#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k1w s THR 2 N 0.00 1.01 -0.22 -5.08 -4.23 -1.26 -5.04 115.64 100.82 3k1w s THR 2 Ca 0.00 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.66 3k1w s THR 2 Cb 0.00 -1.77 0.61 0.00 1.34 0.00 0.00 72.50 72.67 3k1w s THR 2 CO 0.00 -0.78 1.53 0.18 -0.54 0.00 0.00 174.62 175.02 3k1w n LEU 3 N -0.11 4.51 -0.24 4.79 4.77 -1.26 -4.95 117.00 124.52 3k1w n LEU 3 Ca -0.11 -3.11 -0.03 0.00 -0.03 0.00 0.00 56.01 52.73 3k1w n LEU 3 Cb 0.60 -0.60 -0.01 0.00 -2.33 0.00 0.00 43.42 41.08 3k1w n LEU 3 CO 0.31 0.74 -0.03 0.61 -1.33 0.00 0.00 177.39 177.70 3k1w n GLY 4 N -0.35 0.62 0.59 -0.72 0.00 -1.26 -4.93 105.19 99.15 3k1w n GLY 4 Ca 0.26 -0.66 0.06 0.00 0.00 0.00 0.00 46.02 45.68 3k1w n GLY 4 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3k1w n ASN 5 N 0.95 1.46 -4.81 1.61 5.15 -1.26 -4.63 115.26 113.73 3k1w n ASN 5 Ca -0.03 -2.94 -0.36 0.00 -0.60 0.00 0.00 54.58 50.64 3k1w n ASN 5 Cb 0.13 -0.40 -0.07 0.00 -0.53 0.00 0.00 39.78 38.91 3k1w n ASN 5 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 3k1w s THR 6 N -1.92 5.46 0.27 -0.44 2.01 -1.26 -4.86 115.64 114.90 3k1w s THR 6 Ca 0.28 0.21 0.03 0.00 0.31 0.00 0.00 61.69 62.52 3k1w s THR 6 Cb 0.28 -3.44 -0.06 0.00 0.01 0.00 0.00 72.50 69.29 3k1w s THR 6 CO -0.05 0.53 0.05 0.42 -0.69 0.00 0.00 174.62 174.88 3k1w s THR 7 N -0.35 0.94 0.05 -0.82 -4.23 -1.26 -0.21 115.64 109.76 3k1w s THR 7 Ca 0.12 -2.01 0.03 0.00 -1.18 0.00 0.00 61.69 58.64 3k1w s THR 7 Cb -0.12 -2.58 -0.03 0.00 1.34 0.00 0.00 72.50 71.12 3k1w s THR 7 CO 0.01 -0.12 -0.09 -0.55 -0.54 0.00 0.00 174.62 173.33 3k1w s SER 8 N -3.37 0.99 0.05 3.99 0.15 -0.36 -4.98 113.70 110.17 3k1w s SER 8 Ca 0.34 -0.58 0.06 0.00 0.70 0.00 0.00 55.95 56.47 3k1w s SER 8 Cb 0.07 0.03 -0.02 0.00 -1.71 0.00 0.00 66.02 64.38 3k1w s SER 8 CO 0.12 -0.20 -0.16 -0.44 1.20 0.00 0.00 173.24 173.76 3k1w s SER 9 N -1.66 1.95 -0.12 5.45 0.01 -1.26 0.65 113.70 118.73 3k1w s SER 9 Ca -0.08 -0.50 0.01 0.00 1.31 0.00 0.00 55.95 56.69 3k1w s SER 9 Cb -0.09 -0.13 0.02 0.00 0.21 0.00 0.00 66.02 66.02 3k1w s SER 9 CO 0.00 0.07 -0.14 -0.69 0.41 0.00 0.00 173.24 172.89 3k1w s VAL 10 N -0.88 1.42 0.21 3.43 1.01 0.32 -4.43 120.40 121.49 3k1w s VAL 10 Ca 0.03 -0.58 -0.30 0.00 0.00 0.00 0.00 61.98 61.14 3k1w s VAL 10 Cb -0.08 -1.33 -0.08 0.00 0.00 0.00 0.00 36.38 34.89 3k1w s VAL 10 CO 0.02 0.43 0.98 -0.63 0.00 0.00 0.00 175.10 175.89 3k1w s ILE 11 N 1.19 4.07 0.10 2.22 -1.09 -1.26 -1.27 121.20 125.15 3k1w s ILE 11 Ca -0.03 1.97 0.07 0.00 -2.23 0.00 0.00 60.65 60.43 3k1w s ILE 11 Cb -0.14 -4.25 -0.04 0.00 -1.58 0.00 0.00 42.46 36.45 3k1w s ILE 11 CO -0.04 0.42 -0.11 -0.76 -1.23 0.00 0.00 174.94 173.22 3k1w s LEU 12 N -0.88 2.99 -0.09 2.97 1.43 -0.11 -4.39 118.68 120.60 3k1w s LEU 12 Ca 0.43 -0.40 -0.10 0.00 -1.03 0.00 0.00 54.13 53.03 3k1w s LEU 12 Cb -0.26 -1.79 -0.05 0.00 0.03 0.00 0.00 46.19 44.12 3k1w s LEU 12 CO 0.33 0.18 0.25 -0.89 0.23 0.00 0.00 176.35 176.45 3k1w s THR 13 N -1.19 5.32 -0.44 5.49 2.01 0.13 -1.95 115.64 125.01 3k1w s THR 13 Ca 0.21 0.46 -0.10 0.00 0.31 0.00 0.00 61.69 62.57 3k1w s THR 13 Cb -0.11 -3.53 0.09 0.00 0.01 0.00 0.00 72.50 68.96 3k1w s THR 13 CO 0.13 0.58 0.30 0.21 -0.69 0.00 0.00 174.62 175.14 3k1w s ASN 14 N -0.85 5.69 -0.40 3.53 3.04 -1.26 -1.56 114.94 123.13 3k1w s ASN 14 Ca 0.18 -1.64 -0.22 0.00 0.04 0.00 0.00 52.86 51.22 3k1w s ASN 14 Cb -0.14 -2.01 0.02 0.00 -1.54 0.00 0.00 41.25 37.58 3k1w s ASN 14 CO 0.07 -0.60 0.72 -0.47 -3.04 0.00 0.00 177.10 173.78 3k1w s TYR 15 N 1.42 3.07 -0.75 0.43 5.04 0.18 -4.59 117.35 122.14 3k1w s TYR 15 Ca 0.04 0.26 -0.03 0.00 -2.44 0.00 0.00 57.07 54.91 3k1w s TYR 15 Cb -0.24 -3.42 0.02 0.00 0.35 0.00 0.00 41.96 38.67 3k1w s TYR 15 CO 0.01 -0.82 0.12 0.00 -1.34 0.00 0.00 175.55 173.52 3k1w n MET 16 N 6.40 -2.64 -0.91 4.97 0.00 -1.26 -1.40 117.12 122.27 3k1w n MET 16 Ca 0.01 0.34 0.00 0.00 0.00 0.00 0.00 57.70 58.05 3k1w n MET 16 Cb 0.48 -4.92 0.00 0.00 0.00 0.00 0.00 33.22 28.78 3k1w n MET 16 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 175.97 175.72 3k1w n ASP 17 N -1.81 -3.10 0.00 3.17 8.00 -1.26 -4.80 116.55 116.74 3k1w n ASP 17 Ca -0.06 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.44 3k1w n ASP 17 Cb 0.55 -1.87 0.00 0.00 -0.02 0.00 0.00 41.12 39.79 3k1w n ASP 17 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 3k1w n THR 18 N -2.31 0.00 -3.75 -3.53 -2.24 -0.49 -4.79 114.28 97.17 3k1w n THR 18 Ca 0.00 -0.18 -0.24 0.00 -2.27 0.00 0.00 64.05 61.37 3k1w n THR 18 Cb 0.18 0.67 -0.17 0.00 -2.10 0.00 0.00 70.33 68.91 3k1w n THR 18 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3k1w s GLN 19 N -1.59 0.52 -0.17 -0.78 -0.21 -0.89 -4.41 119.66 112.13 3k1w s GLN 19 Ca 0.00 0.04 -0.00 0.00 0.02 0.00 0.00 55.36 55.41 3k1w s GLN 19 Cb 0.00 -1.17 0.00 0.00 1.00 0.00 0.00 33.01 32.85 3k1w s GLN 19 CO 0.00 -0.38 -0.15 0.71 -2.12 0.00 0.00 175.29 173.35 3k1w s TYR 20 N 1.98 2.81 0.03 0.91 2.02 -1.26 -0.65 117.35 123.19 3k1w s TYR 20 Ca 0.04 -1.15 -0.14 0.00 -0.37 0.00 0.00 57.07 55.45 3k1w s TYR 20 Cb -0.13 -1.93 0.02 0.00 -0.40 0.00 0.00 41.96 39.52 3k1w s TYR 20 CO -0.06 -0.55 0.30 1.52 -1.57 0.00 0.00 175.55 175.18 3k1w s TYR 21 N 1.02 -0.11 0.22 2.71 1.13 -0.60 -4.39 117.35 117.32 3k1w s TYR 21 Ca -0.01 0.03 0.04 0.00 -1.41 0.00 0.00 57.07 55.72 3k1w s TYR 21 Cb -0.15 0.08 -0.01 0.00 -1.10 0.00 0.00 41.96 40.78 3k1w s TYR 21 CO -0.03 -0.46 0.14 0.41 -2.51 0.00 0.00 175.55 173.10 3k1w n GLY 22 N 0.79 3.43 3.76 5.49 0.00 -0.62 0.21 105.19 118.25 3k1w n GLY 22 Ca -0.19 -1.88 -0.35 0.00 0.00 0.00 0.00 46.02 43.60 3k1w n GLY 22 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3k1w s GLU 23 N -2.86 3.11 0.22 1.61 2.02 -1.26 -0.16 118.70 121.39 3k1w s GLU 23 Ca 0.20 -0.38 0.08 0.00 0.02 0.00 0.00 54.97 54.89 3k1w s GLU 23 Cb 0.01 -2.90 -0.05 0.00 0.10 0.00 0.00 34.13 31.29 3k1w s GLU 23 CO 0.14 0.70 -0.13 0.96 0.02 0.00 0.00 175.26 176.95 3k1w s ILE 24 N -1.03 1.76 -0.02 -1.63 -4.36 -0.37 -4.72 121.20 110.82 3k1w s ILE 24 Ca 0.17 -2.21 0.02 0.00 -0.26 0.00 0.00 60.65 58.37 3k1w s ILE 24 Cb -0.12 -2.14 -0.03 0.00 1.25 0.00 0.00 42.46 41.42 3k1w s ILE 24 CO 0.07 -0.52 -0.04 -0.83 0.24 0.00 0.00 174.94 173.86 3k1w s GLY 25 N -3.35 1.80 -0.07 6.27 0.00 -0.76 -1.12 107.32 110.08 3k1w s GLY 25 Ca 0.24 -0.96 0.03 0.00 0.00 0.00 0.00 44.72 44.03 3k1w s GLY 25 CO 0.08 -0.80 -0.16 -0.42 0.00 0.00 0.00 173.10 171.81 3k1w s ILE 26 N -0.99 1.39 0.00 0.90 1.01 0.14 -1.04 121.20 122.61 3k1w s ILE 26 Ca 0.17 -0.63 0.00 0.00 0.00 0.00 0.00 60.65 60.19 3k1w s ILE 26 Cb -0.11 -1.24 0.00 0.00 0.01 0.00 0.00 42.46 41.12 3k1w s ILE 26 CO 0.07 0.41 0.00 0.61 0.00 0.00 0.00 174.94 176.03 3k1w n GLY 27 N 3.69 -3.04 2.92 6.18 0.00 0.25 0.21 105.19 115.40 3k1w n GLY 27 Ca -0.22 -1.78 -0.29 0.00 0.00 0.00 0.00 46.02 43.73 3k1w n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k1w s THR 28 N -0.88 1.32 0.79 2.61 2.01 -1.26 -2.01 115.64 118.23 3k1w s THR 28 Ca 0.00 -0.91 -0.11 0.00 0.31 0.00 0.00 61.69 60.98 3k1w s THR 28 Cb 0.00 -1.53 0.07 0.00 0.01 0.00 0.00 72.50 71.05 3k1w s THR 28 CO 0.00 0.03 1.09 -2.16 -0.69 0.00 0.00 174.62 172.89 3k1w s PRO 29 N 1.52 2.11 0.24 4.92 0.04 -1.26 -1.11 135.00 141.46 3k1w s PRO 29 Ca -0.02 1.01 -0.31 0.00 0.04 0.00 0.00 61.00 61.72 3k1w s PRO 29 Cb -0.17 -1.89 -0.12 0.00 0.04 0.00 0.00 34.50 32.36 3k1w s PRO 29 CO -0.07 -1.70 1.62 -2.30 0.04 0.00 0.00 177.00 174.59 3k1w n PRO 30 N -3.54 2.60 -3.70 0.56 -0.02 -0.85 -4.89 135.00 125.16 3k1w n PRO 30 Ca 0.08 0.93 -0.35 0.00 -2.02 0.00 0.00 63.50 62.14 3k1w n PRO 30 Cb 0.54 -2.72 -0.08 0.00 -0.02 0.00 0.00 33.50 31.22 3k1w n PRO 30 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3k1w s GLN 31 N 0.27 4.14 -0.09 -0.52 -0.21 0.13 -4.80 119.66 118.58 3k1w s GLN 31 Ca 0.70 -0.14 -0.13 0.00 0.02 0.00 0.00 55.36 55.81 3k1w s GLN 31 Cb -0.54 -3.40 -0.05 0.00 1.00 0.00 0.00 33.01 30.02 3k1w s GLN 31 CO 0.42 0.33 0.33 0.99 -2.12 0.00 0.00 175.29 175.23 3k1w s THR 32 N 0.25 5.22 -0.01 -0.19 2.01 -1.26 0.27 115.64 121.93 3k1w s THR 32 Ca 0.10 0.64 0.02 0.00 0.31 0.00 0.00 61.69 62.76 3k1w s THR 32 Cb -0.12 -3.64 0.00 0.00 0.01 0.00 0.00 72.50 68.76 3k1w s THR 32 CO -0.00 0.50 -0.06 -0.36 -0.69 0.00 0.00 174.62 174.00 3k1w s PHE 33 N -0.39 0.66 -0.03 4.92 0.08 -0.28 -4.99 117.98 117.94 3k1w s PHE 33 Ca 0.20 -0.14 -0.28 0.00 0.12 0.00 0.00 56.93 56.83 3k1w s PHE 33 Cb -0.14 -0.47 -0.03 0.00 -0.57 0.00 0.00 43.02 41.81 3k1w s PHE 33 CO 0.08 -0.05 0.92 0.15 -0.10 0.00 0.00 175.22 176.21 3k1w s LYS 34 N 0.09 4.51 0.01 0.44 1.02 -1.26 -1.24 119.74 123.31 3k1w s LYS 34 Ca -0.01 1.28 -0.00 0.00 0.02 0.00 0.00 55.97 57.26 3k1w s LYS 34 Cb -0.06 -3.47 -0.01 0.00 -0.52 0.00 0.00 37.83 33.77 3k1w s LYS 34 CO -0.00 -0.07 -0.01 0.14 -0.92 0.00 0.00 175.35 174.49 3k1w s VAL 35 N 1.13 0.06 0.06 3.17 -7.23 0.78 0.10 120.40 118.47 3k1w s VAL 35 Ca 0.48 -0.53 -0.24 0.00 -1.81 0.00 0.00 61.98 59.88 3k1w s VAL 35 Cb -0.20 -0.17 -0.06 0.00 0.56 0.00 0.00 36.38 36.52 3k1w s VAL 35 CO 0.24 -0.29 0.73 -0.69 -0.31 0.00 0.00 175.10 174.77 3k1w s VAL 36 N -0.86 4.70 -0.36 1.32 1.01 -0.89 -1.59 120.40 123.74 3k1w s VAL 36 Ca -0.09 1.55 -0.16 0.00 0.00 0.00 0.00 61.98 63.27 3k1w s VAL 36 Cb -0.06 -4.07 -0.00 0.00 0.00 0.00 0.00 36.38 32.24 3k1w s VAL 36 CO -0.01 0.41 0.40 -0.36 0.00 0.00 0.00 175.10 175.55 3k1w s PHE 37 N -0.32 3.20 -0.29 5.22 0.40 -1.26 -0.59 117.98 124.34 3k1w s PHE 37 Ca 0.36 -0.05 0.03 0.00 -0.60 0.00 0.00 56.93 56.66 3k1w s PHE 37 Cb -0.20 -2.75 0.08 0.00 0.51 0.00 0.00 43.02 40.65 3k1w s PHE 37 CO 0.22 -0.50 -0.03 0.34 0.70 0.00 0.00 175.22 175.95 3k1w s ASP 38 N 1.75 4.43 0.00 1.36 2.15 -0.36 -4.14 116.67 121.86 3k1w s ASP 38 Ca 0.13 -1.63 0.19 0.00 0.43 0.00 0.00 52.55 51.66 3k1w s ASP 38 Cb -0.16 -1.47 0.87 0.00 -0.30 0.00 0.00 42.92 41.86 3k1w s ASP 38 CO 0.12 -0.28 1.59 0.35 -0.17 0.00 0.00 175.17 176.79 3k1w n THR 39 N 4.44 0.59 1.36 1.71 -2.24 -1.26 -0.63 114.28 118.24 3k1w n THR 39 Ca -0.07 0.15 0.09 0.00 -2.27 0.00 0.00 64.05 61.95 3k1w n THR 39 Cb 0.42 -0.83 0.35 0.00 -2.10 0.00 0.00 70.33 68.18 3k1w n THR 39 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k1w n GLY 40 N 0.37 0.03 3.45 3.38 0.00 -1.26 -4.02 105.19 107.15 3k1w n GLY 40 Ca 0.07 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 45.65 3k1w n GLY 40 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k1w s SER 41 N -1.45 -0.02 0.00 1.61 1.04 -1.03 -5.00 113.70 108.84 3k1w s SER 41 Ca 0.28 -0.96 0.00 0.00 0.48 0.00 0.00 55.95 55.75 3k1w s SER 41 Cb 0.15 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.78 3k1w s SER 41 CO 0.22 -1.02 0.48 -1.20 0.98 0.00 0.00 173.24 172.71 3k1w n SER 42 N -0.31 0.87 -4.70 7.02 