 118.68 123.29 3k5g s LEU 287 Ca 0.23 0.09 -0.30 0.00 -1.03 0.00 0.00 54.13 53.12 3k5g s LEU 287 Cb -0.15 -1.90 -0.11 0.00 0.03 0.00 0.00 46.19 44.05 3k5g s LEU 287 CO 0.09 0.34 1.62 -0.32 0.23 0.00 0.00 176.35 178.31 3k5g s MET 288 N -1.14 4.13 0.68 1.70 -2.45 -0.69 -2.32 119.30 119.20 3k5g s MET 288 Ca 0.16 2.57 -0.11 0.00 -1.25 0.00 0.00 55.69 57.06 3k5g s MET 288 Cb -0.11 -3.04 -0.00 0.00 1.25 0.00 0.00 34.83 32.92 3k5g s MET 288 CO 0.05 -0.66 1.06 0.20 1.05 0.00 0.00 175.02 176.73 3k5g s GLY 289 N 0.68 1.70 0.48 2.11 0.00 -1.26 -4.11 107.32 106.92 3k5g s GLY 289 Ca 0.66 0.09 0.17 0.00 0.00 0.00 0.00 44.72 45.64 3k5g s GLY 289 CO 0.43 0.39 2.04 0.83 0.00 0.00 0.00 173.10 176.80 3k5g h GLU 290 N -0.60 0.19 -6.24 2.90 5.08 -1.78 -3.38 114.58 110.74 3k5g h GLU 290 Ca -0.44 -0.01 -0.62 0.00 -1.00 0.00 0.00 59.36 57.29 3k5g h GLU 290 Cb 1.21 -0.04 -0.27 0.00 0.50 0.00 0.00 28.75 30.14 3k5g h GLU 290 CO 0.57 0.12 -0.86 0.08 -1.00 0.00 0.00 179.01 177.93 3k5g s VAL 291 N -5.20 1.79 -2.17 3.13 1.01 -1.26 -5.00 120.40 112.69 3k5g s VAL 291 Ca -0.06 -1.13 0.24 0.00 0.00 0.00 0.00 61.98 61.02 3k5g s VAL 291 Cb 0.19 -1.52 0.59 0.00 0.00 0.00 0.00 36.38 35.64 3k5g s VAL 291 CO 0.72 0.35 1.78 0.35 0.00 0.00 0.00 175.10 178.30 3k5g n THR 292 N 2.10 0.06 0.23 3.92 -2.24 -1.26 -0.19 114.28 116.90 3k5g n THR 292 Ca -0.16 -0.14 0.11 0.00 -2.27 0.00 0.00 64.05 61.59 3k5g n THR 292 Cb 0.53 -0.01 0.27 0.00 -2.10 0.00 0.00 70.33 69.02 3k5g n THR 292 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3k5g n ASN 293 N -0.35 3.30 -1.76 3.42 6.94 -1.26 -1.48 115.26 124.07 3k5g n ASN 293 Ca 0.18 -1.97 -0.06 0.00 -0.02 0.00 0.00 54.58 52.71 3k5g n ASN 293 Cb 0.20 -0.32 0.08 0.00 -2.36 0.00 0.00 39.78 37.37 3k5g n ASN 293 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3k5g n GLN 294 N 1.34 2.05 -1.37 -3.83 6.02 0.73 -4.31 117.38 118.01 3k5g n GLN 294 Ca 0.20 -3.43 -0.29 0.00 -0.01 0.00 0.00 57.00 53.48 3k5g n GLN 294 Cb 0.56 -1.57 0.16 0.00 1.02 0.00 0.00 30.24 30.41 3k5g n GLN 294 CO 0.00 0.00 0.00 -1.12 -1.01 0.00 0.00 177.06 174.93 3k5g s SER 295 N -3.28 3.00 0.17 1.08 0.01 -0.06 -4.26 113.70 110.35 3k5g s SER 295 Ca 0.39 1.01 -0.12 0.00 1.31 0.00 0.00 55.95 58.54 3k5g s SER 295 Cb 0.38 -1.60 0.01 0.00 0.21 0.00 0.00 66.02 65.01 3k5g s SER 295 CO -0.04 -2.88 0.37 0.72 0.41 0.00 0.00 173.24 171.82 3k5g s PHE 296 N -3.15 0.17 0.08 2.43 -0.12 -0.98 0.23 117.98 116.62 3k5g s PHE 296 Ca 0.65 -0.53 0.09 0.00 -0.05 0.00 0.00 56.93 57.09 3k5g s PHE 296 Cb -0.16 0.12 -0.03 0.00 -0.63 0.00 0.00 43.02 42.32 3k5g s PHE 296 CO 0.55 -0.78 -0.23 -0.98 -0.05 0.00 0.00 175.22 173.74 3k5g s ARG 297 N -3.92 1.79 -0.06 1.99 1.70 -0.01 -0.43 118.95 120.01 3k5g s ARG 297 Ca 0.13 -1.14 0.02 0.00 -0.47 0.00 0.00 55.73 54.27 3k5g s ARG 297 Cb 0.02 -2.05 -0.03 0.00 -0.57 0.00 0.00 34.95 32.32 3k5g s ARG 297 CO -0.02 0.50 -0.10 0.96 -1.08 0.00 0.00 175.30 175.56 3k5g s ILE 298 N -0.96 3.42 -0.11 4.99 -4.36 -0.17 -1.15 121.20 122.86 3k5g s ILE 298 Ca 0.14 -0.59 0.02 0.00 -0.26 0.00 0.00 60.65 59.96 3k5g s ILE 298 Cb -0.10 -2.37 -0.01 0.00 1.25 0.00 0.00 42.46 41.22 3k5g s ILE 298 CO 0.05 0.59 -0.16 -0.89 0.24 0.00 0.00 174.94 174.78 3k5g s THR 299 N -0.74 2.83 -0.21 8.37 2.01 -0.21 -1.38 