7.64 -1.26 -0.42 113.62 122.45 3k1w n SER 42 Ca -0.03 -1.19 -0.23 0.00 1.01 0.00 0.00 58.87 58.43 3k1w n SER 42 Cb 0.63 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.77 3k1w n SER 42 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3k1w s ASN 43 N -0.19 4.84 -0.20 6.43 -0.87 -1.26 -4.47 114.94 119.21 3k1w s ASN 43 Ca 0.00 -0.54 -0.09 0.00 -1.57 0.00 0.00 52.86 50.66 3k1w s ASN 43 Cb 0.00 -0.99 -0.04 0.00 -0.02 0.00 0.00 41.25 40.19 3k1w s ASN 43 CO 0.00 -0.04 0.10 -0.69 -2.57 0.00 0.00 177.10 173.90 3k1w s VAL 44 N -2.28 5.05 -0.04 1.60 1.01 -1.26 -0.59 120.40 123.90 3k1w s VAL 44 Ca 0.32 0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.41 3k1w s VAL 44 Cb -0.06 -3.30 -0.00 0.00 0.00 0.00 0.00 36.38 33.01 3k1w s VAL 44 CO 0.22 0.44 -0.17 0.26 0.00 0.00 0.00 175.10 175.84 3k1w s TRP 45 N 0.47 1.73 0.05 5.22 0.52 -0.11 -0.23 118.94 126.58 3k1w s TRP 45 Ca 0.05 -0.48 -0.02 0.00 0.02 0.00 0.00 56.10 55.67 3k1w s TRP 45 Cb -0.12 -1.16 -0.03 0.00 -1.15 0.00 0.00 33.47 31.01 3k1w s TRP 45 CO -0.00 -0.16 0.00 0.14 0.02 0.00 0.00 176.95 176.96 3k1w s VAL 46 N -0.01 0.19 0.39 4.03 -7.23 -0.52 -1.24 120.40 116.02 3k1w s VAL 46 Ca -0.03 -1.55 -0.25 0.00 -1.81 0.00 0.00 61.98 58.34 3k1w s VAL 46 Cb -0.11 -1.25 -0.09 0.00 0.56 0.00 0.00 36.38 35.49 3k1w s VAL 46 CO 0.02 -0.85 1.11 -2.84 -0.31 0.00 0.00 175.10 172.22 3k1w s PRO 47 N -3.41 4.13 0.19 4.82 0.02 -1.26 -0.51 135.00 138.97 3k1w s PRO 47 Ca 0.02 1.68 -0.14 0.00 0.02 0.00 0.00 61.00 62.58 3k1w s PRO 47 Cb 0.04 -2.63 -0.07 0.00 0.02 0.00 0.00 34.50 31.85 3k1w s PRO 47 CO -0.08 -0.21 0.59 0.45 -0.33 0.00 0.00 177.00 177.42 3k1w s SER 48 N -1.33 6.82 0.58 2.53 0.15 0.30 0.05 113.70 122.81 3k1w s SER 48 Ca 0.57 1.12 0.28 0.00 0.70 0.00 0.00 55.95 58.62 3k1w s SER 48 Cb -0.27 -2.30 1.53 0.00 -1.71 0.00 0.00 66.02 63.27 3k1w s SER 48 CO 0.33 0.03 1.98 0.77 1.20 0.00 0.00 173.24 177.56 3k1w h SER 49 N 3.23 0.00 -0.05 5.45 4.64 -0.97 -1.93 113.55 123.92 3k1w h SER 49 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 3k1w h SER 49 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 3k1w h SER 49 CO 0.66 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 176.91 3k1w n LYS 50 N -3.84 1.34 -2.17 4.77 5.02 -1.26 -4.84 118.16 117.18 3k1w n LYS 50 Ca 0.06 -0.50 -0.42 0.00 -2.02 0.00 0.00 58.31 55.43 3k1w n LYS 50 Cb 0.53 -1.40 -0.03 0.00 -0.02 0.00 0.00 35.03 34.12 3k1w n LYS 50 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k1w s SER 52 N 2.30 4.76 0.49 0.00 0.15 -1.25 -4.86 113.70 115.28 3k1w s SER 52 Ca 0.66 2.61 0.29 0.00 0.70 0.00 0.00 55.95 60.22 3k1w s SER 52 Cb -0.31 -2.62 1.60 0.00 -1.71 0.00 0.00 66.02 62.98 3k1w s SER 52 CO 0.26 -1.90 1.89 0.03 1.20 0.00 0.00 173.24 174.72 3k1w h ARG 53 N 0.70 0.00 -0.01 5.44 2.47 -1.97 -2.15 114.38 118.87 3k1w h ARG 53 Ca -0.51 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.21 3k1w h ARG 53 Cb 1.33 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.65 3k1w h ARG 53 CO 0.54 0.00 -0.03 1.28 0.56 0.00 0.00 179.97 182.32 3k1w n LEU 54 N -2.59 0.73 -4.38 3.04 4.77 -1.26 -4.53 117.00 112.78 3k1w n LEU 54 Ca -0.02 -0.21 -0.44 0.00 -0.03 0.00 0.00 56.01 55.32 3k1w n LEU 54 Cb 0.13 -0.04 -0.08 0.00 -2.33 0.00 0.00 43.42 41.10 3k1w n LEU 54 CO 0.13 0.12 -0.01 -0.31 -1.33 0.00 0.00 177.39 176.00 3k1w s TYR 55 N -2.11 3.26 0.35 -1.77 2.02 -0.81 -4.95 117.35 113.33 3k1w s TYR 55 Ca 0.39 -0.97 0.06 0.00 -0.37 0.00 0.00 57.07 56.18 3k1w s TYR 55 Cb 0.21 -3.05 0.65 0.00 -0.40 0.00 0.00 41.96 39.37 3k1w s TYR 55 CO 0.38 -0.77 1.88 1.79 -1.57 0.00 0.00 175.55 177.26 3k1w h THR 56 N 5.79 1.19 0.00 -0.71 1.35 -1.88 -0.99 112.91 117.67 3k1w h THR 56 Ca -0.27 -0.81 -0.00 0.00 -0.55 0.00 0.00 66.41 64.78 3k1w h THR 56 Cb 1.11 1.05 -0.00 0.00 -1.73 0.00 0.00 68.15 68.57 3k1w h THR 56 CO 0.84 0.27 -0.00 0.00 -0.25 0.00 0.00 175.52 176.37 3k1w h ALA 57 N 1.54 1.17 0.06 6.62 0.00 -1.85 -2.67 119.26 124.13 3k1w h ALA 57 Ca 0.09 -0.00 -0.30 0.00 0.00 0.00 0.00 54.91 54.70 3k1w h ALA 57 Cb 0.36 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 3k1w h ALA 57 CO 0.02 0.01 -1.63 0.00 0.00 0.00 0.00 179.25 177.65 3k1w h VAL 59 N -0.51 0.46 -0.33 0.00 -1.51 -1.07 -2.07 116.25 111.23 3k1w h VAL 59 Ca -0.39 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.03 3k1w h VAL 59 Cb 1.64 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 31.84 3k1w h VAL 59 CO -0.08 0.01 0.00 -1.22 -1.23 0.00 0.00 177.57 175.05 3k1w n TYR 60 N -3.73 0.42 -4.37 5.19 0.53 -1.07 -4.97 117.16 109.16 3k1w n TYR 60 Ca -0.03 -0.28 -0.24 0.00 -1.02 0.00 0.00 57.90 56.33 3k1w n TYR 60 Cb 0.09 -0.01 -0.09 0.00 -1.03 0.00 0.00 39.34 38.31 3k1w n TYR 60 CO 0.00 0.00 0.00 -1.01 -1.02 0.00 0.00 176.86 174.83 3k1w s HIS 61 N -1.23 2.51 0.30 -0.72 3.76 -0.78 -5.11 115.29 114.02 3k1w s HIS 61 Ca 0.31 -0.37 -0.30 0.00 -0.15 0.00 0.00 55.06 54.55 3k1w s HIS 61 Cb 0.18 -1.30 -0.11 0.00 1.11 0.00 0.00 32.58 32.46 3k1w s HIS 61 CO 0.25 0.57 1.54 0.15 -0.85 0.00 0.00 174.74 176.39 3k1w s LYS 62 N -3.65 4.16 0.00 1.40 -0.14 -1.26 -4.95 119.74 115.29 3k1w s LYS 62 Ca 0.33 2.51 0.05 0.00 -1.36 0.00 0.00 55.97 57.50 3k1w s LYS 62 Cb -0.02 -3.03 -0.03 0.00 -1.68 0.00 0.00 37.83 33.06 3k1w s LYS 62 CO 0.18 -0.56 -0.15 -0.51 -0.76 0.00 0.00 175.35 173.56 3k1w s LEU 63 N -0.79 2.76 -0.11 3.17 1.43 -1.26 -4.36 118.68 119.52 3k1w s LEU 63 Ca 0.60 -0.29 -0.28 0.00 -1.03 0.00 0.00 54.13 53.12 3k1w s LEU 63 Cb -0.46 -1.59 -0.01 0.00 0.03 0.00 0.00 46.19 44.15 3k1w s LEU 63 CO 0.50 0.29 0.95 0.12 0.23 0.00 0.00 176.35 178.44 3k1w s PHE 64 N -0.88 3.51 -0.48 0.29 5.36 0.11 -4.70 117.98 121.18 3k1w s PHE 64 Ca 0.14 1.51 -0.06 0.00 -0.96 0.00 0.00 56.93 57.56 3k1w s PHE 64 Cb -0.11 -3.13 0.13 0.00 -0.34 0.00 0.00 43.02 39.57 3k1w s PHE 64 CO 0.04 -0.20 0.32 0.34 -1.46 0.00 0.00 175.22 174.26 3k1w s ASP 65 N 1.09 5.51 0.27 6.13 2.15 -1.26 -0.35 116.67 130.20 3k1w s ASP 65 Ca 0.46 -2.12 -0.02 0.00 0.43 0.00 0.00 52.55 51.30 3k1w s ASP 65 Cb -0.18 -1.93 0.43 0.00 -0.30 0.00 0.00 42.92 40.95 3k1w s ASP 65 CO 0.17 -0.59 1.87 0.00 -0.17 0.00 0.00 175.17 176.45 3k1w h ALA 66 N 8.07 1.40 0.00 3.66 0.00 -1.95 -1.48 119.26 128.96 3k1w h ALA 66 Ca -0.14 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3k1w h ALA 66 Cb 1.04 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.56 3k1w h ALA 66 CO 0.77 0.38 0.00 -1.13 0.00 0.00 0.00 179.25 179.27 3k1w n SER 67 N -4.54 0.00 -0.88 0.00 3.41 -1.26 -1.68 113.62 108.67 3k1w n SER 67 Ca 0.16 0.40 0.12 0.00 -0.26 0.00 0.00 58.87 59.29 3k1w n SER 67 Cb 0.22 -0.44 0.27 0.00 -0.26 0.00 0.00 64.21 64.00 3k1w n SER 67 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3k1w n ASP 68 N -1.44 2.65 -4.13 4.04 8.00 -0.56 -4.89 116.55 120.22 3k1w n ASP 68 Ca 0.03 -1.86 -0.33 0.00 0.71 0.00 0.00 54.79 53.34 3k1w n ASP 68 Cb 0.10 -0.13 -0.16 0.00 -0.02 0.00 0.00 41.12 40.91 3k1w n ASP 68 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 3k1w s SER 69 N -1.68 3.13 0.18 -2.24 0.15 -0.68 -4.27 113.70 108.30 3k1w s SER 69 Ca 0.35 -0.64 0.22 0.00 0.70 0.00 0.00 55.95 56.57 3k1w s SER 69 Cb 0.21 -1.47 0.89 0.00 -1.71 0.00 0.00 66.02 63.93 3k1w s SER 69 CO 0.30 0.02 1.66 -1.54 1.20 0.00 0.00 173.24 174.88 3k1w n SER 70 N 4.47 0.50 -0.78 5.45 3.41 -0.26 -2.87 113.62 123.54 3k1w n SER 70 Ca -0.21 0.61 0.09 0.00 -0.26 0.00 0.00 58.87 59.11 3k1w n SER 70 Cb 0.50 -0.72 0.09 0.00 -0.26 0.00 0.00 64.21 63.82 3k1w n SER 70 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3k1w n SER 71 N -2.04 2.64 -4.76 4.04 3.41 -1.26 -4.99 113.62 110.66 3k1w n SER 71 Ca 0.03 -1.80 -0.41 0.00 -0.26 0.00 0.00 58.87 56.43 3k1w n SER 71 Cb 0.23 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.13 3k1w n SER 71 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 175.04 174.41 3k1w s TYR 72 N -1.54 3.07 -0.12 7.33 6.14 -1.14 -4.58 117.35 126.51 3k1w s TYR 72 Ca 0.23 1.29 0.02 0.00 0.64 0.00 0.00 57.07 59.25 3k1w s TYR 72 Cb 0.16 -3.70 0.02 0.00 0.42 0.00 0.00 41.96 38.85 3k1w s TYR 72 CO 0.24 -2.06 -0.16 0.21 0.64 0.00 0.00 175.55 174.43 3k1w s LYS 73 N -1.22 2.32 0.38 4.97 2.20 -0.12 -5.02 119.74 123.25 3k1w s LYS 73 Ca 0.52 -0.59 -0.27 0.00 -0.36 0.00 0.00 55.97 55.27 3k1w s LYS 73 Cb -0.40 -1.98 -0.09 0.00 -1.51 0.00 0.00 37.83 33.85 3k1w s LYS 73 CO 0.49 -0.08 1.28 -1.58 -0.36 0.00 0.00 175.35 175.09 3k1w s HIS 74 N 1.04 2.96 0.01 4.03 5.65 -1.26 -2.20 115.29 125.52 3k1w s HIS 74 Ca -0.05 1.44 0.00 0.00 0.25 0.00 0.00 55.06 56.70 3k1w s HIS 74 Cb -0.15 -3.62 0.00 0.00 -1.18 0.00 0.00 32.58 27.63 3k1w s HIS 74 CO -0.03 -1.85 0.00 -1.71 -0.65 0.00 0.00 174.74 170.50 3k1w n ASN 75 N 0.38 0.02 0.00 9.88 2.85 -1.24 -4.87 115.26 122.27 3k1w n ASN 75 Ca 0.02 0.01 0.00 0.00 -0.11 0.00 0.00 54.58 54.51 3k1w n ASN 75 Cb 0.43 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.46 3k1w n ASN 75 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 3k1w n GLY 76 N 2.46 0.80 3.63 8.20 0.00 0.64 -4.98 105.19 115.94 3k1w n GLY 76 Ca 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.52 3k1w n GLY 76 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3k1w n THR 77 N -2.00 0.04 -2.68 2.61 -1.04 -1.26 -4.60 114.28 105.34 3k1w n THR 77 Ca 0.00 -0.01 -0.38 0.00 -2.04 0.00 0.00 64.05 61.62 3k1w n THR 77 Cb 0.00 -1.17 -0.06 0.00 -1.82 0.00 0.00 70.33 67.28 3k1w n THR 77 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3k1w s GLU 78 N 0.94 4.60 0.07 -2.82 0.41 -1.26 -0.05 118.70 120.58 3k1w s GLU 78 Ca 0.83 1.48 0.08 0.00 -0.41 0.00 0.00 54.97 56.95 3k1w s GLU 78 Cb -0.84 -2.95 -0.03 0.00 -1.78 0.00 0.00 34.13 28.54 3k1w s GLU 78 CO 0.44 0.26 -0.22 -0.51 -0.49 0.00 0.00 175.26 174.74 3k1w s LEU 79 N -1.82 2.23 -0.04 1.80 1.43 0.12 -4.89 118.68 117.51 3k1w s LEU 79 Ca 0.48 -0.61 -0.05 0.00 -1.03 0.00 0.00 54.13 52.92 3k1w s LEU 79 Cb -0.23 -1.01 0.01 0.00 0.03 0.00 0.00 46.19 44.99 3k1w s LEU 79 CO 0.29 0.14 0.14 -0.89 0.23 0.00 0.00 176.35 176.26 3k1w s THR 80 N -0.95 0.02 -0.16 5.49 2.01 -1.26 -1.97 115.64 118.82 3k1w s THR 80 Ca 0.08 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 61.90 3k1w s THR 80 Cb -0.09 -0.26 0.04 0.00 0.01 0.00 0.00 72.50 72.19 3k1w s THR 80 CO 0.03 -0.10 -0.04 -0.22 -0.69 0.00 0.00 174.62 173.61 3k1w s LEU 81 N -0.28 1.47 -1.30 4.42 2.96 0.15 -5.02 118.68 121.07 3k1w s LEU 81 Ca -0.04 -0.62 -0.18 0.00 -0.22 0.00 0.00 54.13 53.07 3k1w s LEU 81 Cb -0.03 -0.83 0.03 0.00 0.50 0.00 0.00 46.19 45.86 3k1w s LEU 81 CO 0.00 -0.20 1.89 -1.14 -1.32 0.00 0.00 176.35 175.59 3k1w n ARG 82 N 4.92 2.84 -2.65 1.98 0.63 -1.26 -0.89 116.66 122.24 3k1w n ARG 82 Ca -0.11 -2.94 -0.34 0.00 -0.92 0.00 0.00 57.85 53.54 3k1w n ARG 82 Cb 0.48 -3.44 -0.05 0.00 0.45 0.00 0.00 32.46 29.90 3k1w n ARG 82 CO 0.00 0.00 0.00 -0.47 -2.51 0.00 0.00 177.63 174.65 3k1w s TYR 83 N 4.79 3.13 0.18 -0.14 6.14 -1.18 -4.97 117.35 125.31 3k1w s TYR 83 Ca 0.54 1.60 -0.27 0.00 0.64 0.00 0.00 57.07 59.58 3k1w s TYR 83 Cb 0.07 -2.99 0.03 0.00 0.42 0.00 0.00 41.96 39.48 3k1w s TYR 83 CO 0.05 -0.55 1.54 1.03 0.64 0.00 0.00 175.55 178.26 3k1w h SER 84 N 1.77 -1.93 0.49 4.32 0.87 -1.99 -1.85 113.55 115.24 3k1w h SER 84 Ca -0.49 0.32 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 3k1w h SER 84 Cb 1.21 0.89 0.00 0.00 -0.44 0.00 0.00 62.40 64.06 3k1w h SER 84 CO 0.60 -0.25 -0.15 0.35 -0.53 0.00 0.00 176.83 176.84 3k1w n THR 85 N -5.32 0.00 0.00 2.23 -2.24 -1.26 -4.96 114.28 102.73 3k1w n THR 85 Ca 0.05 -0.04 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3k1w n THR 85 Cb 0.31 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.43 3k1w n THR 85 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3k1w n GLY 86 N 1.35 2.65 3.72 3.38 0.00 -0.69 -4.88 105.19 110.71 3k1w n GLY 86 Ca 0.12 -1.06 -0.42 0.00 0.00 0.00 0.00 46.02 44.66 3k1w n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3k1w s THR 87 N -2.00 4.21 -0.24 2.61 2.01 -1.26 -3.10 115.64 117.87 3k1w s THR 87 Ca 0.00 1.66 -0.14 0.00 0.31 0.00 0.00 61.69 63.52 3k1w s THR 87 Cb 0.00 -4.06 -0.04 0.00 0.01 0.00 0.00 72.50 68.41 3k1w s THR 87 CO 0.00 0.17 0.33 -0.69 -0.69 0.00 0.00 174.62 173.74 3k1w s VAL 88 N 0.71 5.23 0.07 3.82 1.01 -0.06 -4.09 120.40 127.09 3k1w s VAL 88 Ca 0.55 0.53 0.07 0.00 0.00 0.00 0.00 61.98 63.12 3k1w s VAL 88 Cb -0.27 -3.66 -0.03 0.00 0.00 0.00 0.00 36.38 32.42 3k1w s VAL 88 CO 0.30 0.24 -0.19 -0.55 0.00 0.00 0.00 175.10 174.90 3k1w s SER 89 N 1.28 2.26 0.00 3.32 0.15 0.25 -0.68 113.70 120.28 3k1w s SER 89 Ca 0.15 -0.60 0.00 0.00 0.70 0.00 0.00 55.95 56.19 3k1w s SER 89 Cb -0.15 -0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 3k1w s SER 89 CO 0.08 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.19 3k1w n GLY 90 N 1.41 1.26 3.11 9.45 0.00 -0.83 -0.94 105.19 118.65 3k1w n GLY 90 Ca -0.19 -0.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 3k1w n GLY 90 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3k1w s PHE 91 N -3.25 0.68 0.12 1.61 -0.12 -0.57 0.14 117.98 116.59 3k1w s PHE 91 Ca 0.00 -0.88 -0.26 0.00 -0.05 0.00 0.00 56.93 55.74 3k1w s PHE 91 Cb 0.00 -0.43 -0.07 0.00 -0.63 0.00 0.00 43.02 41.89 3k1w s PHE 91 CO 0.00 -0.22 0.80 -1.17 -0.05 0.00 0.00 175.22 174.58 3k1w s LEU 92 N -2.67 4.53 0.20 -1.99 2.96 0.93 -0.63 118.68 122.01 3k1w s LEU 92 Ca 0.05 1.60 0.01 0.00 -0.22 0.00 0.00 54.13 55.57 3k1w s LEU 92 Cb 0.03 -3.32 -0.05 0.00 0.50 0.00 0.00 46.19 43.35 3k1w s LEU 92 CO -0.06 0.10 0.05 -0.44 -1.32 0.00 0.00 176.35 174.69 3k1w s SER 93 N -0.58 0.97 -0.06 3.68 0.01 -0.22 -0.26 113.70 117.24 3k1w s SER 93 Ca 0.38 -1.27 0.04 0.00 1.31 0.00 0.00 55.95 56.41 3k1w s SER 93 Cb -0.22 0.18 -0.00 0.00 0.21 0.00 0.00 66.02 66.19 3k1w s SER 93 CO 0.26 -0.67 -0.18 -1.58 0.41 0.00 0.00 173.24 171.48 3k1w s GLN 94 N -4.00 2.00 0.32 12.44 0.74 -0.93 -1.03 119.66 129.20 3k1w s GLN 94 Ca 0.30 -0.63 -0.19 0.00 0.05 0.00 0.00 55.36 54.89 3k1w s GLN 94 Cb 0.07 -1.67 0.04 0.00 1.10 0.00 0.00 33.01 32.55 3k1w s GLN 94 CO 0.08 0.20 0.77 0.34 -0.55 0.00 0.00 175.29 176.13 3k1w s ASP 95 N 0.19 -0.13 -0.13 6.67 -1.08 -0.98 -0.94 116.67 120.27 3k1w s ASP 95 Ca -0.08 -0.85 -0.28 0.00 -0.52 0.00 0.00 52.55 50.82 3k1w s ASP 95 Cb -0.13 0.77 -0.01 0.00 -1.46 0.00 0.00 42.92 42.08 3k1w s ASP 95 CO 0.04 -1.48 0.94 -0.63 0.52 0.00 0.00 175.17 174.55 3k1w s ILE 96 N -3.10 4.83 -0.11 4.11 1.01 -1.26 -1.30 121.20 125.37 3k1w s ILE 96 Ca 0.13 1.88 -0.01 0.00 0.00 0.00 0.00 60.65 62.65 3k1w s ILE 96 Cb -0.05 -4.24 -0.03 0.00 0.01 0.00 0.00 42.46 38.14 3k1w s ILE 96 CO 0.09 0.02 -0.05 -0.63 0.00 0.00 0.00 174.94 174.36 3k1w s ILE 97 N 2.02 3.79 -0.21 2.92 1.01 0.70 -0.58 121.20 130.86 3k1w s ILE 97 Ca 0.44 -0.42 -0.06 0.00 0.00 0.00 0.00 60.65 60.62 3k1w s ILE 97 Cb -0.18 -2.61 -0.03 0.00 0.01 0.00 0.00 42.46 39.66 3k1w s ILE 97 CO 0.16 0.55 0.02 -0.89 0.00 0.00 0.00 174.94 174.78 3k1w s THR 98 N -0.24 4.07 -0.09 2.92 2.01 -0.21 -0.45 115.64 123.65 3k1w s THR 98 Ca 0.04 -0.27 -0.02 0.00 0.31 0.00 0.00 61.69 61.75 3k1w s THR 98 Cb -0.13 -2.86 0.04 0.00 0.01 0.00 0.00 72.50 69.56 3k1w s THR 98 CO 0.02 0.41 0.02 -0.69 -0.69 0.00 0.00 174.62 173.70 3k1w s VAL 99 N 1.08 0.29 -1.31 3.82 1.01 -0.12 -1.84 120.40 123.33 3k1w s VAL 99 Ca 0.03 0.04 -0.07 0.00 0.00 0.00 0.00 61.98 61.98 3k1w s VAL 99 Cb -0.14 -0.56 0.04 0.00 0.00 0.00 0.00 36.38 35.72 3k1w s VAL 99 CO 0.02 0.13 0.43 0.61 0.00 0.00 0.00 175.10 176.28 3k1w n GLY 100 N 5.17 -0.50 2.62 4.51 0.00 -1.26 -0.91 105.19 114.81 3k1w n GLY 100 Ca -0.07 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.04 3k1w n GLY 100 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k1w n GLY 101 N -1.19 2.64 3.73 -0.02 0.00 -1.26 -4.50 105.19 104.59 3k1w n GLY 101 Ca -0.06 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.55 3k1w n GLY 101 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k1w s ILE 102 N -2.23 4.42 -0.14 -0.61 1.01 -0.09 -5.04 121.20 118.52 3k1w s ILE 102 Ca 0.00 2.04 -0.05 0.00 0.00 0.00 0.00 60.65 62.64 3k1w s ILE 102 Cb 0.00 -4.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.13 3k1w s ILE 102 CO 0.00 0.33 0.03 0.42 0.00 0.00 0.00 174.94 175.72 3k1w s THR 103 N -0.12 4.55 -0.03 2.92 -4.23 -1.26 -0.95 115.64 116.51 3k1w s THR 103 Ca 0.47 -0.13 0.01 0.00 -1.18 0.00 0.00 61.69 60.86 3k1w s THR 103 Cb -0.24 -3.00 0.01 0.00 1.34 0.00 0.00 72.50 70.62 3k1w s THR 103 CO 0.30 0.52 -0.06 -0.69 -0.54 0.00 0.00 174.62 174.16 3k1w s VAL 104 N -0.10 0.56 -0.38 2.29 1.01 0.41 -4.96 120.40 119.23 3k1w s VAL 104 Ca 0.05 -0.19 -0.28 0.00 0.00 0.00 0.00 61.98 61.57 3k1w s VAL 104 Cb -0.12 -0.55 0.02 0.00 0.00 0.00 0.00 36.38 35.72 3k1w s VAL 104 CO 0.02 0.21 1.03 -0.89 0.00 0.00 0.00 175.10 175.46 3k1w s THR 105 N 0.59 4.47 -0.00 3.92 2.01 -1.26 -0.21 115.64 125.15 3k1w s THR 105 Ca -0.08 1.38 0.03 0.00 0.31 0.00 0.00 61.69 63.33 3k1w s THR 105 Cb -0.11 -4.43 -0.01 0.00 0.01 0.00 0.00 72.50 67.96 3k1w s THR 105 CO 0.00 -0.63 -0.09 -1.58 -0.69 0.00 0.00 174.62 171.63 3k1w s GLN 106 N 3.77 0.72 0.04 4.92 2.00 -0.42 -4.97 119.66 125.70 3k1w s GLN 106 Ca 0.43 -0.33 -0.23 0.00 -2.00 0.00 0.00 55.36 53.22 3k1w s GLN 106 Cb -0.11 -0.69 -0.06 0.00 0.80 0.00 0.00 33.01 32.96 3k1w s GLN 106 CO 0.21 0.19 0.71 -1.64 -0.50 0.00 0.00 175.29 174.25 3k1w s MET 107 N -0.25 4.44 0.12 1.67 -1.94 -1.26 -2.33 119.30 119.75 3k1w s MET 107 Ca 0.03 0.96 -0.10 0.00 -1.71 0.00 0.00 55.69 54.88 3k1w s MET 107 Cb -0.04 -3.35 -0.00 0.00 2.01 0.00 0.00 34.83 33.45 3k1w s MET 107 CO -0.00 0.33 0.25 -0.59 -0.01 0.00 0.00 175.02 175.00 3k1w s PHE 108 N -0.17 0.20 -0.16 -0.03 -0.71 -0.20 -4.65 117.98 112.27 3k1w s PHE 108 Ca 0.36 -0.60 -0.15 0.00 -1.04 0.00 0.00 56.93 55.50 3k1w s PHE 108 Cb -0.20 -0.02 -0.04 0.00 -1.21 0.00 0.00 43.02 41.55 3k1w s PHE 108 CO 0.21 -0.63 0.34 0.20 -1.34 0.00 0.00 175.22 174.01 3k1w s GLY 109 N -2.89 2.24 -0.30 1.99 0.00 0.68 -1.05 107.32 107.98 3k1w s GLY 109 Ca 0.09 -0.40 -0.15 0.00 0.00 0.00 0.00 44.72 44.26 3k1w s GLY 109 CO -0.07 0.55 0.38 -0.54 0.00 0.00 0.00 173.10 173.41 3k1w s GLU 110 N 0.59 3.85 0.01 2.90 2.02 0.20 -1.44 118.70 126.83 3k1w s GLU 110 Ca 0.19 -0.11 -0.28 0.00 0.02 0.00 0.00 54.97 54.78 3k1w s GLU 110 Cb -0.14 -3.71 -0.04 0.00 0.10 0.00 0.00 34.13 30.35 3k1w s GLU 110 CO 0.06 -0.38 0.90 0.08 0.02 0.00 0.00 175.26 175.94 3k1w s VAL 111 N 2.08 4.84 -0.07 2.63 1.01 0.33 -1.51 120.40 129.70 3k1w s VAL 111 Ca 0.14 1.89 0.02 0.00 0.00 0.00 0.00 61.98 64.03 3k1w s VAL 111 Cb -0.16 -4.24 -0.02 0.00 0.00 0.00 0.00 36.38 31.96 3k1w s VAL 111 CO 0.11 0.22 0.07 0.35 0.00 0.00 0.00 175.10 175.85 3k1w n THR 112 N 3.60 0.00 -3.71 3.92 -2.24 -0.12 -0.54 114.28 115.20 3k1w n THR 112 Ca 0.03 -0.36 -0.11 0.00 -2.27 0.00 0.00 64.05 61.34 3k1w n THR 112 Cb 0.51 0.87 -0.11 0.00 -2.10 0.00 0.00 70.33 69.50 3k1w n THR 112 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 3k1w s GLU 113 N -1.41 0.41 -0.03 -0.78 2.02 -1.02 -3.81 118.70 114.08 3k1w s GLU 113 Ca 0.00 0.70 -0.27 0.00 0.02 0.00 0.00 54.97 55.42 3k1w s GLU 113 Cb 0.01 0.06 0.06 0.00 0.10 0.00 0.00 34.13 34.36 3k1w s GLU 113 CO 0.08 -0.12 0.59 0.00 0.02 0.00 0.00 175.26 175.83 3k1w s MET 114 N 0.99 0.99 0.59 1.61 0.23 -1.26 -0.58 119.30 121.87 3k1w s MET 114 Ca -0.06 0.11 -0.19 0.00 -1.03 0.00 0.00 55.69 54.52 3k1w s MET 114 Cb -0.07 0.46 -0.04 0.00 -1.53 0.00 0.00 34.83 33.66 3k1w s MET 114 CO -0.08 -0.31 1.19 -1.25 -2.03 0.00 0.00 175.02 172.54 3k1w s PRO 115 N -1.40 3.00 0.24 3.16 0.04 -1.26 -4.75 135.00 134.03 3k1w s PRO 115 Ca -0.11 1.78 -0.06 0.00 0.04 0.00 0.00 61.00 62.65 3k1w s PRO 115 Cb -0.01 -1.94 0.24 0.00 0.04 0.00 0.00 34.50 32.84 3k1w s PRO 115 CO 0.07 -1.17 1.83 0.00 0.04 0.00 0.00 177.00 177.77 3k1w h ALA 116 N 0.86 1.15 -3.23 8.56 0.00 -1.97 -3.33 119.26 121.31 3k1w h ALA 116 Ca -0.50 -0.16 -0.61 0.00 0.00 0.00 0.00 54.91 53.63 3k1w h ALA 116 Cb 1.29 -0.32 -0.15 0.00 0.00 0.00 0.00 17.79 18.61 3k1w h ALA 116 CO 0.55 0.64 -0.54 -0.51 0.00 0.00 0.00 179.25 179.39 3k1w s LEU 117 N -9.75 3.91 0.00 0.00 1.43 -1.26 -0.20 118.68 112.81 3k1w s LEU 117 Ca -0.12 0.10 0.24 0.00 -1.03 0.00 0.00 54.13 53.32 3k1w s LEU 117 Cb 0.16 -2.01 0.80 0.00 0.03 0.00 0.00 46.19 45.18 3k1w s LEU 117 CO 0.83 0.15 1.59 -0.81 0.23 0.00 0.00 176.35 178.34 3k1w n PRO 118 N 3.71 1.82 0.23 1.29 -0.04 -1.26 -4.74 135.00 136.00 3k1w n PRO 118 Ca -0.16 -1.21 0.10 0.00 -0.04 0.00 0.00 63.50 62.19 3k1w n PRO 118 Cb 0.52 -1.45 0.50 0.00 -0.04 0.00 0.00 33.50 33.03 3k1w n PRO 118 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 3k1w h PHE 119 N 2.67 0.00 0.00 0.54 0.04 -1.51 -2.76 116.94 115.93 3k1w h PHE 119 Ca 0.00 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.70 3k1w h PHE 119 Cb 0.58 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.72 3k1w h PHE 119 CO 0.06 0.21 -0.33 0.00 -0.60 0.00 0.00 178.31 177.65 3k1w h MET 120 N 0.00 0.00 -0.00 1.51 -0.00 -0.79 -2.73 114.93 112.92 3k1w h MET 120 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3k1w h MET 120 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.29 3k1w h MET 120 CO 0.03 0.33 -0.05 1.28 -0.00 0.00 0.00 176.91 178.50 3k1w n LEU 121 N -3.76 0.05 -4.73 -0.10 4.77 -1.04 -4.87 117.00 107.32 3k1w n LEU 121 Ca -0.01 0.44 -0.42 0.00 -0.03 0.00 0.00 56.01 55.99 3k1w n LEU 121 Cb 0.42 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 41.02 3k1w n LEU 121 CO 0.36 0.01 1.14 0.00 -1.33 0.00 0.00 177.39 177.58 3k1w s ALA 122 N -2.98 3.67 -0.16 -1.18 0.00 -1.03 -4.90 121.76 115.19 3k1w s ALA 122 Ca 0.15 1.33 0.25 0.00 0.00 