115.64 126.30 3k5g s THR 299 Ca 0.11 -0.76 -0.05 0.00 0.31 0.00 0.00 61.69 61.31 3k5g s THR 299 Cb -0.11 -2.15 -0.02 0.00 0.01 0.00 0.00 72.50 70.23 3k5g s THR 299 CO 0.01 0.54 0.00 -0.63 -0.69 0.00 0.00 174.62 173.86 3k5g s ILE 300 N 0.12 3.90 0.47 1.82 -1.09 0.78 -3.69 121.20 123.51 3k5g s ILE 300 Ca -0.08 -0.33 -0.12 0.00 -2.23 0.00 0.00 60.65 57.89 3k5g s ILE 300 Cb -0.15 -2.77 -0.07 0.00 -1.58 0.00 0.00 42.46 37.89 3k5g s ILE 300 CO 0.05 0.42 0.87 -0.76 -1.23 0.00 0.00 174.94 174.29 3k5g s LEU 301 N 1.12 3.70 0.60 2.97 1.43 -1.26 -1.58 118.68 125.66 3k5g s LEU 301 Ca 0.03 1.31 0.30 0.00 -1.03 0.00 0.00 54.13 54.73 3k5g s LEU 301 Cb -0.14 -4.22 1.81 0.00 0.03 0.00 0.00 46.19 43.66 3k5g s LEU 301 CO 0.01 -0.51 2.20 1.55 0.23 0.00 0.00 176.35 179.83 3k5g h PRO 302 N 0.96 0.00 0.00 1.29 0.13 -1.85 0.17 132.00 132.70 3k5g h PRO 302 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3k5g h PRO 302 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 3k5g h PRO 302 CO 0.63 0.00 0.00 1.96 -0.23 0.00 0.00 178.00 180.36 3k5g h GLN 303 N 0.00 0.00 0.10 0.86 7.50 -1.93 0.12 115.11 121.76 3k5g h GLN 303 Ca 0.03 0.00 -0.29 0.00 0.50 0.00 0.00 58.65 58.89 3k5g h GLN 303 Cb 0.18 0.00 -0.01 0.00 0.05 0.00 0.00 27.48 27.70 3k5g h GLN 303 CO -0.00 0.00 -1.54 1.96 -1.50 0.00 0.00 178.83 177.75 3k5g h GLN 304 N 0.00 0.21 -0.02 1.46 4.20 -0.96 -3.40 115.11 116.60 3k5g h GLN 304 Ca 0.00 -0.36 0.00 0.00 0.06 0.00 0.00 58.65 58.35 3k5g h GLN 304 Cb 0.08 0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.00 3k5g h GLN 304 CO 0.00 1.17 -0.17 2.48 -0.67 0.00 0.00 178.83 181.64 3k5g n TYR 305 N -3.89 0.00 -3.49 2.96 0.18 -0.99 -4.41 117.16 107.52 3k5g n TYR 305 Ca -0.28 0.00 -0.43 0.00 1.88 0.00 0.00 57.90 59.08 3k5g n TYR 305 Cb 0.91 -0.02 -0.09 0.00 -0.38 0.00 0.00 39.34 39.75 3k5g n TYR 305 CO 0.00 0.00 0.00 -0.51 -2.08 0.00 0.00 176.86 174.27 3k5g s LEU 306 N -2.22 5.39 -0.04 -3.48 1.43 0.37 0.06 118.68 120.19 3k5g s LEU 306 Ca 0.27 -1.38 -0.24 0.00 -1.03 0.00 0.00 54.13 51.75 3k5g s LEU 306 Cb 0.20 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 44.28 3k5g s LEU 306 CO 0.42 -0.59 0.73 -0.60 0.23 0.00 0.00 176.35 176.54 3k5g s ARG 307 N 1.55 4.45 0.26 1.70 3.52 0.08 -4.76 118.95 125.76 3k5g s ARG 307 Ca 0.04 0.95 -0.30 0.00 -0.13 0.00 0.00 55.73 56.28 3k5g s ARG 307 Cb -0.24 -3.43 -0.10 0.00 -1.56 0.00 0.00 34.95 29.62 3k5g s ARG 307 CO 0.05 0.10 1.49 -1.25 -0.81 0.00 0.00 175.30 174.88 3k5g s PRO 308 N 0.64 4.22 0.02 5.12 0.04 -1.26 -0.38 135.00 143.40 3k5g s PRO 308 Ca 0.39 2.39 0.01 0.00 0.04 0.00 0.00 61.00 63.83 3k5g s PRO 308 Cb -0.18 -3.08 -0.01 0.00 0.04 0.00 0.00 34.50 31.26 3k5g s PRO 308 CO 0.20 -0.49 -0.05 0.14 0.04 0.00 0.00 177.00 176.84 3k5g s VAL 309 N 0.01 0.35 0.31 -0.36 -7.23 -0.67 -4.86 120.40 107.95 3k5g s VAL 309 Ca 0.61 -0.66 -0.29 0.00 -1.81 0.00 0.00 61.98 59.83 3k5g s VAL 309 Cb -0.44 -0.39 -0.10 0.00 0.56 0.00 0.00 36.38 36.01 3k5g s VAL 309 CO 0.45 -0.21 1.37 -1.61 -0.31 0.00 0.00 175.10 174.79 3k5g s GLU 310 N -0.93 4.29 -0.37 4.82 2.02 -1.26 -4.25 118.70 123.02 3k5g s GLU 310 Ca -0.06 2.29 -0.29 0.00 0.02 0.00 0.00 54.97 56.93 3k5g s GLU 310 Cb -0.06 -3.07 0.02 0.00 0.10 0.00 0.00 34.13 31.12 3k5g s GLU 310 CO -0.00 -0.31 1.12 0.34 0.02 0.00 0.00 175.26 176.43 3k5g s ASP 311 N -0.17 6.80 0.00 -0.19 2.15 -1.26 -4.87 116.67 119.13 3k5g s ASP 311 Ca 0.53 0.85 0.15 0.00 0.43 0.00 0.00 52.55 54.51 3k5g s ASP 311 Cb -0.41 -2.55 0.79 0.00 -0.30 0.00 0.00 42.92 40.46 3k5g s ASP 311 CO 0.51 -1.03 1.38 1.33 -0.17 0.00 0.00 175.17 177.19 3k5g n VAL 312 N 6.25 0.41 -2.56 1.11 0.24 -1.26 -4.75 118.33 117.76 3k5g n VAL 312 Ca 0.12 0.10 -0.24 0.00 -2.04 0.00 0.00 64.34 62.29 3k5g n VAL 312 Cb 0.48 -0.86 0.11 0.00 -1.47 0.00 0.00 33.84 32.10 3k5g n VAL 312 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3k5g s ALA 313 N -2.39 3.65 -1.95 2.33 0.00 -1.26 -4.99 121.76 117.14 3k5g s ALA 313 Ca 0.17 -1.73 0.31 0.00 0.00 0.00 0.00 51.96 50.71 3k5g s ALA 313 Cb 0.10 -2.03 1.69 0.00 0.00 0.00 0.00 23.12 22.88 3k5g s ALA 313 CO 0.21 -1.52 2.11 -2.37 0.00 0.00 0.00 175.76 174.19 3k5g n THR 314 N -2.88 0.00 -3.06 0.00 5.66 -1.26 -4.87 114.28 107.87 3k5g n THR 314 Ca 0.15 -0.04 -0.27 0.00 -3.05 0.00 0.00 64.05 60.85 3k5g n THR 314 Cb 0.61 -0.34 -0.01 0.00 -1.55 0.00 0.00 70.33 69.03 3k5g n THR 314 CO 0.00 0.00 0.00 -0.44 -3.05 0.00 0.00 175.07 171.58 3k5g s SER 315 N -2.12 6.34 -0.92 1.09 0.01 -1.26 -5.02 113.70 111.81 3k5g s SER 315 Ca 0.42 0.74 -0.00 0.00 1.31 0.00 0.00 55.95 58.42 3k5g s SER 315 Cb 0.21 -2.16 0.29 0.00 0.21 0.00 0.00 66.02 64.58 3k5g s SER 315 CO 0.39 -0.38 1.26 0.00 0.41 0.00 0.00 173.24 174.92 3k5g n GLN 316 N -1.72 3.91 -3.62 12.44 6.02 -1.26 -4.87 117.38 128.28 3k5g n GLN 316 Ca -0.02 -4.62 -0.20 0.00 -0.01 0.00 0.00 57.00 52.16 3k5g n GLN 316 Cb 0.55 -2.42 -0.02 0.00 1.02 0.00 0.00 30.24 29.38 3k5g n GLN 316 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 3k5g s ASP 317 N -2.05 5.81 -0.26 1.08 1.11 -1.26 -3.95 116.67 117.14 3k5g s ASP 317 Ca 0.35 -0.25 -0.24 0.00 0.18 0.00 0.00 52.55 52.59 3k5g s ASP 317 Cb 0.10 -1.22 -0.00 0.00 1.07 0.00 0.00 42.92 42.86 3k5g s ASP 317 CO 0.05 -0.37 0.82 -1.81 1.18 0.00 0.00 175.17 175.04 3k5g s ASP 318 N -4.10 6.78 0.14 0.27 -0.00 0.38 -4.79 116.67 115.34 3k5g s ASP 318 Ca 0.43 0.92 0.11 0.00 -0.00 0.00 0.00 52.55 54.00 3k5g s ASP 318 Cb -0.08 -2.43 -0.04 0.00 -0.00 0.00 0.00 42.92 40.37 3k5g s ASP 318 CO 0.30 -0.55 -0.26 0.00 -0.00 0.00 0.00 175.17 174.65 3k5g s TYR 320 N -1.19 0.03 0.04 0.00 1.51 0.34 -1.67 117.35 116.42 3k5g s TYR 320 Ca 0.16 -0.18 0.04 0.00 -1.01 0.00 0.00 57.07 56.08 3k5g s TYR 320 Cb -0.10 -0.03 -0.04 0.00 -0.11 0.00 0.00 41.96 41.69 3k5g s TYR 320 CO 0.07 -0.37 -0.06 0.15 -1.11 0.00 0.00 175.55 174.23 3k5g s LYS 321 N -2.00 2.47 -0.14 -0.62 1.02 0.49 -1.16 119.74 119.80 3k5g s LYS 321 Ca -0.10 -0.81 -0.29 0.00 0.02 0.00 0.00 55.97 54.79 3k5g s LYS 321 Cb -0.04 -2.48 -0.04 0.00 -0.52 0.00 0.00 37.83 34.75 3k5g s LYS 321 CO -0.01 0.57 1.73 0.12 -0.92 0.00 0.00 175.35 176.84 3k5g s PHE 322 N -1.12 1.88 -0.47 3.18 5.36 -1.26 -0.74 117.98 124.82 3k5g s PHE 322 Ca 0.20 0.33 0.04 0.00 -0.96 0.00 0.00 56.93 56.53 3k5g s PHE 322 Cb -0.11 -3.98 0.63 0.00 -0.34 0.00 0.00 43.02 39.21 3k5g s PHE 322 CO 0.11 -3.62 1.90 0.00 -1.46 0.00 0.00 175.22 172.15 3k5g n ALA 323 N 8.28 5.62 -3.42 11.12 0.00 0.11 -4.40 120.51 137.81 3k5g n ALA 323 Ca 0.20 -3.00 -0.33 0.00 0.00 0.00 0.00 53.44 50.31 3k5g n ALA 323 Cb 