0.00 0.00 51.96 53.69 3k1w s ALA 122 Cb 0.19 -3.58 0.68 0.00 0.00 0.00 0.00 23.12 20.41 3k1w s ALA 122 CO 0.54 -0.75 1.73 0.93 0.00 0.00 0.00 175.76 178.21 3k1w h GLU 123 N 5.68 0.00 -6.59 0.00 4.39 -1.90 -3.45 114.58 112.71 3k1w h GLU 123 Ca -0.45 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 58.79 3k1w h GLU 123 Cb 1.21 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.88 3k1w h GLU 123 CO 0.82 0.10 -0.16 -0.59 -1.16 0.00 0.00 179.01 178.03 3k1w s PHE 124 N -3.37 3.31 -0.07 4.33 -0.71 -1.26 -4.98 117.98 115.22 3k1w s PHE 124 Ca 0.04 0.22 0.22 0.00 -1.04 0.00 0.00 56.93 56.37 3k1w s PHE 124 Cb 0.07 -2.13 -0.28 0.00 -1.21 0.00 0.00 43.02 39.48 3k1w s PHE 124 CO 0.64 -0.15 0.56 -0.25 -1.34 0.00 0.00 175.22 174.68 3k1w n ASP 125 N -1.92 0.16 -1.92 1.98 8.00 0.11 -5.00 116.55 117.97 3k1w n ASP 125 Ca -0.01 0.06 -0.02 0.00 0.71 0.00 0.00 54.79 55.53 3k1w n ASP 125 Cb 0.57 1.65 0.01 0.00 -0.02 0.00 0.00 41.12 43.34 3k1w n ASP 125 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k1w n GLY 126 N 1.28 1.19 2.91 0.44 0.00 -0.56 -4.08 105.19 106.37 3k1w n GLY 126 Ca -0.05 -1.05 -0.16 0.00 0.00 0.00 0.00 46.02 44.75 3k1w n GLY 126 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k1w s VAL 127 N -2.44 0.33 -0.32 1.61 1.01 -0.37 -2.09 120.40 118.13 3k1w s VAL 127 Ca 0.09 -0.11 -0.02 0.00 0.00 0.00 0.00 61.98 61.94 3k1w s VAL 127 Cb -0.02 -0.33 0.06 0.00 0.00 0.00 0.00 36.38 36.10 3k1w s VAL 127 CO 0.03 0.13 0.04 -0.69 0.00 0.00 0.00 175.10 174.61 3k1w s VAL 128 N 0.33 3.00 0.00 2.92 1.01 0.24 -0.94 120.40 126.97 3k1w s VAL 128 Ca -0.03 -1.55 -0.30 0.00 0.00 0.00 0.00 61.98 60.09 3k1w s VAL 128 Cb -0.07 -2.81 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 3k1w s VAL 128 CO -0.00 -0.23 1.16 -0.83 0.00 0.00 0.00 175.10 175.19 3k1w s GLY 129 N 1.34 2.37 -0.08 4.51 0.00 0.25 -1.22 107.32 114.48 3k1w s GLY 129 Ca -0.02 0.71 0.14 0.00 0.00 0.00 0.00 44.72 45.54 3k1w s GLY 129 CO -0.02 2.05 1.35 1.03 0.00 0.00 0.00 173.10 177.51 3k1w n MET 130 N 4.42 2.97 -0.22 2.90 2.81 0.20 -4.49 117.12 125.72 3k1w n MET 130 Ca 0.09 -2.42 -0.02 0.00 -1.81 0.00 0.00 57.70 53.54 3k1w n MET 130 Cb 0.47 -1.54 0.01 0.00 -0.71 0.00 0.00 33.22 31.46 3k1w n MET 130 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 3k1w n GLY 131 N 0.18 -0.91 3.94 3.03 0.00 0.44 -4.75 105.19 107.12 3k1w n GLY 131 Ca 0.16 -1.71 -0.25 0.00 0.00 0.00 0.00 46.02 44.23 3k1w n GLY 131 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k1w s PHE 132 N -1.05 3.50 0.55 1.61 0.40 -1.26 -4.76 117.98 116.96 3k1w s PHE 132 Ca 0.05 0.39 0.24 0.00 -0.60 0.00 0.00 56.93 57.00 3k1w s PHE 132 Cb -0.00 -1.92 1.48 0.00 0.51 0.00 0.00 43.02 43.09 3k1w s PHE 132 CO 0.04 0.15 2.11 0.97 0.70 0.00 0.00 175.22 179.19 3k1w h ILE 133 N 0.89 0.73 -0.66 0.64 2.10 -1.90 -2.21 117.51 117.09 3k1w h ILE 133 Ca -0.49 0.00 0.19 0.00 1.08 0.00 0.00 64.86 65.64 3k1w h ILE 133 Cb 1.21 0.89 -0.03 0.00 -1.09 0.00 0.00 36.82 37.81 3k1w h ILE 133 CO 0.62 0.00 0.49 -0.33 -1.08 0.00 0.00 178.15 177.85 3k1w h GLU 134 N 0.00 0.00 -0.29 2.19 3.07 -1.94 -1.00 114.58 116.62 3k1w h GLU 134 Ca 0.09 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.95 3k1w h GLU 134 Cb 0.39 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.30 3k1w h GLU 134 CO -0.00 0.00 0.00 1.04 -1.40 0.00 0.00 179.01 178.65 3k1w n GLN 135 N -4.29 2.41 -2.43 2.33 6.02 -0.83 -4.98 117.38 115.61 3k1w n GLN 135 Ca 0.13 -1.88 -0.42 0.00 -0.01 0.00 0.00 57.00 54.81 3k1w n GLN 135 Cb 0.75 -1.26 -0.03 0.00 1.02 0.00 0.00 30.24 30.71 3k1w n GLN 135 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3k1w s ALA 136 N -0.99 3.42 0.19 -1.58 0.00 -0.38 -4.52 121.76 117.91 3k1w s ALA 136 Ca 0.22 0.78 -0.30 0.00 0.00 0.00 0.00 51.96 52.65 3k1w s ALA 136 Cb 0.12 -3.47 -0.08 0.00 0.00 0.00 0.00 23.12 19.69 3k1w s ALA 136 CO 0.16 -0.54 1.12 0.96 0.00 0.00 0.00 175.76 177.45 3k1w s ILE 137 N 1.45 3.76 0.00 0.00 -4.36 -1.26 -1.60 121.20 119.19 3k1w s ILE 137 Ca 0.58 1.55 0.00 0.00 -0.26 0.00 0.00 60.65 62.51 3k1w s ILE 137 Cb -0.28 -3.99 0.00 0.00 1.25 0.00 0.00 42.46 39.45 3k1w s ILE 137 CO 0.27 0.28 0.00 0.61 0.24 0.00 0.00 174.94 176.34 3k1w n GLY 138 N 1.94 0.33 2.33 6.27 0.00 -1.26 -3.86 105.19 110.94 3k1w n GLY 138 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.91 3k1w n GLY 138 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3k1w n ARG 139 N -1.63 -1.92 -2.61 1.61 3.00 -0.63 -4.95 116.66 109.53 3k1w n ARG 139 Ca 0.00 0.69 -0.34 0.00 -0.00 0.00 0.00 57.85 58.20 3k1w n ARG 139 Cb 0.17 -5.21 -0.04 0.00 0.00 0.00 0.00 32.46 27.38 3k1w n ARG 139 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.63 177.77 3k1w s VAL 140 N -2.53 3.93 -0.08 5.15 -7.23 -1.25 -4.95 120.40 113.44 3k1w s VAL 140 Ca 0.00 1.24 -0.30 0.00 -1.81 0.00 0.00 61.98 61.12 3k1w s VAL 140 Cb 0.00 -3.53 -0.04 0.00 0.56 0.00 0.00 36.38 33.37 3k1w s VAL 140 CO 0.00 -0.22 1.54 -0.89 -0.31 0.00 0.00 175.10 175.22 3k1w s THR 141 N -1.98 3.77 0.79 5.32 2.01 -1.26 -4.80 115.64 119.49 3k1w s THR 141 Ca 0.64 0.95 -0.13 0.00 0.31 0.00 0.00 61.69 63.46 3k1w s THR 141 Cb -0.15 -3.61 0.07 0.00 0.01 0.00 0.00 72.50 68.82 3k1w s THR 141 CO 0.19 -0.08 1.17 -2.84 -0.69 0.00 0.00 174.62 172.37 3k1w s PRO 142 N 3.78 1.82 0.28 4.92 0.02 -1.26 -4.69 135.00 139.87 3k1w s PRO 142 Ca 0.68 1.60 -0.03 0.00 0.02 0.00 0.00 61.00 63.27 3k1w s PRO 142 Cb -0.30 -1.81 0.38 0.00 0.02 0.00 0.00 34.50 32.79 3k1w s PRO 142 CO 0.25 -2.04 1.95 0.97 -0.33 0.00 0.00 177.00 177.80 3k1w h ILE 143 N -0.89 1.23 -0.40 2.83 2.10 -1.85 -2.26 117.51 118.26 3k1w h ILE 143 Ca -0.46 -0.44 -0.09 0.00 1.08 0.00 0.00 64.86 64.95 3k1w h ILE 143 Cb 1.28 -0.03 -0.02 0.00 -1.09 0.00 0.00 36.82 36.95 3k1w h ILE 143 CO 0.47 0.23 -0.13 0.15 -1.08 0.00 0.00 178.15 177.79 3k1w h PHE 144 N 1.18 0.81 -0.85 2.19 3.57 -1.92 -1.16 116.94 120.77 3k1w h PHE 144 Ca 0.32 -0.15 0.01 0.00 3.53 0.00 0.00 57.97 61.68 3k1w h PHE 144 Cb -0.11 -0.21 -0.04 0.00 2.79 0.00 0.00 35.95 38.38 3k1w h PHE 144 CO 0.00 0.83 0.56 -0.44 -2.23 0.00 0.00 178.31 177.03 3k1w h ASP 145 N 0.66 0.96 -0.09 0.41 5.19 -1.79 0.24 116.42 122.01 3k1w h ASP 145 Ca 0.11 -0.02 -0.08 0.00 -0.62 0.00 0.00 57.03 56.42 3k1w h ASP 145 Cb 0.60 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.86 3k1w h ASP 145 CO 0.04 0.70 -0.17 0.78 -3.12 0.00 0.00 179.24 177.47 3k1w h ASN 146 N 1.14 0.44 -0.33 6.45 2.35 -0.87 -1.78 115.58 122.99 3k1w h ASN 146 Ca 0.31 -0.12 -0.15 0.00 -0.55 0.00 0.00 56.30 55.79 3k1w h ASN 146 Cb -0.12 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 38.13 3k1w h ASN 146 CO -0.07 0.63 -0.38 0.40 -1.65 0.00 0.00 177.43 176.36 3k1w h ILE 147 N 0.42 1.28 -1.01 2.81 2.04 -0.63 -3.02 117.51 119.40 3k1w h ILE 147 Ca 0.07 -1.56 0.10 0.00 1.00 0.00 0.00 64.86 64.47 3k1w h ILE 147 Cb 0.53 1.52 -0.08 0.00 -0.74 0.00 0.00 36.82 38.05 3k1w h ILE 147 CO 0.03 0.51 0.64 0.40 0.00 0.00 0.00 178.15 179.73 3k1w h ILE 148 N 0.62 0.98 0.00 -0.67 2.04 -0.27 -2.14 117.51 118.07 3k1w h ILE 148 Ca 0.04 -0.36 -0.01 0.00 1.00 0.00 0.00 64.86 65.53 3k1w h ILE 148 Cb 0.97 -0.18 -0.00 0.00 -0.74 0.00 0.00 36.82 36.88 3k1w h ILE 148 CO 0.09 0.19 -0.02 0.77 0.00 0.00 0.00 178.15 179.18 3k1w h SER 149 N 1.06 0.00 1.14 1.72 4.64 -1.21 -2.37 113.55 118.54 3k1w h SER 149 Ca 0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.80 3k1w h SER 149 Cb 0.37 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.46 3k1w h SER 149 CO -0.23 0.02 0.00 1.56 -0.87 0.00 0.00 176.83 177.31 3k1w h GLN 150 N 0.00 0.00 -4.31 4.77 4.20 -1.27 -3.47 115.11 115.02 3k1w h GLN 150 Ca -0.00 0.00 -0.37 0.00 0.06 0.00 0.00 58.65 58.34 3k1w h GLN 150 Cb 0.61 0.00 0.07 0.00 0.30 0.00 0.00 27.48 28.46 3k1w h GLN 150 CO 0.00 0.00 -0.57 0.41 -0.67 0.00 0.00 178.83 178.01 3k1w n GLY 151 N 0.38 -0.42 0.10 3.46 0.00 -0.89 -4.92 105.19 102.90 3k1w n GLY 151 Ca 0.02 0.07 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 3k1w n GLY 151 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3k1w n VAL 152 N -4.48 1.46 -2.72 1.61 0.24 -1.26 -4.84 118.33 108.35 3k1w n VAL 152 Ca -0.09 -0.81 -0.37 0.00 -2.04 0.00 0.00 64.34 61.03 3k1w n VAL 152 Cb 0.60 -0.73 -0.06 0.00 -1.47 0.00 0.00 33.84 32.18 3k1w n VAL 152 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 3k1w s LEU 153 N -5.78 4.29 0.21 1.34 1.43 -1.26 -4.42 118.68 114.49 3k1w s LEU 153 Ca -0.12 1.89 -0.09 0.00 -1.03 0.00 0.00 54.13 54.78 3k1w s LEU 153 Cb 0.07 -4.06 0.32 0.00 0.03 0.00 0.00 46.19 42.55 3k1w s LEU 153 CO 0.80 -0.17 1.71 0.50 0.23 0.00 0.00 176.35 179.42 3k1w h LYS 154 N 3.00 0.28 -3.91 1.70 3.64 -0.76 -3.45 116.57 117.08 3k1w h LYS 154 Ca -0.47 -0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 58.79 3k1w h LYS 154 Cb 1.20 -0.06 -0.14 0.00 -0.41 0.00 0.00 32.23 32.82 3k1w h LYS 154 CO 0.64 0.18 -0.40 -1.83 -2.27 0.00 0.00 179.45 175.78 3k1w s GLU 155 N -6.10 0.94 -1.49 1.90 -1.05 -1.11 -4.92 118.70 106.88 3k1w s GLU 155 Ca -0.13 -1.09 -0.10 0.00 -0.15 0.00 0.00 54.97 53.50 3k1w s GLU 155 Cb 0.18 0.34 0.01 0.00 -0.44 0.00 0.00 34.13 34.22 3k1w s GLU 155 CO 0.74 -0.31 2.56 -0.25 0.95 0.00 0.00 175.26 178.95 3k1w n ASP 156 N -0.11 7.10 -4.08 0.83 8.00 -1.26 -4.18 116.55 122.85 3k1w n ASP 156 Ca -0.12 -2.81 -0.07 0.00 0.71 0.00 0.00 54.79 52.50 3k1w n ASP 156 Cb 0.63 -1.53 -0.10 0.00 -0.02 0.00 0.00 41.12 40.09 3k1w n ASP 156 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 3k1w s VAL 157 N 1.54 0.21 0.04 2.53 -7.23 -1.26 -1.21 120.40 115.02 3k1w s VAL 157 Ca 0.58 -1.75 -0.02 0.00 -1.81 0.00 0.00 61.98 58.98 3k1w s VAL 157 Cb 0.16 -1.47 -0.03 0.00 0.56 0.00 0.00 36.38 35.60 3k1w s VAL 157 CO -0.07 -0.97 0.00 0.72 -0.31 0.00 0.00 175.10 174.48 3k1w s PHE 158 N -3.84 0.37 0.06 2.82 -0.12 -0.40 -0.34 117.98 116.54 3k1w s PHE 158 Ca 0.06 -0.79 -0.00 0.00 -0.05 0.00 0.00 56.93 56.15 3k1w s PHE 158 Cb 0.07 -0.27 -0.04 0.00 -0.63 0.00 0.00 43.02 42.15 3k1w s PHE 158 CO -0.10 -0.33 -0.04 -1.54 -0.05 0.00 0.00 175.22 173.16 3k1w s SER 159 N -2.36 0.63 -0.08 1.98 1.04 -0.26 0.04 113.70 114.68 3k1w s SER 159 Ca -0.02 -1.00 0.03 0.00 0.48 0.00 0.00 55.95 55.44 3k1w s SER 159 Cb 0.01 0.18 0.01 0.00 0.10 0.00 0.00 66.02 66.32 3k1w s SER 159 CO -0.07 -0.57 -0.15 -0.36 0.98 0.00 0.00 173.24 173.07 3k1w s PHE 160 N -3.84 1.78 -0.19 5.02 0.40 0.50 -1.51 117.98 120.13 3k1w s PHE 160 Ca 0.08 -0.71 -0.03 0.00 -0.60 0.00 0.00 56.93 55.67 3k1w s PHE 160 Cb 0.07 -1.26 -0.01 0.00 0.51 0.00 0.00 43.02 42.33 3k1w s PHE 160 CO -0.09 -0.34 -0.06 -0.47 0.70 0.00 0.00 175.22 174.96 3k1w s TYR 161 N 0.65 2.94 -0.16 0.36 5.04 0.63 -1.86 117.35 124.94 3k1w s TYR 161 Ca -0.14 -0.76 0.00 0.00 -2.44 0.00 0.00 57.07 53.73 3k1w s TYR 161 Cb -0.16 -2.03 0.00 0.00 0.35 0.00 0.00 41.96 40.12 3k1w s TYR 161 CO 0.04 -0.39 -0.16 0.71 -1.34 0.00 0.00 175.55 174.41 3k1w s TYR 162 N 1.06 2.78 0.51 4.97 2.02 -1.26 -0.62 117.35 126.81 3k1w s TYR 162 Ca 0.01 -1.18 -0.06 0.00 -0.37 0.00 0.00 57.07 55.46 3k1w s TYR 162 Cb -0.15 -1.91 -0.03 0.00 -0.40 0.00 0.00 41.96 39.47 3k1w s TYR 162 CO -0.00 -0.56 0.83 1.21 -1.57 0.00 0.00 175.55 175.46 3k1w s ASN 163 N 0.97 6.23 0.48 2.29 3.04 -0.34 -4.23 114.94 123.37 3k1w s ASN 163 Ca -0.03 1.00 -0.22 0.00 0.04 0.00 0.00 52.86 53.65 3k1w s ASN 163 Cb -0.15 -2.26 -0.07 0.00 -1.54 0.00 0.00 41.25 37.23 3k1w s ASN 163 CO -0.03 -0.65 1.17 -0.13 -3.04 0.00 0.00 177.10 174.42 3k1w s ARG 164 N -4.83 3.63 0.16 0.43 0.52 -1.26 -4.93 118.95 112.67 3k1w s ARG 164 Ca 0.49 1.77 -0.32 0.00 -0.52 0.00 0.00 55.73 57.16 3k1w s ARG 164 Cb -0.10 -2.32 -0.10 0.00 0.52 0.00 0.00 34.95 32.95 3k1w s ARG 164 CO 0.46 -0.66 1.64 0.34 0.02 0.00 0.00 175.30 177.10 3k1w s ASP 165 N -1.41 6.52 0.00 0.23 2.15 -1.26 -4.99 116.67 117.91 3k1w s ASP 165 Ca 0.66 2.68 0.00 0.00 0.43 0.00 0.00 52.55 56.32 3k1w s ASP 165 Cb -0.28 -2.59 0.00 0.00 -0.30 0.00 0.00 42.92 39.75 3k1w s ASP 165 CO 0.34 -0.88 0.00 -0.24 -0.17 0.00 0.00 175.17 174.22 3k1w n SER 166 N 4.31 0.00 0.00 -0.34 2.88 -1.26 -5.08 113.62 114.13 3k1w n SER 166 Ca 0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 3k1w n SER 166 Cb 0.38 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 3k1w n SER 166 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 3k1w n SER 171 N 0.00 0.00 -4.72 -3.46 2.88 -1.26 -5.15 113.62 101.92 3k1w n SER 171 Ca 0.00 0.00 -0.42 0.00 -1.33 0.00 0.00 58.87 57.12 3k1w n SER 171 Cb 0.00 0.00 -0.03 0.00 -0.75 0.00 0.00 64.21 63.43 3k1w n SER 171 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 3k1w s LEU 172 N 0.00 4.37 0.40 2.46 2.96 -1.26 -4.92 118.68 122.69 3k1w s LEU 172 Ca 0.00 2.41 0.08 0.00 -0.22 0.00 0.00 54.13 56.40 3k1w s LEU 172 Cb 0.00 -3.59 0.83 0.00 0.50 0.00 0.00 46.19 43.93 3k1w s LEU 172 CO 0.00 -0.71 1.98 1.23 -1.32 0.00 0.00 176.35 177.54 3k1w h GLY 173 N 6.85 0.40 0.00 7.98 0.00 -1.87 -3.41 103.07 113.02 3k1w h GLY 173 Ca -0.42 -0.19 0.00 0.00 0.00 0.00 0.00 47.33 46.71 3k1w h GLY 173 CO 0.88 0.19 0.00 0.61 0.00 0.00 0.00 176.54 178.22 3k1w n GLY 174 N -1.16 -1.38 3.63 4.60 0.00 -0.82 -1.20 105.19 108.85 3k1w n GLY 174 Ca 0.01 -1.05 -0.10 0.00 0.00 0.00 0.00 46.02 44.88 3k1w n GLY 174 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3k1w s GLN 175 N -1.89 0.76 -0.15 1.61 0.74 0.21 -0.94 119.66 119.99 3k1w s GLN 175 Ca 0.00 1.13 -0.03 0.00 0.05 0.00 0.00 55.36 56.51 3k1w s GLN 175 Cb 0.00 0.25 -0.02 0.00 1.10 0.00 0.00 33.01 34.34 3k1w s GLN 175 CO 0.00 -0.13 -0.07 -1.50 -0.55 0.00 0.00 175.29 173.04 3k1w s ILE 176 N 1.11 3.59 -0.20 -2.34 2.07 -0.40 -0.27 121.20 124.76 3k1w s ILE 176 Ca -0.06 -0.46 -0.07 0.00 -1.41 0.00 0.00 60.65 58.65 3k1w s ILE 176 Cb -0.05 -2.56 -0.03 0.00 0.13 0.00 0.00 42.46 39.95 3k1w s ILE 176 CO -0.11 0.50 0.05 -0.69 -1.91 0.00 0.00 174.94 172.77 3k1w s VAL 177 N 0.46 4.46 -0.26 4.00 1.01 -0.57 -0.52 120.40 128.98 3k1w s VAL 177 Ca -0.05 -0.14 -0.13 0.00 0.00 0.00 0.00 61.98 61.66 3k1w s VAL 177 Cb -0.15 -3.03 -0.04 0.00 0.00 0.00 0.00 36.38 33.16 3k1w s VAL 177 CO 0.03 0.43 0.28 -0.76 0.00 0.00 0.00 175.10 175.08 3k1w s LEU 178 N 0.77 4.06 0.00 3.92 1.43 0.21 -1.11 118.68 127.97 3k1w s LEU 178 Ca 0.02 0.19 0.00 0.00 -1.03 0.00 0.00 54.13 53.32 3k1w s LEU 178 Cb -0.14 -2.28 0.00 0.00 0.03 0.00 0.00 46.19 43.81 3k1w s LEU 178 CO 0.02 -0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.14 3k1w n GLY 179 N 4.61 0.47 0.00 -3.19 0.00 0.54 -1.22 105.19 106.40 3k1w n GLY 179 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.91 3k1w n GLY 179 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k1w n GLY 180 N -1.84 -0.66 3.18 -0.02 0.00 -1.23 -2.77 105.19 101.85 3k1w n GLY 180 Ca 0.00 -0.49 -0.13 0.00 0.00 0.00 0.00 46.02 45.39 3k1w n GLY 180 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k1w s SER 181 N -4.00 1.40 -0.36 1.61 0.01 -1.26 -3.71 113.70 107.38 3k1w s SER 181 Ca 0.00 -0.88 -0.07 0.00 1.31 0.00 0.00 55.95 56.31 3k1w s SER 181 Cb 0.00 0.03 0.05 0.00 0.21 0.00 0.00 66.02 66.31 3k1w s SER 181 CO 0.00 -0.32 0.16 -0.62 0.41 0.00 0.00 173.24 172.87 3k1w s ASP 182 N -2.66 5.44 0.14 2.44 -1.08 -1.26 -4.97 116.67 114.72 3k1w s ASP 182 Ca 0.08 -1.25 0.16 0.00 -0.52 0.00 0.00 52.55 51.02 3k1w s ASP 182 Cb -0.00 -1.91 0.73 0.00 -1.46 0.00 0.00 42.92 40.27 3k1w s ASP 182 CO -0.01 -0.39 1.50 -2.65 0.52 0.00 0.00 175.17 174.14 3k1w n PRO 183 N 4.85 0.09 0.31 4.34 -0.02 -1.26 -1.34 135.00 141.96 3k1w n PRO 183 Ca -0.11 0.41 0.19 0.00 -2.02 0.00 0.00 63.50 61.96 3k1w n PRO 183 Cb 0.44 -1.70 1.00 0.00 -0.02 0.00 0.00 33.50 33.22 3k1w n PRO 183 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3k1w h GLN 184 N 0.00 0.00 -0.13 -0.52 1.08 -1.99 -3.22 115.11 110.34 3k1w h GLN 184 Ca 0.00 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.20 3k1w h GLN 184 Cb 0.21 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.64 3k1w h GLN 184 CO 0.00 0.02 0.00 0.72 -0.95 0.00 0.00 178.83 178.62 3k1w n HIS 185 N -3.34 0.17 -4.10 2.96 8.25 -0.45 -4.82 115.22 113.89 3k1w n HIS 185 Ca -0.02 -0.39 -0.08 0.00 -0.26 0.00 0.00 57.72 56.96 3k1w n HIS 185 Cb 0.14 -0.03 -0.10 0.00 1.12 0.00 0.00 29.99 31.12 3k1w n HIS 185 CO 0.00 0.00 0.00 1.52 0.64 0.00 0.00 176.34 178.50 3k1w s TYR 186 N -0.88 0.66 0.25 4.41 1.13 -1.22 -1.01 117.35 120.70 3k1w s TYR 186 Ca 0.10 -1.11 0.08 0.00 -1.41 0.00 0.00 57.07 54.72 3k1w s TYR 186 Cb 0.05 -0.40 -0.05 0.00 -1.10 0.00 0.00 41.96 40.46 3k1w s TYR 186 CO 0.07 -0.46 -0.11 -1.83 -2.51 0.00 0.00 175.55 170.71 3k1w s GLU 187 N -3.98 1.48 3.53 -3.49 -1.05 -0.06 -4.71 118.70 110.43 3k1w s GLU 187 Ca 0.15 -1.71 0.00 0.00 -0.15 0.00 0.00 54.97 53.27 3k1w s GLU 187 Cb 0.07 -1.23 0.00 0.00 -0.44 0.00 0.00 34.13 32.54 3k1w s GLU 187 CO -0.04 0.14 0.00 0.41 0.95 0.00 0.00 175.26 176.71 3k1w n GLY 188 N -0.51 0.62 3.39 -3.83 0.00 -1.26 -3.85 105.19 99.74 3k1w n GLY 188 Ca -0.06 -0.78 -0.29 0.00 0.00 0.00 0.00 46.02 44.89 3k1w n GLY 188 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3k1w s ASN 189 N -4.00 3.32 0.30 1.61 0.01 -1.26 -5.00 114.94 109.93 3k1w s ASN 189 Ca 0.00 -0.73 -0.29 0.00 -0.71 0.00 0.00 52.86 51.13 3k1w s ASN 189 Cb 0.00 -0.23 -0.10 0.00 0.41 0.00 0.00 41.25 41.33 3k1w s ASN 189 CO 0.00 0.19 1.28 -0.36 -1.51 0.00 0.00 177.10 176.70 3k1w s PHE 190 N -1.04 3.15 0.06 2.20 0.08 -1.26 -4.64 117.98 116.52 3k1w s PHE 190 Ca 0.14 1.42 0.06 0.00 0.12 0.00 0.00 56.93 58.67 3k1w s PHE 190 Cb -0.10 -3.62 -0.04 0.00 -0.57 0.00 0.00 43.02 38.70 3k1w s PHE 190 CO 0.06 -1.69 -0.10 -1.58 -0.10 0.00 0.00 175.22 171.80 3k1w s HIS 191 N -0.95 2.75 0.11 0.36 5.65 -0.83 -4.93 115.29 117.46 3k1w s HIS 191 Ca 0.50 -0.14 0.10 0.00 0.25 0.00 0.00 55.06 55.77 3k1w s HIS 191 Cb -0.38 -1.50 -0.04 0.00 -1.18 0.00 0.00 32.58 29.48 3k1w s HIS 191 CO 0.49 0.37 -0.23 0.71 -0.65 0.00 0.00 174.74 175.43 3k1w s TYR 192 N -1.09 2.40 -0.07 3.88 2.02 -1.26 -0.72 117.35 122.50 3k1w s TYR 192 Ca 0.19 -0.34 0.04 0.00 -0.37 0.00 0.00 57.07 56.59 3k1w s TYR 192 Cb -0.11 -1.31 0.00 0.00 -0.40 0.00 0.00 41.96 40.15 3k1w s TYR 192 CO 0.10 0.33 -0.19 0.42 -1.57 0.00 0.00 175.55 174.64 3k1w s ILE 193 N -1.06 1.63 0.38 2.71 1.09 0.21 -4.89 121.20 121.28 3k1w s ILE 193 Ca 0.15 -0.78 -0.25 0.00 -1.10 0.00 0.00 60.65 58.67 3k1w s ILE 193 Cb -0.10 -1.43 -0.09 0.00 -1.06 0.00 0.00 42.46 39.78 3k1w s ILE 193 CO 0.07 0.46 1.10 0.20 -0.10 0.00 0.00 174.94 176.67 3k1w s ASN 194 N 0.36 6.74 0.41 3.58 0.02 -1.26 -0.92 114.94 123.86 3k1w s ASN 194 Ca -0.14 2.17 -0.26 0.00 -1.02 0.00 0.00 52.86 53.62 3k1w s ASN 194 Cb -0.16 -2.60 -0.09 0.00 0.02 0.00 0.00 41.25 38.42 3k1w s ASN 194 CO 0.06 -0.51 1.32 -0.76 0.02 0.00 0.00 177.10 177.23 3k1w s LEU 195 N -2.44 4.20 0.17 0.60 1.43 -0.43 -4.54 118.68 117.68 3k1w s LEU 195 Ca 0.56 2.70 -0.14 0.00 -1.03 0.00 0.00 54.13 56.21 3k1w s LEU 195 Cb -0.26 -3.90 0.13 0.00 0.03 0.00 0.00 46.19 42.18 3k1w s LEU 195 CO 0.33 -0.89 1.74 0.40 0.23 0.00 0.00 176.35 178.15 3k1w h ILE 196 N 2.46 0.81 -2.84 -0.59 2.04 -1.77 -3.44 117.51 114.18 3k1w h ILE 196 Ca -0.50 -0.09 -0.10 0.00 1.00 0.00 0.00 64.86 65.17 3k1w h ILE 196 Cb 1.25 0.52 -0.19 0.00 -0.74 0.00 0.00 36.82 37.66 3k1w h ILE 196 CO 0.62 0.05 -0.15 -1.59 0.00 0.00 0.00 178.15 177.08 3k1w s LYS 197 N -6.15 0.79 0.60 2.37 -2.85 -1.26 -5.13 119.74 108.11 3k1w s LYS 197 Ca -0.13 -0.15 -0.19 0.00 -1.00 0.00 0.00 55.97 54.50 3k1w s LYS 197 Cb 0.14 0.36 -0.04 0.00 -2.06 0.00 0.00 37.83 36.23 3k1w s LYS 197 CO 0.72 -0.24 1.12 -2.37 0.10 0.00 0.00 175.35 174.68 3k1w n THR 198 N 1.04 4.09 0.00 3.79 5.66 -1.26 -3.72 114.28 123.88 3k1w n THR 198 Ca -0.20 -0.50 0.00 0.00 -3.05 0.00 0.00 64.05 60.30 3k1w n THR 198 Cb 0.57 -1.32 0.00 0.00 -1.55 0.00 0.00 70.33 68.03 3k1w n THR 198 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3k1w n GLY 199 N 1.10 2.79 3.00 1.09 0.00 -1.26 -5.05 105.19 106.86 3k1w n GLY 199 Ca 0.14 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 3k1w n GLY 199 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k1w s VAL 200 N -2.49 -0.04 -1.23 1.61 1.01 -1.24 -4.25 120.40 113.77 3k1w s VAL 200 Ca 0.00 0.13 -0.16 0.00 0.00 0.00 0.00 61.98 61.95 3k1w s VAL 200 Cb 0.00 -0.30 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 3k1w s VAL 200 CO 0.00 0.05 2.18 0.79 0.00 0.00 0.00 175.10 178.13 3k1w n TRP 201 N 3.95 2.83 -4.16 5.22 7.02 -1.26 -4.78 117.44 126.26 3k1w n TRP 201 Ca -0.23 -2.58 -0.18 0.00 -1.02 0.00 0.00 57.50 53.50 3k1w n TRP 201 Cb 0.54 -2.25 -0.15 0.00 -2.42 0.00 0.00 31.31 27.03 3k1w n TRP 201 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 3k1w s GLN 202 N 3.69 0.58 0.25 -0.99 0.74 -1.26 -1.13 119.66 121.54 3k1w s GLN 202 Ca 0.52 -0.15 0.07 0.00 0.05 0.00 0.00 55.36 55.84 3k1w s GLN 202 Cb 0.14 -0.59 -0.05 0.00 1.10 0.00 0.00 33.01 33.61 3k1w s GLN 202 CO -0.02 0.04 -0.08 0.96 -0.55 0.00 0.00 175.29 175.63 3k1w s ILE 203 N 0.31 1.63 0.28 -2.34 -4.36 -0.18 -2.20 121.20 114.34 3k1w s ILE 203 Ca -0.04 -2.15 -0.29 0.00 -0.26 0.00 0.00 60.65 57.91 3k1w s ILE 203 Cb -0.07 -2.29 -0.10 0.00 1.25 0.00 0.00 42.46 41.24 3k1w s ILE 203 CO -0.00 -0.41 1.11 -1.10 0.24 0.00 0.00 174.94 174.78 3k1w s GLN 204 N -3.71 4.63 -0.04 0.37 -1.52 -1.26 -0.77 119.66 117.36 3k1w s GLN 204 Ca 0.27 1.82 0.06 0.00 -1.95 0.00 0.00 55.36 55.56 3k1w s GLN 204 Cb 0.02 -3.18 -0.02 0.00 -0.22 0.00 0.00 33.01 29.61 3k1w s GLN 204 CO 0.10 0.19 -0.22 1.41 -0.25 0.00 0.00 175.29 176.52 3k1w s MET 205 N -1.45 2.40 -0.01 2.91 -2.45 0.72 -4.45 119.30 116.97 3k1w s MET 205 Ca 0.45 -0.86 0.20 0.00 -1.25 0.00 0.00 55.69 54.23 3k1w