0.44 -1.44 -0.16 0.00 0.00 0.00 0.00 19.45 18.29 3k5g n ALA 323 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3k5g s ILE 324 N -3.50 2.47 0.19 0.00 1.01 -1.26 -1.77 121.20 118.34 3k5g s ILE 324 Ca 0.57 -0.85 0.11 0.00 0.00 0.00 0.00 60.65 60.48 3k5g s ILE 324 Cb 0.48 -2.02 -0.04 0.00 0.01 0.00 0.00 42.46 40.89 3k5g s ILE 324 CO 0.09 0.53 -0.23 -0.44 0.00 0.00 0.00 174.94 174.89 3k5g s SER 325 N 0.68 3.28 0.12 3.58 0.01 0.36 -4.78 113.70 116.96 3k5g s SER 325 Ca -0.09 -0.87 -0.26 0.00 1.31 0.00 0.00 55.95 56.05 3k5g s SER 325 Cb -0.16 -0.23 -0.07 0.00 0.21 0.00 0.00 66.02 65.77 3k5g s SER 325 CO 0.02 0.09 0.79 -1.58 0.41 0.00 0.00 173.24 172.97 3k5g s GLN 326 N -2.69 4.56 0.15 12.44 0.74 -1.26 -0.93 119.66 132.67 3k5g s GLN 326 Ca 0.20 1.16 0.11 0.00 0.05 0.00 0.00 55.36 56.87 3k5g s GLN 326 Cb -0.08 -3.31 -0.04 0.00 1.10 0.00 0.00 33.01 30.69 3k5g s GLN 326 CO 0.09 0.44 -0.25 0.45 -0.55 0.00 0.00 175.29 175.47 3k5g s SER 327 N -0.66 3.22 0.00 6.67 0.15 0.14 -4.79 113.70 118.43 3k5g s SER 327 Ca 0.38 -0.78 0.07 0.00 0.70 0.00 0.00 55.95 56.31 3k5g s SER 327 Cb -0.22 -0.22 0.18 0.00 -1.71 0.00 0.00 66.02 64.05 3k5g s SER 327 CO 0.26 0.13 1.13 -1.54 1.20 0.00 0.00 173.24 174.42 3k5g n SER 328 N 0.70 2.52 -1.25 5.45 3.41 -1.26 -2.80 113.62 120.38 3k5g n SER 328 Ca -0.16 -1.96 0.02 0.00 -0.26 0.00 0.00 58.87 56.52 3k5g n SER 328 Cb 0.54 -0.14 0.10 0.00 -0.26 0.00 0.00 64.21 64.46 3k5g n SER 328 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3k5g n THR 329 N 0.15 1.25 0.00 6.66 -2.24 -1.26 -4.87 114.28 113.97 3k5g n THR 329 Ca 0.07 -2.37 0.00 0.00 -2.27 0.00 0.00 64.05 59.48 3k5g n THR 329 Cb 0.35 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.89 3k5g n THR 329 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k5g n GLY 330 N -0.38 0.96 3.76 3.38 0.00 -1.22 -4.53 105.19 107.17 3k5g n GLY 330 Ca 0.15 -2.05 -0.40 0.00 0.00 0.00 0.00 46.02 43.71 3k5g n GLY 330 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k5g s THR 331 N -1.58 3.40 -0.21 2.61 2.01 0.13 -4.35 115.64 117.65 3k5g s THR 331 Ca 0.00 1.41 0.01 0.00 0.31 0.00 0.00 61.69 63.42 3k5g s THR 331 Cb 0.00 -3.90 0.05 0.00 0.01 0.00 0.00 72.50 68.66 3k5g s THR 331 CO 0.00 0.34 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.50 3k5g s VAL 332 N -1.16 1.57 -0.94 3.82 1.01 0.42 -1.68 120.40 123.44 3k5g s VAL 332 Ca 0.45 -1.07 -0.21 0.00 0.00 0.00 0.00 61.98 61.15 3k5g s VAL 332 Cb -0.33 -1.72 0.09 0.00 0.00 0.00 0.00 36.38 34.42 3k5g s VAL 332 CO 0.42 0.06 1.23 -0.04 0.00 0.00 0.00 175.10 176.78 3k5g s MET 333 N 1.41 3.55 0.00 2.72 -1.94 0.20 -1.43 119.30 123.80 3k5g s MET 333 Ca -0.03 -1.42 0.00 0.00 -1.71 0.00 0.00 55.69 52.53 3k5g s MET 333 Cb -0.17 -5.00 0.00 0.00 2.01 0.00 0.00 34.83 31.67 3k5g s MET 333 CO -0.07 -1.94 0.00 0.41 -0.01 0.00 0.00 175.02 173.41 3k5g n GLY 334 N 5.97 -0.01 0.34 -0.03 0.00 -1.12 -1.46 105.19 108.88 3k5g n GLY 334 Ca 0.24 -1.76 0.02 0.00 0.00 0.00 0.00 46.02 44.52 3k5g n GLY 334 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k5g h ALA 335 N -1.61 1.54 0.00 4.61 0.00 0.34 -1.27 119.26 122.87 3k5g h ALA 335 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3k5g h ALA 335 Cb 0.00 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.52 