s MET 205 Cb -0.32 -2.19 -0.26 0.00 1.25 0.00 0.00 34.83 33.31 3k1w s MET 205 CO 0.42 0.50 0.63 1.63 1.05 0.00 0.00 175.02 179.25 3k1w n LYS 206 N 2.62 0.60 0.00 4.11 5.02 0.61 -1.75 118.16 129.37 3k1w n LYS 206 Ca -0.17 -0.09 0.00 0.00 -2.02 0.00 0.00 58.31 56.03 3k1w n LYS 206 Cb 0.52 -1.44 0.00 0.00 -0.02 0.00 0.00 35.03 34.08 3k1w n LYS 206 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3k1w n GLY 207 N 1.41 2.00 3.11 0.72 0.00 -1.23 -4.44 105.19 106.76 3k1w n GLY 207 Ca 0.00 -0.54 -0.33 0.00 0.00 0.00 0.00 46.02 45.15 3k1w n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3k1w s VAL 208 N -2.00 2.02 -0.05 1.61 1.01 0.04 -0.57 120.40 122.45 3k1w s VAL 208 Ca 0.00 -0.91 -0.02 0.00 0.00 0.00 0.00 61.98 61.05 3k1w s VAL 208 Cb 0.00 -1.82 -0.04 0.00 0.00 0.00 0.00 36.38 34.52 3k1w s VAL 208 CO 0.00 0.53 0.05 -0.44 0.00 0.00 0.00 175.10 175.24 3k1w s SER 209 N 1.29 5.52 -0.25 3.32 0.01 0.13 -1.73 113.70 121.98 3k1w s SER 209 Ca 0.05 0.17 -0.04 0.00 1.31 0.00 0.00 55.95 57.44 3k1w s SER 209 Cb -0.13 -1.59 0.01 0.00 0.21 0.00 0.00 66.02 64.52 3k1w s SER 209 CO -0.12 0.34 -0.02 -0.69 0.41 0.00 0.00 173.24 173.15 3k1w s VAL 210 N -1.03 3.29 0.00 3.43 1.01 -0.15 -0.43 120.40 126.53 3k1w s VAL 210 Ca 0.17 -0.78 0.00 0.00 0.00 0.00 0.00 61.98 61.37 3k1w s VAL 210 Cb -0.12 -2.62 0.00 0.00 0.00 0.00 0.00 36.38 33.64 3k1w s VAL 210 CO 0.07 0.24 0.00 0.61 0.00 0.00 0.00 175.10 176.02 3k1w n GLY 211 N 4.76 2.26 0.06 4.51 0.00 0.71 -2.80 105.19 114.68 3k1w n GLY 211 Ca -0.17 -0.35 0.14 0.00 0.00 0.00 0.00 46.02 45.64 3k1w n GLY 211 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3k1w n SER 212 N 5.74 0.35 -4.18 1.61 7.64 -1.26 -4.86 113.62 118.66 3k1w n SER 212 Ca 0.00 -0.22 -0.22 0.00 1.01 0.00 0.00 58.87 59.44 3k1w n SER 212 Cb 0.00 -0.12 -0.14 0.00 -1.01 0.00 0.00 64.21 62.95 3k1w n SER 212 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 3k1w s SER 213 N -2.72 1.93 0.25 6.43 0.01 -1.12 -5.12 113.70 113.35 3k1w s SER 213 Ca 0.21 -0.48 -0.30 0.00 1.31 0.00 0.00 55.95 56.70 3k1w s SER 213 Cb 0.19 -0.14 -0.09 0.00 0.21 0.00 0.00 66.02 66.19 3k1w s SER 213 CO 0.54 0.07 1.20 -0.89 0.41 0.00 0.00 173.24 174.57 3k1w s THR 214 N -0.84 3.31 0.00 1.44 2.01 -1.26 -0.97 115.64 119.33 3k1w s THR 214 Ca 0.03 1.21 0.00 0.00 0.31 0.00 0.00 61.69 63.25 3k1w s THR 214 Cb -0.08 -3.77 0.00 0.00 0.01 0.00 0.00 72.50 68.66 3k1w s THR 214 CO 0.01 0.25 0.00 -0.11 -0.69 0.00 0.00 174.62 174.08 3k1w n LEU 215 N 1.71 0.83 -4.29 4.42 0.00 -0.71 -4.87 117.00 114.10 3k1w n LEU 215 Ca 0.02 0.00 -0.17 0.00 0.00 0.00 0.00 56.01 55.86 3k1w n LEU 215 Cb 0.44 0.00 -0.10 0.00 0.00 0.00 0.00 43.42 43.76 3k1w n LEU 215 CO 0.56 0.14 -0.43 -0.76 0.00 0.00 0.00 177.39 176.90 3k1w s LEU 216 N -3.64 2.51 -1.44 -1.96 1.43 -0.74 -4.86 118.68 109.99 3k1w s LEU 216 Ca 0.00 -0.97 0.00 0.00 -1.03 0.00 0.00 54.13 52.13 3k1w s LEU 216 Cb 0.00 -0.52 0.00 0.00 0.03 0.00 0.00 46.19 45.70 3k1w s LEU 216 CO 0.00 -0.23 0.00 0.00 0.23 0.00 0.00 176.35 176.35 3k1w h GLU 218 N 0.00 0.57 -0.49 0.00 9.09 -1.89 -0.21 114.58 121.65 3k1w h GLU 218 Ca -0.34 -0.04 0.00 0.00 0.05 0.00 0.00 59.36 59.03 3k1w h GLU 218 Cb 1.15 -0.13 0.00 0.00 -1.65 0.00 0.00 28.75 28.13 3k1w h GLU 218 CO 0.44 0.38 0.00 -0.25 0.05 0.00 0.00 179.01 179.63 3k1w n ASP 219 N -4.47 2.59 0.00 3.06 8.00 -1.26 -4.91 116.55 119.56 3k1w n ASP 219 Ca 0.03 -2.10 0.00 0.00 0.71 0.00 0.00 54.79 53.44 3k1w n ASP 219 Cb 0.06 -0.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 3k1w n ASP 219 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3k1w n GLY 220 N 1.04 -0.65 2.49 0.44 0.00 -0.09 -5.11 105.19 103.30 3k1w n GLY 220 Ca 0.15 -1.54 -0.05 0.00 0.00 0.00 0.00 46.02 44.58 3k1w n GLY 220 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k1w s LEU 222 N 0.00 3.22 -0.14 0.00 1.43 -1.26 -0.20 118.68 121.73 3k1w s LEU 222 Ca 0.11 -0.29 -0.02 0.00 -1.03 0.00 0.00 54.13 52.90 3k1w s LEU 222 Cb -0.03 -1.98 0.04 0.00 0.03 0.00 0.00 46.19 44.26 3k1w s LEU 222 CO 0.07 0.18 0.01 0.00 0.23 0.00 0.00 176.35 176.84 3k1w s ALA 223 N -1.24 0.94 0.04 4.21 0.00 0.05 -1.37 121.76 124.40 3k1w s ALA 223 Ca 0.23 -0.47 -0.28 0.00 0.00 0.00 0.00 51.96 51.44 3k1w s ALA 223 Cb -0.11 -0.98 -0.05 0.00 0.00 0.00 0.00 23.12 21.98 3k1w s ALA 223 CO 0.15 -0.81 0.88 -1.17 0.00 0.00 0.00 175.76 174.81 3k1w s LEU 224 N 1.88 4.43 -0.54 0.00 2.96 0.40 -1.01 118.68 126.80 3k1w s LEU 224 Ca 0.02 1.59 -0.13 0.00 -0.22 0.00 0.00 54.13 55.39 3k1w s LEU 224 Cb -0.15 -3.42 0.13 0.00 0.50 0.00 0.00 46.19 43.26 3k1w s LEU 224 CO -0.07 -0.10 0.46 -0.69 -1.32 0.00 0.00 176.35 174.63 3k1w s VAL 225 N 0.34 4.80 -0.36 1.68 1.01 -0.28 0.56 120.40 128.16 3k1w s VAL 225 Ca 0.45 -1.74 0.03 0.00 0.00 0.00 0.00 61.98 60.72 3k1w s VAL 225 Cb -0.21 -4.10 0.10 0.00 0.00 0.00 0.00 36.38 32.17 3k1w s VAL 225 CO 0.26 -0.85 0.09 -0.62 0.00 0.00 0.00 175.10 173.98 3k1w s ASP 226 N 3.03 4.87 0.44 3.32 -1.08 -0.62 -4.62 116.67 122.01 3k1w s ASP 226 Ca 0.06 -2.15 0.30 0.00 -0.52 0.00 0.00 52.55 50.24 3k1w s ASP 226 Cb -0.27 -1.67 1.33 0.00 -1.46 0.00 0.00 42.92 40.85 3k1w s ASP 226 CO 0.00 -0.41 1.91 0.71 0.52 0.00 0.00 175.17 177.90 3k1w h THR 227 N 6.54 0.00 -0.01 1.71 1.35 -1.84 -2.29 112.91 118.37 3k1w h THR 227 Ca -0.06 -0.32 0.00 0.00 -0.55 0.00 0.00 66.41 65.49 3k1w h THR 227 Cb 1.02 1.18 0.00 0.00 -1.73 0.00 0.00 68.15 68.62 3k1w h THR 227 CO 0.56 0.00 -0.14 0.61 -0.25 0.00 0.00 175.52 176.31 3k1w n GLY 228 N -0.20 -0.19 3.85 5.82 0.00 -1.26 -4.74 105.19 108.46 3k1w n GLY 228 Ca 0.01 -0.45 -0.38 0.00 0.00 0.00 0.00 46.02 45.20 3k1w n GLY 228 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k1w s ALA 229 N -2.24 3.76 0.18 4.61 0.00 -0.86 -5.01 121.76 122.19 3k1w s ALA 229 Ca 0.30 -0.35 0.00 0.00 0.00 0.00 0.00 51.96 51.92 3k1w s ALA 229 Cb 0.20 -2.26 0.07 0.00 0.00 0.00 0.00 23.12 21.13 3k1w s ALA 229 CO 0.42 0.53 1.43 0.77 0.00 0.00 0.00 175.76 178.91 3k1w h SER 230 N 4.78 0.41 -1.34 0.00 0.02 -1.87 0.32 113.55 115.86 3k1w h SER 230 Ca -0.53 -0.28 -0.63 0.00 -0.84 0.00 0.00 61.79 59.51 3k1w h SER 230 Cb 1.22 -0.12 -0.13 0.00 0.14 0.00 0.00 62.40 63.51 3k1w h SER 230 CO 0.60 1.02 -0.55 -0.31 -1.14 0.00 0.00 176.83 176.45 3k1w s TYR 231 N -3.54 2.06 -0.01 3.45 2.02 -1.26 -2.79 117.35 117.29 3k1w s TYR 231 Ca -0.05 -0.91 -0.28 0.00 -0.37 0.00 0.00 57.07 55.47 3k1w s TYR 231 Cb 0.10 -1.58 -0.04 0.00 -0.40 0.00 0.00 41.96 40.05 3k1w s TYR 231 CO 0.83 0.21 0.88 0.42 -1.57 0.00 0.00 175.55 176.33 3k1w s ILE 232 N -2.90 4.89 0.10 2.71 1.01 -1.12 -1.23 121.20 124.66 3k1w s ILE 232 Ca 0.19 1.85 0.06 0.00 0.00 0.00 0.00 60.65 62.76 3k1w s ILE 232 Cb 0.05 -4.23 -0.03 0.00 0.01 0.00 0.00 42.46 38.26 3k1w s ILE 232 CO 0.10 0.21 -0.15 -0.94 0.00 0.00 0.00 174.94 174.17 3k1w s SER 233 N 0.81 1.92 0.29 3.58 1.04 -0.10 -1.26 113.70 119.98 3k1w s SER 233 Ca 0.47 -0.74 0.03 0.00 0.48 0.00 0.00 55.95 56.19 3k1w s SER 233 Cb -0.20 -0.07 -0.04 0.00 0.10 0.00 0.00 66.02 65.81 3k1w s SER 233 CO 0.25 -0.11 0.16 -0.83 0.98 0.00 0.00 173.24 173.69 3k1w s GLY 234 N -2.18 1.96 0.80 7.32 0.00 -1.05 -0.55 107.32 113.63 3k1w s GLY 234 Ca 0.05 -1.78 -0.14 0.00 0.00 0.00 0.00 44.72 42.84 3k1w s GLY 234 CO 0.03 -1.55 0.82 -1.14 0.00 0.00 0.00 173.10 171.26 3k1w n SER 235 N -0.84 -0.27 -0.18 1.64 3.41 -1.25 -0.39 113.62 115.73 3k1w n SER 235 Ca 0.02 0.55 -0.03 0.00 -0.26 0.00 0.00 58.87 59.15 3k1w n SER 235 Cb 0.65 -1.35 0.04 0.00 -0.26 0.00 0.00 64.21 63.28 3k1w n SER 235 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 3k1w h THR 236 N -0.77 0.36 -0.52 6.66 2.02 -1.92 -0.53 112.91 118.21 3k1w h THR 236 Ca -0.46 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.70 3k1w h THR 236 Cb 1.32 0.36 -0.02 0.00 -1.74 0.00 0.00 68.15 68.06 3k1w h THR 236 CO 0.43 0.00 0.25 0.77 0.37 0.00 0.00 175.52 177.34 3k1w h SER 237 N -0.07 0.69 -0.42 4.18 4.64 -2.00 0.93 113.55 121.51 3k1w h SER 237 Ca 0.25 -0.13 0.03 0.00 -0.47 0.00 0.00 61.79 61.47 3k1w h SER 237 Cb 0.46 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.34 3k1w h SER 237 CO -0.59 0.63 0.23 0.28 -0.87 0.00 0.00 176.83 176.51 3k1w h SER 238 N 0.70 0.35 0.38 4.97 0.02 -1.82 -2.76 113.55 115.39 3k1w h SER 238 Ca 0.18 0.01 -0.16 0.00 -0.84 0.00 0.00 61.79 60.99 3k1w h SER 238 Cb 0.12 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 3k1w h SER 238 CO -0.02 0.25 -0.65 0.40 -1.14 0.00 0.00 176.83 175.67 3k1w h ILE 239 N 0.46 1.40 -0.17 3.27 1.08 -0.74 -0.90 117.51 121.91 3k1w h ILE 239 Ca 0.17 -2.08 0.04 0.00 -0.39 0.00 0.00 64.86 62.60 3k1w h ILE 239 Cb 0.05 2.07 -0.04 0.00 -3.07 0.00 0.00 36.82 35.83 3k1w h ILE 239 CO -0.10 0.62 -0.06 -0.33 -0.69 0.00 0.00 178.15 177.58 3k1w h GLU 240 N 0.18 -0.03 -0.14 2.37 5.08 -0.78 0.67 114.58 121.93 3k1w h GLU 240 Ca -0.01 0.00 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 3k1w h GLU 240 Cb 1.18 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 3k1w h GLU 240 CO 0.10 -0.02 -0.06 0.87 -1.00 0.00 0.00 179.01 178.90 3k1w h LYS 241 N -0.03 -0.04 -0.13 2.33 1.57 -1.28 -1.49 116.57 117.50 3k1w h LYS 241 Ca 0.09 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.90 3k1w h LYS 241 Cb 0.17 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 3k1w h LYS 241 CO -0.20 -0.03 -0.02 1.25 -0.57 0.00 0.00 179.45 179.89 3k1w h LEU 242 N -0.04 -0.09 -1.19 2.94 5.85 -0.92 -2.59 115.31 119.27 3k1w h LEU 242 Ca 0.08 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.77 3k1w h LEU 242 Cb 0.16 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.24 3k1w h LEU 242 CO -0.17 -0.03 -0.10 0.24 -0.34 0.00 0.00 178.44 178.04 3k1w h MET 243 N 0.02 0.44 -0.53 1.25 2.86 -0.69 -1.57 114.93 116.71 3k1w h MET 243 Ca 0.06 -0.11 0.06 0.00 -2.06 0.00 0.00 59.70 57.65 3k1w h MET 243 Cb 0.09 -0.05 -0.05 0.00 0.06 0.00 0.00 31.60 31.64 3k1w h MET 243 CO -0.12 0.55 0.23 0.93 1.06 0.00 0.00 176.91 179.56 3k1w h GLU 244 N 0.41 0.44 0.00 1.72 5.08 -1.09 -1.04 114.58 120.09 3k1w h GLU 244 Ca 0.08 -0.03 -0.06 0.00 -1.00 0.00 0.00 59.36 58.36 3k1w h GLU 244 Cb 0.43 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 3k1w h GLU 244 CO 0.02 0.29 -0.28 0.00 -1.00 0.00 0.00 179.01 178.04 3k1w h ALA 245 N 1.32 1.21 0.00 3.43 0.00 -0.91 -2.99 119.26 121.32 3k1w h ALA 245 Ca 0.25 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3k1w h ALA 245 Cb 0.