3k5g h ALA 335 CO 0.00 0.43 -0.11 -0.39 0.00 0.00 0.00 179.25 179.17 3k5g h VAL 336 N 0.89 0.42 0.05 0.00 -1.51 -1.28 0.44 116.25 115.26 3k5g h VAL 336 Ca 0.25 -0.60 -0.07 0.00 -1.23 0.00 0.00 66.70 65.06 3k5g h VAL 336 Cb -0.08 1.42 0.01 0.00 -2.13 0.00 0.00 31.29 30.50 3k5g h VAL 336 CO -0.06 0.11 -0.28 0.40 -1.23 0.00 0.00 177.57 176.51 3k5g h ILE 337 N 0.00 1.68 0.00 7.19 1.08 -1.58 -3.38 117.51 122.51 3k5g h ILE 337 Ca -0.00 -2.37 -0.06 0.00 -0.39 0.00 0.00 64.86 62.04 3k5g h ILE 337 Cb 0.41 3.28 -0.01 0.00 -3.07 0.00 0.00 36.82 37.43 3k5g h ILE 337 CO 0.01 0.64 -0.28 0.24 -0.69 0.00 0.00 178.15 178.07 3k5g h MET 338 N -0.75 0.00 -0.12 2.37 2.86 -0.71 -3.08 114.93 115.50 3k5g h MET 338 Ca -0.05 0.00 0.03 0.00 -2.06 0.00 0.00 59.70 57.63 3k5g h MET 338 Cb 1.21 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 32.86 3k5g h MET 338 CO 0.05 0.28 0.10 0.93 1.06 0.00 0.00 176.91 179.34 3k5g h GLU 339 N 0.00 0.00 0.00 1.72 5.08 -1.10 -0.40 114.58 119.88 3k5g h GLU 339 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 3k5g h GLU 339 Cb 0.56 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.81 3k5g h GLU 339 CO 0.04 0.00 -0.02 0.78 -1.00 0.00 0.00 179.01 178.81 3k5g h GLY 340 N 0.00 0.00 -4.15 -3.84 0.00 -1.76 -3.42 103.07 89.90 3k5g h GLY 340 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.23 3k5g h GLY 340 CO -0.00 0.00 -0.69 -1.36 0.00 0.00 0.00 176.54 174.49 3k5g s PHE 341 N -4.06 0.41 -0.21 5.60 0.40 -0.16 -1.99 117.98 117.96 3k5g s PHE 341 Ca -0.03 -0.78 -0.18 0.00 -0.60 0.00 0.00 56.93 55.34 3k5g s PHE 341 Cb 0.12 -0.30 -0.03 0.00 0.51 0.00 0.00 43.02 43.32 3k5g s PHE 341 CO 0.48 -0.27 0.49 -0.47 0.70 0.00 0.00 175.22 176.15 3k5g s TYR 342 N -2.60 3.35 -0.19 0.36 5.04 0.67 -4.35 117.35 119.62 3k5g s TYR 342 Ca -0.05 0.71 0.01 0.00 -2.44 0.00 0.00 57.07 55.29 3k5g s TYR 342 Cb -0.02 -2.65 0.02 0.00 0.35 0.00 0.00 41.96 39.66 3k5g s TYR 342 CO -0.05 -0.12 -0.18 0.08 -1.34 0.00 0.00 175.55 173.94 3k5g s VAL 343 N 1.72 2.18 -0.29 3.14 1.01 -0.49 -1.85 120.40 125.83 3k5g s VAL 343 Ca 0.22 -0.96 -0.10 0.00 0.00 0.00 0.00 61.98 61.14 3k5g s VAL 343 Cb -0.15 -1.95 -0.02 0.00 0.00 0.00 0.00 36.38 34.25 3k5g s VAL 343 CO 0.09 0.48 0.15 -0.69 0.00 0.00 0.00 175.10 175.13 3k5g s VAL 344 N 1.29 4.77 -0.87 2.92 1.01 -0.13 -0.55 120.40 128.84 3k5g s VAL 344 Ca 0.04 -0.20 -0.17 0.00 0.00 0.00 0.00 61.98 61.65 3k5g s VAL 344 Cb -0.14 -3.35 0.17 0.00 0.00 0.00 0.00 36.38 33.06 3k5g s VAL 344 CO -0.11 0.16 0.94 -0.36 0.00 0.00 0.00 175.10 175.73 3k5g s PHE 345 N 1.66 3.41 -1.20 5.22 0.08 0.11 -0.88 117.98 126.38 3k5g s PHE 345 Ca 0.06 -1.65 -0.12 0.00 0.12 0.00 0.00 56.93 55.34 3k5g s PHE 345 Cb -0.16 -4.06 0.19 0.00 -0.57 0.00 0.00 43.02 38.42 3k5g s PHE 345 CO 0.07 -1.25 1.45 -3.47 -0.10 0.00 0.00 175.22 171.92 3k5g n ASP 346 N 5.35 5.30 -0.24 1.36 -0.08 -0.31 -2.31 116.55 125.62 3k5g n ASP 346 Ca 0.18 -3.02 -0.05 0.00 -1.51 0.00 0.00 54.79 50.39 3k5g n ASP 346 Cb 0.48 -1.52 0.06 0.00 2.34 0.00 0.00 41.12 42.48 3k5g n ASP 346 CO 0.00 0.00 0.00 0.03 0.12 0.00 0.00 177.20 177.35 3k5g h ARG 347 N 6.80 0.84 -0.92 -0.67 3.08 -1.75 0.22 114.38 122.00 3k5g h ARG 347 Ca 0.30 -0.05 0.16 0.00 0.07 0.00 0.00 59.98 60.46 3k5g h ARG 347 Cb 0.83 -0.19 -0.08 0.00 0.08 0.00 0.00 29.97 30.61 3k5g h ARG 347 CO 1.26 0.56 0.59 0.00 -1.07 0.00 0.00 179.97 181.31 3k5g h ALA 348 N 1.26 1.85 -0.34 0.04 0.00 -1.49 -1.33 119.26 119.26 3k5g h ALA 348 Ca 0.25 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.19 3k5g h ALA 348 Cb -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3k5g h ALA 348 CO -0.07 -0.12 0.00 0.54 0.00 0.00 0.00 179.25 179.60 3k5g n ARG 349 N -4.59 2.92 -3.77 0.00 1.74 -1.02 -5.00 116.66 106.94 3k5g n ARG 349 Ca 0.19 -2.29 -0.25 0.00 -0.77 0.00 0.00 57.85 54.73 3k5g n ARG 349 Cb 0.51 -1.45 0.02 0.00 -1.02 0.00 0.00 32.46 30.53 3k5g n ARG 349 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74 3k5g n LYS 350 N 0.26 -3.44 -3.73 5.56 5.02 -0.01 -4.92 118.16 116.92 3k5g n LYS 350 Ca 0.15 0.52 -0.10 0.00 -2.02 0.00 0.00 58.31 56.85 3k5g n LYS 350 Cb 0.57 -4.74 -0.06 0.00 -0.02 0.00 0.00 35.03 30.77 3k5g n LYS 350 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 3k5g s ARG 351 N -6.12 0.93 -0.11 1.97 1.70 -0.76 -1.03 118.95 115.54 3k5g s ARG 351 Ca 0.12 -0.70 0.03 0.00 -0.47 0.00 0.00 55.73 54.71 3k5g s ARG 351 Cb -0.04 0.40 0.00 0.00 -0.57 0.00 0.00 34.95 34.75 3k5g s ARG 351 CO 0.85 -0.33 -0.22 0.42 -1.08 0.00 0.00 175.30 174.94 3k5g s ILE 352 N -3.42 1.94 0.06 4.99 1.01 0.67 -1.17 121.20 125.28 3k5g s ILE 352 Ca 0.01 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.74 3k5g s ILE 352 Cb 0.02 -1.69 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 3k5g s ILE 352 CO -0.09 0.53 0.13 -0.83 0.00 0.00 0.00 174.94 174.68 3k5g s GLY 353 N 0.51 2.08 -0.05 6.18 0.00 -0.06 -0.89 107.32 115.09 3k5g s GLY 353 Ca -0.15 -0.92 0.03 0.00 0.00 0.00 0.00 44.72 43.68 3k5g s GLY 353 CO 0.06 -0.88 -0.14 -1.36 0.00 0.00 0.00 173.10 170.77 3k5g s PHE 354 N -1.39 1.46 0.05 1.90 0.40 0.80 -0.96 117.98 120.23 3k5g s PHE 354 Ca 0.30 -0.45 -0.01 0.00 -0.60 0.00 0.00 56.93 56.16 3k5g s PHE 354 Cb -0.12 -1.02 -0.04 0.00 0.51 0.00 0.00 43.02 42.35 3k5g s PHE 354 CO 0.22 -0.19 -0.01 0.00 0.70 0.00 0.00 175.22 175.94 3k5g s ALA 355 N 0.28 0.42 0.16 5.36 0.00 -0.77 -1.01 121.76 126.20 3k5g s ALA 355 Ca -0.07 -1.10 -0.31 0.00 0.00 0.00 0.00 51.96 50.47 3k5g s ALA 355 Cb -0.12 0.27 -0.11 0.00 0.00 0.00 0.00 23.12 23.16 3k5g s ALA 355 CO 0.02 -0.36 1.75 0.08 0.00 0.00 0.00 175.76 177.26 3k5g s VAL 356 N -3.64 2.33 0.46 0.00 1.01 -1.24 -0.24 120.40 119.08 3k5g s VAL 356 Ca 0.04 0.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.90 3k5g s VAL 356 Cb 0.06 -3.05 -0.09 0.00 0.00 0.00 0.00 36.38 33.30 3k5g s VAL 356 CO -0.09 0.00 1.03 -0.55 0.00 0.00 0.00 175.10 175.49 3k5g s SER 357 N 1.88 6.51 0.53 3.32 0.15 -0.84 -1.24 113.70 124.01 3k5g s SER 357 Ca 0.77 1.91 0.26 0.00 0.70 0.00 0.00 55.95 59.59 3k5g s SER 357 Cb -0.47 -2.56 1.51 0.00 -1.71 0.00 0.00 66.02 62.78 3k5g s SER 357 CO 0.34 -0.66 2.13 0.00 1.20 0.00 0.00 173.24 176.24 3k5g h ALA 358 N 1.79 1.44 -0.85 5.45 0.00 -0.98 -1.77 119.26 124.34 3k5g h ALA 358 Ca -0.49 -0.08 -0.52 0.00 0.00 0.00 0.00 54.91 53.82 3k5g h ALA 358 Cb 1.21 -0.01 -0.28 0.00 0.00 0.00 0.00 17.79 18.71 3k5g h ALA 358 CO 0.60 0.11 0.44 0.00 0.00 0.00 0.00 179.25 180.39 3k5g s HIS 360 N -3.53 0.24 -0.25 0.00 -0.00 -0.67 -4.61 115.29 106.48 3k5g s HIS 360 Ca 0.57 0.88 -0.17 