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3k1w h ALA 245 CO -0.21 0.35 -0.78 1.28 0.00 0.00 0.00 179.25 179.89 3k1w n LEU 246 N -3.73 0.63 -0.53 0.00 4.77 -0.87 -4.96 117.00 112.31 3k1w n LEU 246 Ca -0.01 -0.01 -0.04 0.00 -0.03 0.00 0.00 56.01 55.92 3k1w n LEU 246 Cb 0.39 -0.15 -0.00 0.00 -2.33 0.00 0.00 43.42 41.32 3k1w n LEU 246 CO 0.35 0.07 -0.05 0.61 -1.33 0.00 0.00 177.39 177.04 3k1w n GLY 247 N 1.42 0.23 3.91 -0.72 0.00 -0.64 -4.91 105.19 104.47 3k1w n GLY 247 Ca 0.03 -0.70 -0.31 0.00 0.00 0.00 0.00 46.02 45.05 3k1w n GLY 247 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k1w s ALA 248 N -2.27 3.95 -0.08 4.61 0.00 -0.49 -4.84 121.76 122.64 3k1w s ALA 248 Ca 0.01 -0.76 0.02 0.00 0.00 0.00 0.00 51.96 51.22 3k1w s ALA 248 Cb -0.00 -1.91 -0.02 0.00 0.00 0.00 0.00 23.12 21.18 3k1w s ALA 248 CO 0.01 0.78 -0.12 0.21 0.00 0.00 0.00 175.76 176.64 3k1w s LYS 249 N -2.56 2.80 0.03 0.00 2.20 0.38 -4.57 119.74 118.02 3k1w s LYS 249 Ca 0.37 -0.66 -0.30 0.00 -0.36 0.00 0.00 55.97 55.02 3k1w s LYS 249 Cb -0.13 -2.50 -0.05 0.00 -1.51 0.00 0.00 37.83 33.65 3k1w s LYS 249 CO 0.27 0.52 1.14 0.21 -0.36 0.00 0.00 175.35 177.13 3k1w s LYS 250 N -0.45 4.46 0.15 4.03 2.20 -1.26 -0.61 119.74 128.25 3k1w s LYS 250 Ca 0.06 1.66 0.02 0.00 -0.36 0.00 0.00 55.97 57.34 3k1w s LYS 250 Cb -0.12 -3.41 0.02 0.00 -1.51 0.00 0.00 37.83 32.81 3k1w s LYS 250 CO 0.02 -0.23 0.13 0.54 -0.36 0.00 0.00 175.35 175.46 3k1w n ARG 251 N 4.10 1.19 -0.12 4.03 1.74 0.48 -4.96 116.66 123.12 3k1w n ARG 251 Ca 0.08 -0.90 -0.04 0.00 -0.77 0.00 0.00 57.85 56.22 3k1w n ARG 251 Cb 0.48 0.06 0.03 0.00 -1.02 0.00 0.00 32.46 32.00 3k1w n ARG 251 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 3k1w h LEU 252 N 0.00 -0.22 -0.75 0.55 3.38 -2.03 -3.31 115.31 112.93 3k1w h LEU 252 Ca -0.09 0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3k1w h LEU 252 Cb 0.34 0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.28 3k1w h LEU 252 CO 0.14 -0.07 -0.01 0.49 0.09 0.00 0.00 178.44 179.08 3k1w n PHE 253 N -5.23 0.00 -3.51 1.13 3.72 -1.26 -5.08 117.46 107.23 3k1w n PHE 253 Ca 0.03 0.00 -0.05 0.00 -0.05 0.00 0.00 57.45 57.38 3k1w n PHE 253 Cb 0.21 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 3k1w n PHE 253 CO 0.00 0.00 0.00 -0.40 -0.05 0.00 0.00 176.76 176.31 3k1w n ASP 254 N -0.24 -0.76 -4.40 4.37 5.68 -1.25 -5.01 116.55 114.94 3k1w n ASP 254 Ca 0.00 -1.69 -0.30 0.00 -0.50 0.00 0.00 54.79 52.30 3k1w n ASP 254 Cb 0.01 1.31 -0.13 0.00 -1.14 0.00 0.00 41.12 41.17 3k1w n ASP 254 CO 0.00 0.00 0.00 -0.31 -1.33 0.00 0.00 177.20 175.56 3k1w s TYR 255 N -5.37 2.39 0.05 2.11 2.02 -1.26 -0.38 117.35 116.91 3k1w s TYR 255 Ca 0.09 -0.35 0.03 0.00 -0.37 0.00 0.00 57.07 56.46 3k1w s TYR 255 Cb -0.01 -1.37 -0.03 0.00 -0.40 0.00 0.00 41.96 40.16 3k1w s TYR 255 CO 0.06 0.24 -0.09 0.14 -1.57 0.00 0.00 175.55 174.33 3k1w s VAL 256 N -0.94 0.70 0.29 0.71 -7.23 0.22 -1.60 120.40 112.55 3k1w s VAL 256 Ca 0.14 -1.18 0.09 0.00 -1.81 0.00 0.00 61.98 59.21 3k1w s VAL 256 Cb -0.10 -0.78 -0.06 0.00 0.56 0.00 0.00 36.38 36.00 3k1w s VAL 256 CO 0.05 -0.37 -0.11 0.68 -0.31 0.00 0.00 175.10 175.04 3k1w s VAL 257 N -1.47 1.98 0.22 1.32 -7.23 -0.65 -0.47 120.40 114.10 3k1w s VAL 257 Ca -0.07 -2.21 -0.30 0.00 -1.81 0.00 0.00 61.98 57.59 3k1w s VAL 257 Cb -0.09 -2.43 -0.10 0.00 0.56 0.00 0.00 36.38 34.32 3k1w s VAL 257 CO 0.01 -0.33 1.45 -0.54 -0.31 0.00 0.00 175.10 175.38 3k1w s LYS 258 N -3.64 4.27 0.49 4.82 1.02 -1.26 -0.34 119.74 125.10 3k1w s LYS 258 Ca 0.29 2.28 0.20 0.00 0.02 0.00 0.00 55.97 58.76 3k1w s LYS 258 Cb 0.01 -3.13 1.24 0.00 -0.52 0.00 0.00 37.83 35.43 3k1w s LYS 258 CO 0.13 -0.45 2.01 0.00 -0.92 0.00 0.00 175.35 176.12 3k1w h ASN 260 N 0.16 0.00 0.31 0.00 -1.07 -1.57 -3.11 115.58 110.29 3k1w h ASN 260 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.60 3k1w h ASN 260 Cb 0.72 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.97 3k1w h ASN 260 CO -0.03 0.00 -0.77 -0.62 0.07 0.00 0.00 177.43 176.07 3k1w n GLU 261 N -3.03 0.05 -0.13 4.14 1.02 -0.16 -4.45 120.64 118.08 3k1w n GLU 261 Ca 0.03 -0.00 -0.13 0.00 -0.02 0.00 0.00 57.16 57.04 3k1w n GLU 261 Cb 0.43 -1.52 -0.09 0.00 -0.02 0.00 0.00 31.44 30.24 3k1w n GLU 261 CO 0.00 0.00 0.00 0.78 1.18 0.00 0.00 177.13 179.09 3k1w h GLY 262 N 4.92 -1.07 1.44 0.62 0.00 -1.45 -2.34 103.07 105.19 3k1w h GLY 262 Ca 0.00 0.73 0.02 0.00 0.00 0.00 0.00 47.33 48.08 3k1w h GLY 262 CO 0.00 -0.15 0.26 -2.55 0.00 0.00 0.00 176.54 174.09 3k1w h PRO 263 N -0.37 0.00 0.00 4.80 0.11 -1.80 -1.83 132.00 132.91 3k1w h PRO 263 Ca 0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3k1w h PRO 263 Cb 0.56 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.67 3k1w h PRO 263 CO -0.56 0.00 -0.67 0.25 -0.21 0.00 0.00 178.00 176.80 3k1w n THR 264 N -3.18 0.08 -1.69 -1.15 -2.24 -0.89 -4.88 114.28 100.33 3k1w n THR 264 Ca -0.00 -0.08 -0.38 0.00 -2.27 0.00 0.00 64.05 61.31 3k1w n THR 264 Cb 0.34 0.28 0.05 0.00 -2.10 0.00 0.00 70.33 68.89 3k1w n THR 264 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 3k1w n LEU 265 N -1.67 4.90 -4.82 3.22 4.32 -0.69 -4.97 117.00 117.28 3k1w n LEU 265 Ca 0.04 0.89 -0.32 0.00 -0.02 0.00 0.00 56.01 56.60 3k1w n LEU 265 Cb 0.37 -1.50 -0.02 0.00 -1.62 0.00 0.00 43.42 40.65 3k1w n LEU 265 CO 0.37 -1.15 0.70 -2.16 -1.22 0.00 0.00 177.39 173.93 3k1w s PRO 266 N -2.91 3.67 0.49 3.23 0.04 -1.26 -4.42 135.00 133.84 3k1w s PRO 266 Ca 0.75 1.09 -0.24 0.00 0.04 0.00 0.00 61.00 62.64 3k1w s PRO 266 Cb -0.42 -2.09 -0.07 0.00 0.04 0.00 0.00 34.50 31.96 3k1w s PRO 266 CO 0.47 -0.51 1.38 -0.25 0.04 0.00 0.00 177.00 178.12 3k1w n ASP 267 N -1.74 2.95 -4.47 6.66 8.00 -1.26 -4.51 116.55 122.18 3k1w n ASP 267 Ca 0.08 1.06 -0.33 0.00 0.71 0.00 0.00 54.79 56.30 3k1w n ASP 267 Cb 0.53 -1.58 -0.13 0.00 -0.02 0.00 0.00 41.12 39.93 3k1w n ASP 267 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 3k1w s ILE 268 N -1.24 3.33 -0.03 0.53 1.01 -0.16 -0.21 121.20 124.42 3k1w s ILE 268 Ca 0.66 -0.60 0.06 0.00 0.00 0.00 0.00 60.65 60.76 3k1w s ILE 268 Cb -0.44 -2.37 -0.01 0.00 0.01 0.00 0.00 42.46 39.65 3k1w s ILE 268 CO 0.54 0.56 -0.20 -0.44 0.00 0.00 0.00 174.94 175.40 3k1w s SER 269 N -0.28 2.46 -0.22 3.58 0.01 0.43 -0.86 113.70 118.82 3k1w s SER 269 Ca 0.03 -0.39 -0.05 0.00 1.31 0.00 0.00 55.95 56.84 3k1w s SER 269 Cb -0.13 -0.51 -0.02 0.00 0.21 0.00 0.00 66.02 65.57 3k1w s SER 269 CO 0.03 0.21 -0.01 -0.36 0.41 0.00 0.00 173.24 173.52 3k1w s PHE 270 N -0.22 3.01 -0.48 2.43 0.08 -0.09 0.17 117.98 122.88 3k1w s PHE 270 Ca 0.01 -0.68 -0.20 0.00 0.12 0.00 0.00 56.93 56.17 3k1w s PHE 270 Cb -0.11 -2.13 0.04 0.00 -0.57 0.00 0.00 43.02 40.26 3k1w s PHE 270 CO 0.01 -0.42 0.66 -1.58 -0.10 0.00 0.00 175.22 173.80 3k1w s HIS 271 N 1.37 3.03 -0.16 0.36 2.46 0.27 -0.64 115.29 121.98 3k1w s HIS 271 Ca 0.05 -0.28 -0.00 0.00 0.47 0.00 0.00 55.06 55.30 3k1w s HIS 271 Cb -0.15 -3.50 0.04 0.00 -0.13 0.00 0.00 32.58 28.84 3k1w s HIS 271 CO -0.00 -1.00 -0.08 -0.51 -2.47 0.00 0.00 174.74 170.69 3k1w s LEU 272 N 2.85 1.69 -1.58 8.88 1.43 -0.75 -0.29 118.68 130.90 3k1w s LEU 272 Ca 0.20 -0.63 0.00 0.00 -1.03 0.00 0.00 54.13 52.67 3k1w s LEU 272 Cb -0.16 -1.00 0.00 0.00 0.03 0.00 0.00 46.19 45.06 3k1w s LEU 272 CO 0.16 -0.15 0.00 0.61 0.23 0.00 0.00 176.35 177.20 3k1w n GLY 273 N 4.84 0.56 1.15 -3.19 0.00 -1.26 -2.42 105.19 104.86 3k1w n GLY 273 Ca -0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.89 3k1w n GLY 273 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3k1w n GLY 274 N -0.60 0.83 3.91 -0.02 0.00 -1.26 -4.97 105.19 103.09 3k1w n GLY 274 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 3k1w n GLY 274 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3k1w s LYS 275 N -0.62 3.51 -0.26 1.61 2.20 -1.02 -5.11 119.74 120.06 3k1w s LYS 275 Ca 0.00 -0.31 -0.16 0.00 -0.36 0.00 0.00 55.97 55.14 3k1w s LYS 275 Cb 0.00 -2.95 -0.03 0.00 -1.51 0.00 0.00 37.83 33.34 3k1w s LYS 275 CO 0.00 0.53 0.42 -1.21 -0.36 0.00 0.00 175.35 174.73 3k1w s GLU 276 N -2.69 4.04 -0.43 4.03 0.41 -1.26 -1.81 118.70 120.99 3k1w s GLU 276 Ca 0.37 0.13 -0.16 0.00 -0.41 0.00 0.00 54.97 54.91 3k1w s GLU 276 Cb -0.12 -3.64 0.03 0.00 -1.78 0.00 0.00 34.13 28.61 3k1w s GLU 276 CO 0.27 -0.28 0.37 0.71 -0.49 0.00 0.00 175.26 175.84 3k1w s TYR 277 N 2.07 3.22 -0.18 1.61 2.02 0.19 -4.92 117.35 121.36 3k1w s TYR 277 Ca 0.17 -0.60 -0.07 0.00 -0.37 0.00 0.00 57.07 56.21 3k1w s TYR 277 Cb -0.16 -2.81 -0.04 0.00 -0.40 0.00 0.00 41.96 38.55 3k1w s TYR 277 CO 0.09 -0.67 0.05 0.99 -1.57 0.00 0.00 175.55 174.44 3k1w s THR 278 N 1.83 4.69 -0.17 -0.71 2.01 -1.26 -0.91 115.64 121.12 3k1w s THR 278 Ca 0.07 -0.07 -0.05 0.00 0.31 0.00 0.00 61.69 61.95 3k1w s THR 278 Cb -0.19 -3.10 -0.03 0.00 0.01 0.00 0.00 72.50 69.18 3k1w s THR 278 CO 0.10 0.47 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.73 3k1w s LEU 279 N 0.30 3.34 0.71 4.42 1.02 -0.04 -4.99 118.68 123.44 3k1w s LEU 279 Ca 0.03 -0.11 -0.06 0.00 0.02 0.00 0.00 54.13 54.01 3k1w s LEU 279 Cb -0.12 -1.82 0.08 0.00 0.02 0.00 0.00 46.19 44.34 3k1w s LEU 279 CO 0.00 0.15 1.01 0.42 0.02 0.00 0.00 176.35 177.95 3k1w s THR 280 N 0.49 2.28 0.40 5.49 -4.23 -1.26 -0.99 115.64 117.82 3k1w s THR 280 Ca -0.02 -0.34 0.08 0.00 -1.18 0.00 0.00 61.69 60.23 3k1w s THR 280 Cb -0.14 -2.94 0.28 0.00 1.34 0.00 0.00 72.50 71.04 3k1w s THR 280 CO 0.02 0.00 2.02 0.77 -0.54 0.00 0.00 174.62 176.89 3k1w h SER 281 N -0.60 0.51 -0.14 3.99 4.64 -1.79 0.20 113.55 120.37 3k1w h SER 281 Ca -0.43 -0.01 0.04 0.00 -0.47 0.00 0.00 61.79 60.92 3k1w h SER 281 Cb 1.30 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 63.27 3k1w h SER 281 CO 0.55 0.35 0.12 0.00 -0.87 0.00 0.00 176.83 176.98 3k1w h ALA 282 N 1.70 1.91 0.00 5.18 0.00 -1.88 -0.26 119.26 125.91 3k1w h ALA 282 Ca 0.21 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3k1w h ALA 282 Cb 0.11 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.91 3k1w h ALA 282 CO -0.06 -0.19 -0.68 -0.44 0.00 0.00 0.00 179.25 177.88 3k1w h ASP 283 N 0.00 0.00 0.00 0.00 3.32 -0.95 -3.39 116.42 115.40 3k1w h ASP 283 Ca 0.07 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.09 3k1w h ASP 283 Cb 0.