0.00 -0.00 0.00 0.00 55.06 56.33 3k5g s HIS 360 Cb 0.47 -2.94 -0.03 0.00 -0.00 0.00 0.00 32.58 30.08 3k5g s HIS 360 CO 0.04 -4.61 0.48 0.08 -0.00 0.00 0.00 174.74 170.73 3k5g s VAL 361 N -2.29 5.10 -0.17 -5.38 1.01 -1.26 -5.03 120.40 112.38 3k5g s VAL 361 Ca 0.69 0.83 -0.11 0.00 0.00 0.00 0.00 61.98 63.39 3k5g s VAL 361 Cb -0.20 -3.80 -0.05 0.00 0.00 0.00 0.00 36.38 32.33 3k5g s VAL 361 CO 0.62 0.13 0.18 -1.00 0.00 0.00 0.00 175.10 175.03 3k5g s HIS 362 N 2.08 3.46 0.19 5.22 3.76 -1.26 -4.20 115.29 124.53 3k5g s HIS 362 Ca 0.20 0.45 0.09 0.00 -0.15 0.00 0.00 55.06 55.65 3k5g s HIS 362 Cb -0.16 -2.17 -0.04 0.00 1.11 0.00 0.00 32.58 31.32 3k5g s HIS 362 CO 0.09 0.36 -0.19 0.34 -0.85 0.00 0.00 174.74 174.49 3k5g s ASP 363 N 0.12 2.89 0.22 1.40 2.15 -1.19 -5.05 116.67 117.22 3k5g s ASP 363 Ca 0.12 -0.90 -0.08 0.00 0.43 0.00 0.00 52.55 52.12 3k5g s ASP 363 Cb -0.12 -0.19 0.25 0.00 -0.30 0.00 0.00 42.92 42.57 3k5g s ASP 363 CO 0.01 -0.02 1.85 -0.33 -0.17 0.00 0.00 175.17 176.52 3k5g h GLU 364 N 3.06 0.91 0.00 4.34 4.39 -2.04 -3.33 114.58 121.92 3k5g h GLU 364 Ca -0.42 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.22 3k5g h GLU 364 Cb 1.21 -0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.66 3k5g h GLU 364 CO 0.53 0.60 0.00 1.19 -1.16 0.00 0.00 179.01 180.17 3k5g n PHE 365 N -4.63 0.00 -4.23 4.33 3.01 -1.26 -5.05 117.46 109.63 3k5g n PHE 365 Ca 0.10 0.00 -0.20 0.00 1.01 0.00 0.00 57.45 58.36 3k5g n PHE 365 Cb 0.12 0.00 -0.12 0.00 -0.01 0.00 0.00 39.48 39.47 3k5g n PHE 365 CO 0.00 0.00 0.00 1.03 1.01 0.00 0.00 176.76 178.80 3k5g s ARG 366 N -0.68 0.99 -0.05 -1.08 0.52 -1.25 -5.15 118.95 112.25 3k5g s ARG 366 Ca 0.00 -1.12 0.02 0.00 -0.52 0.00 0.00 55.73 54.11 3k5g s ARG 366 Cb 0.00 -1.05 0.02 0.00 0.52 0.00 0.00 34.95 34.44 3k5g s ARG 366 CO 0.00 0.23 -0.07 0.95 0.02 0.00 0.00 175.30 176.43 3k5g s THR 367 N -1.52 0.72 0.47 0.02 -4.23 -1.26 -3.17 115.64 106.67 3k5g s THR 367 Ca 0.04 -0.25 -0.23 0.00 -1.18 0.00 0.00 61.69 60.08 3k5g s THR 367 Cb -0.08 -0.70 -0.09 0.00 1.34 0.00 0.00 72.50 72.96 3k5g s THR 367 CO 0.03 0.26 1.04 0.00 -0.54 0.00 0.00 174.62 175.41 3k5g n ALA 368 N 3.89 0.36 -2.54 3.99 0.00 -1.26 -5.00 120.51 119.95 3k5g n ALA 368 Ca -0.24 0.18 -0.09 0.00 0.00 0.00 0.00 53.44 53.29 3k5g n ALA 368 Cb 0.51 -2.12 -0.07 0.00 0.00 0.00 0.00 19.45 17.77 3k5g n ALA 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3k5g s ALA 369 N -1.33 -0.20 -0.18 0.00 0.00 -1.24 -4.97 121.76 113.83 3k5g s ALA 369 Ca 0.66 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.99 3k5g s ALA 369 Cb -0.51 0.48 0.04 0.00 0.00 0.00 0.00 23.12 23.13 3k5g s ALA 369 CO 0.55 -0.51 -0.10 0.08 0.00 0.00 0.00 175.76 175.78 3k5g s VAL 370 N -3.86 1.50 -0.01 0.00 1.01 -1.26 -1.05 120.40 116.73 3k5g s VAL 370 Ca 0.05 -0.84 0.02 0.00 0.00 0.00 0.00 61.98 61.22 3k5g s VAL 370 Cb 0.05 -1.56 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 3k5g s VAL 370 CO -0.11 0.22 -0.08 -1.61 0.00 0.00 0.00 175.10 173.52 3k5g s GLU 371 N 1.47 0.64 0.28 2.72 2.02 -0.30 -4.92 118.70 120.61 3k5g s GLU 371 Ca 0.01 -0.28 -0.17 0.00 0.02 0.00 0.00 54.97 54.55 3k5g s GLU 371 Cb -0.15 -0.61 0.06 0.00 0.10 0.00 0.00 34.13 33.53 3k5g s GLU 371 CO -0.09 0.17 0.86 0.41 0.02 0.00 0.00 175.26 176.63 3k5g n GLY 372 N 2.90 0.85 3.80 -1.39 0.00 -1.26 -0.83 105.19 109.25 3k5g n GLY 372 Ca -0.13 -1.20 -0.34 0.00 0.00 0.00 0.00 46.02 44.35 3k5g n GLY 372 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k5g s PRO 373 N -2.07 3.92 0.08 1.61 0.04 -1.26 -5.09 135.00 132.23 3k5g s PRO 373 Ca 0.18 1.31 0.09 0.00 0.04 0.00 0.00 61.00 62.62 3k5g s PRO 373 Cb -0.04 -2.13 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 3k5g s PRO 373 CO 0.09 -0.32 -0.24 -0.06 0.04 0.00 0.00 177.00 176.50 3k5g s PHE 374 N -2.01 2.10 -0.18 0.56 0.40 0.13 -4.94 117.98 114.05 3k5g s PHE 374 Ca 0.66 -0.40 -0.14 0.00 -0.60 0.00 0.00 56.93 56.45 3k5g s PHE 374 Cb -0.15 -1.21 -0.04 0.00 0.51 0.00 0.00 43.02 42.13 3k5g s PHE 374 CO 0.18 0.19 0.32 0.54 0.70 0.00 0.00 175.22 177.16 3k5g s VAL 375 N -0.94 5.27 0.30 -0.44 0.11 -1.26 -0.88 120.40 122.56 3k5g s VAL 375 Ca 0.10 0.58 0.05 0.00 -2.93 0.00 0.00 61.98 59.79 3k5g s VAL 375 Cb -0.10 -3.66 -0.03 0.00 -1.53 0.00 0.00 36.38 31.06 3k5g s VAL 375 CO 0.03 0.33 0.24 0.42 -3.33 0.00 0.00 175.10 172.80 3k5g s THR 376 N 0.83 0.00 1.00 5.04 -4.23 -0.55 -5.01 115.64 112.72 3k5g s THR 376 Ca 0.17 -1.99 -0.12 0.00 -1.18 0.00 0.00 61.69 58.57 3k5g s THR 376 Cb -0.14 -2.50 0.19 0.00 1.34 0.00 0.00 72.50 71.39 3k5g s THR 376 CO 0.06 0.00 1.08 -0.76 -0.54 0.00 0.00 174.62 174.46 3k5g s LEU 377 N -3.32 1.90 0.00 4.79 1.43 -1.26 -4.85 118.68 117.37 3k5g s LEU 377 Ca 0.40 1.71 0.01 0.00 -1.03 0.00 0.00 54.13 55.22 3k5g s LEU 377 Cb 0.03 -3.93 0.01 0.00 0.03 0.00 0.00 46.19 42.34 3k5g s LEU 377 CO 0.24 -3.37 0.09 -0.90 0.23 0.00 0.00 176.35 172.63 3k5g n ASP 378 N -4.38 2.13 -0.26 2.29 5.68 -1.26 -4.93 116.55 115.82 3k5g n ASP 378 Ca 0.07 -1.85 -0.07 0.00 -0.50 0.00 0.00 54.79 52.45 3k5g n ASP 378 Cb 0.54 0.06 0.05 0.00 -1.14 0.00 0.00 41.12 40.63 3k5g n ASP 378 CO 0.00 0.00 0.00 -0.03 -1.33 0.00 0.00 177.20 175.84 3k5g h MET 379 N 0.00 1.08 -0.97 0.11 1.85 -1.97 -0.37 114.93 114.67 3k5g h MET 379 Ca -0.16 -0.20 0.04 0.00 -0.61 0.00 0.00 59.70 58.77 3k5g h MET 379 Cb 0.52 -0.17 -0.06 0.00 0.43 0.00 0.00 31.60 32.32 3k5g h MET 379 CO 0.26 0.90 0.63 0.93 -0.40 0.00 0.00 176.91 179.22 3k5g h GLU 380 N 1.04 1.16 -0.24 0.39 3.07 -1.96 0.34 114.58 118.37 3k5g h GLU 380 Ca 0.24 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 58.89 3k5g h GLU 380 Cb 0.23 -0.26 -0.01 0.00 -0.84 0.00 0.00 28.75 27.87 3k5g h GLU 380 CO -0.02 0.77 -0.43 -0.44 -1.40 0.00 0.00 179.01 177.49 3k5g h ASP 381 N 1.19 0.63 0.00 1.42 3.32 -1.63 -3.39 116.42 117.96 3k5g h ASP 381 Ca 0.39 -0.29 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3k5g h ASP 381 Cb 0.05 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.42 3k5g h ASP 381 CO -0.14 0.98 -0.78 0.00 -1.72 0.00 0.00 179.24 177.58 3k5g s GLY 383 N -2.00 2.95 0.25 0.00 0.00 0.12 -3.99 107.32 104.65 3k5g s GLY 383 Ca -0.00 0.55 -0.30 0.00 0.00 0.00 0.00 44.72 44.97 3k5g s GLY 383 CO 0.15 1.57 1.08 -0.47 0.00 0.00 0.00 173.10 175.43 3k5g s TYR 384 N 0.52 3.63 0.00 1.90 5.04 -1.26 -4.93 117.35 122.25 3k5g s TYR 384 Ca 0.49 1.70 0.00 0.00 -2.44 0.00 0.00 57.07 56.82 3k5g s TYR 384 Cb -0.22 -3.25 0.00 0.00 0.35 0.00 0.00 41.96 38.84 3k5g s TYR 384 CO 0.29 -0.46 0.45 0.09 -1.34 0.00 0.00 175.55 174.58