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.86 3k1w h ASP 283 CO -0.00 0.01 0.00 0.00 -1.72 0.00 0.00 179.24 177.53 3k1w n TYR 284 N -2.72 0.00 -4.65 4.55 0.18 -0.83 -4.94 117.16 108.74 3k1w n TYR 284 Ca 0.02 -0.11 -0.33 0.00 1.88 0.00 0.00 57.90 59.36 3k1w n TYR 284 Cb 0.53 -0.01 -0.13 0.00 -0.38 0.00 0.00 39.34 39.35 3k1w n TYR 284 CO 0.00 0.00 0.00 0.08 -2.08 0.00 0.00 176.86 174.86 3k1w s VAL 285 N -0.21 3.42 -1.02 -3.48 1.01 -0.17 -0.38 120.40 119.56 3k1w s VAL 285 Ca 0.00 -0.55 -0.22 0.00 0.00 0.00 0.00 61.98 61.22 3k1w s VAL 285 Cb 0.00 -2.44 0.07 0.00 0.00 0.00 0.00 36.38 34.01 3k1w s VAL 285 CO 0.00 0.54 1.39 -0.36 0.00 0.00 0.00 175.10 176.67 3k1w s PHE 286 N 0.03 2.70 -1.54 5.22 0.08 -0.48 -4.83 117.98 119.15 3k1w s PHE 286 Ca -0.02 -1.04 -0.11 0.00 0.12 0.00 0.00 56.93 55.88 3k1w s PHE 286 Cb -0.14 -4.60 -0.02 0.00 -0.57 0.00 0.00 43.02 37.69 3k1w s PHE 286 CO 0.04 -1.82 2.64 0.94 -0.10 0.00 0.00 175.22 176.92 3k1w n GLN 287 N 8.26 3.48 0.23 0.44 -0.06 -1.26 -4.24 117.38 124.22 3k1w n GLN 287 Ca 0.32 -2.47 0.10 0.00 -2.00 0.00 0.00 57.00 52.94 3k1w n GLN 287 Cb 0.50 -2.96 0.54 0.00 -4.06 0.00 0.00 30.24 24.26 3k1w n GLN 287 CO 0.00 0.00 0.00 0.93 -0.20 0.00 0.00 177.06 177.79 3k1w h GLU 288 N 5.34 0.00 -4.38 3.69 3.07 -1.95 -3.45 114.58 116.90 3k1w h GLU 288 Ca 0.75 0.00 -0.29 0.00 -0.50 0.00 0.00 59.36 59.32 3k1w h GLU 288 Cb 0.42 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 28.21 3k1w h GLU 288 CO 1.80 0.22 -0.37 0.45 -1.40 0.00 0.00 179.01 179.71 3k1w s SER 289 N -6.29 0.79 -0.06 1.42 0.15 -1.26 -5.05 113.70 103.40 3k1w s SER 289 Ca -0.01 -1.46 0.08 0.00 0.70 0.00 0.00 55.95 55.26 3k1w s SER 289 Cb 0.12 0.55 0.14 0.00 -1.71 0.00 0.00 66.02 65.13 3k1w s SER 289 CO 0.63 -1.10 1.08 -1.22 1.20 0.00 0.00 173.24 173.83 3k1w n TYR 290 N -0.48 0.05 -2.62 3.44 4.01 -1.26 -4.71 117.16 115.59 3k1w n TYR 290 Ca 0.03 -0.70 -0.40 0.00 -0.16 0.00 0.00 57.90 56.66 3k1w n TYR 290 Cb 0.63 -0.10 -0.05 0.00 -0.31 0.00 0.00 39.34 39.51 3k1w n TYR 290 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 3k1w s SER 291 N -1.75 7.44 0.00 7.72 0.15 -1.26 -3.46 113.70 122.54 3k1w s SER 291 Ca 0.15 2.04 0.16 0.00 0.70 0.00 0.00 55.95 58.99 3k1w s SER 291 Cb 0.12 -2.61 0.71 0.00 -1.71 0.00 0.00 66.02 62.53 3k1w s SER 291 CO 0.02 -0.04 1.49 -1.20 1.20 0.00 0.00 173.24 174.71 3k1w n SER 292 N 1.82 0.00 -0.02 5.45 7.64 -1.26 -2.35 113.62 124.90 3k1w n SER 292 Ca -0.00 0.37 0.10 0.00 1.01 0.00 0.00 58.87 60.36 3k1w n SER 292 Cb 0.47 -0.44 -0.11 0.00 -1.01 0.00 0.00 64.21 63.11 3k1w n SER 292 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3k1w n LYS 293 N -1.44 0.05 -4.22 1.43 3.00 -1.26 -4.86 118.16 110.86 3k1w n LYS 293 Ca 0.05 -0.04 -0.29 0.00 -0.00 0.00 0.00 58.31 58.03 3k1w n LYS 293 Cb 0.17 -1.50 -0.09 0.00 0.00 0.00 0.00 35.03 33.61 3k1w n LYS 293 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.40 177.55 3k1w s LYS 294 N -2.98 2.21 -0.13 1.64 1.02 -0.99 -5.04 119.74 115.47 3k1w s LYS 294 Ca 0.08 -1.05 -0.06 0.00 0.02 0.00 0.00 55.97 54.96 3k1w s LYS 294 Cb 0.16 -2.32 -0.04 0.00 -0.52 0.00 0.00 37.83 35.11 3k1w s LYS 294 CO 0.86 0.49 0.08 -0.51 -0.92 0.00 0.00 175.35 175.35 3k1w s LEU 295 N -2.43 4.02 -0.09 3.17 1.43 -1.26 -0.78 118.68 122.74 3k1w s LEU 295 Ca 0.23 0.27 0.04 0.00 -1.03 0.00 0.00 54.13 53.65 3k1w s LEU 295 Cb -0.11 -1.98 -0.01 0.00 0.03 0.00 0.00 46.19 44.13 3k1w s LEU 295 CO 0.15 0.33 -0.23 0.00 0.23 0.00 0.00 176.35 176.83 3k1w s THR 297 N 0.17 4.74 0.09 0.00 -4.23 -1.26 -1.64 115.64 113.51 3k1w s THR 297 Ca -0.13 0.78 -0.07 0.00 -1.18 0.00 0.00 61.69 61.09 3k1w s THR 297 Cb -0.16 -3.66 -0.06 0.00 1.34 0.00 0.00 72.50 69.96 3k1w s THR 297 CO 0.07 -0.31 0.37 -0.76 -0.54 0.00 0.00 174.62 173.44 3k1w s LEU 298 N -3.33 4.32 -0.11 4.79 1.43 -0.63 -1.39 118.68 123.76 3k1w s LEU 298 Ca 0.52 0.67 -0.00 0.00 -1.03 0.00 0.00 54.13 54.29 3k1w s LEU 298 Cb -0.10 -3.07 0.09 0.00 0.03 0.00 0.00 46.19 43.13 3k1w s LEU 298 CO 0.23 0.13 1.84 0.00 0.23 0.00 0.00 176.35 178.78 3k1w n ALA 299 N 0.59 4.15 -3.54 4.21 0.00 0.48 -4.71 120.51 121.70 3k1w n ALA 299 Ca -0.06 -0.61 -0.14 0.00 0.00 0.00 0.00 53.44 52.62 3k1w n ALA 299 Cb 0.52 -1.13 -0.16 0.00 0.00 0.00 0.00 19.45 18.69 3k1w n ALA 299 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3k1w s ILE 300 N -0.82 -0.03 0.10 0.00 1.01 -1.26 -2.79 121.20 117.41 3k1w s ILE 300 Ca 0.12 0.16 0.01 0.00 0.00 0.00 0.00 60.65 60.93 3k1w s ILE 300 Cb 0.09 -0.07 -0.04 0.00 0.01 0.00 0.00 42.46 42.45 3k1w s ILE 300 CO 0.00 0.07 -0.03 -1.00 0.00 0.00 0.00 174.94 173.98 3k1w s HIS 301 N 0.80 0.84 0.12 3.97 3.76 -0.39 -4.65 115.29 119.75 3k1w s HIS 301 Ca -0.07 -1.00 -0.25 0.00 -0.15 0.00 0.00 55.06 53.58 3k1w s HIS 301 Cb -0.10 -0.51 -0.07 0.00 1.11 0.00 0.00 32.58 33.01 3k1w s HIS 301 CO -0.02 -0.26 0.78 0.00 -0.85 0.00 0.00 174.74 174.39 3k1w s ALA 302 N -3.75 3.41 -0.21 -1.40 0.00 -1.26 -2.52 121.76 116.03 3k1w s ALA 302 Ca 0.14 0.35 -0.05 0.00 0.00 0.00 0.00 51.96 52.39 3k1w s ALA 302 Cb 0.06 -2.99 0.10 0.00 0.00 0.00 0.00 23.12 20.30 3k1w s ALA 302 CO -0.04 0.20 0.39 1.41 0.00 0.00 0.00 175.76 177.72 3k1w s MET 303 N -0.74 0.31 -0.58 0.00 0.00 0.47 -4.89 119.30 113.89 3k1w s MET 303 Ca 0.37 0.81 -0.22 0.00 0.00 0.00 0.00 55.69 56.66 3k1w s MET 303 Cb -0.22 -0.02 0.06 0.00 0.00 0.00 0.00 34.83 34.65 3k1w s MET 303 CO 0.25 -0.40 0.85 -0.51 0.00 0.00 0.00 175.02 175.21 3k1w s ASP 304 N 2.57 6.24 -0.15 1.11 1.01 -1.26 -3.94 116.67 122.24 3k1w s ASP 304 Ca 0.04 -0.80 -0.20 0.00 0.71 0.00 0.00 52.55 52.30 3k1w s ASP 304 Cb -0.13 -2.38 -0.03 0.00 1.01 0.00 0.00 42.92 41.38 3k1w s ASP 304 CO -0.13 -1.21 0.58 -0.63 0.21 0.00 0.00 175.17 173.99 3k1w s ILE 305 N 3.55 5.09 0.63 0.77 1.01 -1.26 -5.04 121.20 125.93 3k1w s ILE 305 Ca 0.22 1.13 -0.17 0.00 0.00 0.00 0.00 60.65 61.83 3k1w s ILE 305 Cb -0.17 -3.91 -0.02 0.00 0.01 0.00 0.00 42.46 38.38 3k1w s ILE 305 CO 0.13 0.20 1.14 -2.16 0.00 0.00 0.00 174.94 174.25 3k1w s PRO 306 N 1.33 2.89 0.72 2.79 0.04 -1.26 -3.35 135.00 138.16 3k1w s PRO 306 Ca 0.29 1.54 -0.16 0.00 0.04 0.00 0.00 61.00 62.71 3k1w s PRO 306 Cb -0.16 -1.95 0.02 0.00 0.04 0.00 0.00 34.50 32.45 3k1w s PRO 306 CO 0.11 -1.20 1.12 -2.30 0.04 0.00 0.00 177.00 174.77 3k1w n PRO 307 N -2.05 0.62 0.07 0.56 -0.02 -1.08 -1.07 135.00 132.04 3k1w n PRO 307 Ca 0.11 0.27 -0.06 0.00 -2.02 0.00 0.00 63.50 61.81 3k1w n PRO 307 Cb 0.51 -2.36 -0.08 0.00 -0.02 0.00 0.00 33.50 31.55 3k1w n PRO 307 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3k1w h PRO 308 N -0.15 0.00 -0.52 0.52 0.11 -2.04 -3.44 132.00 126.48 3k1w h PRO 308 Ca -0.48 -0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.67 3k1w h PRO 308 Cb 1.33 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.40 3k1w h PRO 308 CO 0.49 0.95 0.27 1.15 -0.21 0.00 0.00 178.00 180.64 3k1w h THR 309 N 0.00 0.96 -0.73 -1.15 2.02 -1.92 -3.44 112.91 108.65 3k1w h THR 309 Ca -0.01 -0.18 -0.53 0.00 0.77 0.00 0.00 66.41 66.47 3k1w h THR 309 Cb 1.67 0.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.47 3k1w h THR 309 CO 0.12 0.09 -0.20 -0.83 0.37 0.00 0.00 175.52 175.08 3k1w s GLY 310 N -2.85 2.02 0.42 2.16 0.00 -0.23 -4.61 107.32 104.23 3k1w s GLY 310 Ca -0.13 -1.76 -0.25 0.00 0.00 0.00 0.00 44.72 42.58 3k1w s GLY 310 CO 0.74 -1.79 1.23 -4.14 0.00 0.00 0.00 173.10 169.14 3k1w s PRO 311 N -4.48 3.94 -0.02 2.90 0.02 -1.21 -2.63 135.00 133.52 3k1w s PRO 311 Ca 0.50 1.98 -0.29 0.00 0.02 0.00 0.00 61.00 63.20 3k1w s PRO 311 Cb -0.04 -2.66 0.08 0.00 0.02 0.00 0.00 34.50 31.90 3k1w s PRO 311 CO 0.31 -0.46 0.70 -0.08 -0.33 0.00 0.00 177.00 177.14 3k1w s THR 312 N -1.36 0.00 0.60 0.99 -1.32 -1.26 -4.76 115.64 108.54 3k1w s THR 312 Ca 0.58 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.91 3k1w s THR 312 Cb -0.34 -1.00 -0.03 0.00 -1.51 0.00 0.00 72.50 69.62 3k1w s THR 312 CO 0.43 0.00 1.07 0.26 -2.21 0.00 0.00 174.62 174.17 3k1w s TRP 313 N -1.76 2.88 -0.11 9.09 0.52 -0.47 -4.35 118.94 124.73 3k1w s TRP 313 Ca -0.07 1.53 0.02 0.00 0.02 0.00 0.00 56.10 57.60 3k1w s TRP 313 Cb -0.00 -3.07 0.01 0.00 -1.15 0.00 0.00 33.47 29.26 3k1w s TRP 313 CO 0.04 -1.28 -0.18 0.00 0.02 0.00 0.00 176.95 175.55 3k1w s ALA 314 N -2.37 1.87 -0.62 0.98 0.00 0.29 -0.45 121.76 121.46 3k1w s ALA 314 Ca 0.65 -0.83 -0.15 0.00 0.00 0.00 0.00 51.96 51.63 3k1w s ALA 314 Cb -0.18 -0.84 0.16 0.00 0.00 0.00 0.00 23.12 22.26 3k1w s ALA 314 CO 0.37 0.03 0.56 -0.51 0.00 0.00 0.00 175.76 176.21 3k1w s LEU 315 N 0.79 6.29 0.00 0.00 1.43 0.19 -0.92 118.68 126.46 3k1w s LEU 315 Ca -0.10 -2.09 0.00 0.00 -1.03 0.00 0.00 54.13 50.91 3k1w s LEU 315 Cb -0.16 -2.18 0.00 0.00 0.03 0.00 0.00 46.19 43.88 3k1w s LEU 315 CO 0.01 -0.75 0.00 0.61 0.23 0.00 0.00 176.35 176.45 3k1w n GLY 316 N 4.81 1.80 0.34 -3.19 0.00 -0.36 -1.58 105.19 107.01 3k1w n GLY 316 Ca -0.05 -1.83 0.08 0.00 0.00 0.00 0.00 46.02 44.22 3k1w n GLY 316 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k1w h ALA 317 N -1.11 1.83 -0.95 4.61 0.00 -0.86 -0.44 119.26 122.34 3k1w h ALA 317 Ca 0.00 -0.02 0.11 0.00 0.00 0.00 0.00 54.91 55.00 3k1w h ALA 317 Cb 0.00 -0.14 -0.08 0.00 0.00 0.00 0.00 17.79 17.57 3k1w h ALA 317 CO 0.00 0.07 0.59 1.15 0.00 0.00 0.00 179.25 181.06 3k1w h THR 318 N 0.57 0.92 0.08 0.00 2.02 -1.75 0.52 112.91 115.27 3k1w h THR 318 Ca 0.26 -0.32 -0.21 0.00 0.77 0.00 0.00 66.41 66.90 3k1w h THR 318 Cb 0.29 -0.11 0.02 0.00 -1.74 0.00 0.00 68.15 66.61 3k1w h THR 318 CO -0.07 0.17 -0.87 0.15 0.37 0.00 0.00 175.52 175.27 3k1w h PHE 319 N 0.95 0.73 -0.16 3.16 3.04 -1.43 -3.32 116.94 119.90 3k1w h PHE 319 Ca 0.47 -0.45 -0.08 0.00 3.98 0.00 0.00 57.97 61.88 3k1w h PHE 319 Cb 0.44 -0.06 -0.01 0.00 2.56 0.00 0.00 35.95 38.87 3k1w h PHE 319 CO -0.02 1.30 -0.27 0.82 -2.02 0.00 0.00 178.31 178.12 3k1w h ILE 320 N -0.06 1.25 -1.00 1.41 2.04 -0.88 -0.80 117.51 119.48 3k1w h ILE 320 Ca -0.13 -1.20 0.10 0.00 1.00 0.00 0.00 64.86 64.63 3k1w h ILE 320 Cb 1.61 1.43 -0.08 0.00 -0.74 0.00 0.00 36.82 39.04 3k1w h ILE 320 CO 0.17 0.37 0.63 0.03 0.00 0.00 0.00 178.15 179.35 3k1w h ARG 321 N 0.27 1.01 0.16 2.37 3.08 -1.00 -2.52 114.38 117.75 3k1w h ARG 321 Ca 0.04 -0.06 -0.30 0.00 0.07 0.00 0.00 59.98 59.73 3k1w h ARG 321 Cb 0.62 -0.23 0.01 0.00 0.08 0.00 0.00 29.97 30.46 3k1w h ARG 321 CO 0.04 0.67 -1.36 -0.22 -1.07 0.00 0.00 179.97 178.03 3k1w h LYS 322 N 1.04 0.34 -4.28 0.04 1.63 -1.43 -3.43 116.57 110.49 3k1w h LYS 322 Ca 0.47 -0.59 -0.62 0.00 -0.85 0.00 0.00 60.65 59.06 3k1w h LYS 322 Cb 0.39 0.22 -0.39 0.00 -0.60 0.00 0.00 32.23 31.85 3k1w h LYS 322 CO -0.23 1.27 -0.75 -0.06 -3.45 0.00 0.00 179.45 176.23 3k1w s PHE 323 N -2.63 2.75 0.11 1.91 0.08 -0.40 -1.15 117.98 118.65 3k1w s PHE 323 Ca -0.06 -2.24 -0.35 0.00 0.12 0.00 0.00 56.93 54.40 3k1w s PHE 323 Cb 0.06 -2.13 -0.17 0.00 -0.57 0.00 0.00 43.02 40.21 3k1w s PHE 323 CO 0.90 -0.87 1.17 0.98 -0.10 0.00 0.00 175.22 177.30 3k1w n TYR 324 N 4.55 1.16 -4.56 0.36 4.19 0.49 -4.41 117.16 118.94 3k1w n TYR 324 Ca -0.03 0.75 -0.30 0.00 3.31 0.00 0.00 57.90 61.63 3k1w n TYR 324 Cb 0.43 -2.25 -0.17 0.00 0.49 0.00 0.00 39.34 37.84 3k1w n TYR 324 CO 0.00 0.00 0.00 0.99 0.91 0.00 0.00 176.86 178.76 3k1w s THR 325 N 0.04 1.66 -0.19 2.97 2.01 -0.78 -1.35 115.64 120.00 3k1w s THR 325 Ca 0.80 -0.74 -0.05 0.00 0.31 0.00 0.00 61.69 62.01 3k1w s THR 325 Cb -0.97 -1.50 -0.02 0.00 0.01 0.00 0.00 72.50 70.02 3k1w s THR 325 CO 0.51 0.47 -0.01 -0.70 -0.69 0.00 0.00 174.62 174.20 3k1w s GLU 326 N 0.89 3.62 -0.35 4.92 2.12 0.21 -0.37 118.70 129.74 3k1w s GLU 326 Ca -0.08 -0.53 -0.11 0.00 0.36 0.00 0.00 54.97 54.61 3k1w s GLU 326 Cb -0.15 -3.03 0.01 0.00 0.26 0.00 0.00 34.13 31.22 3k1w s GLU 326 CO -0.01 0.07 0.20 -0.06 -0.54 0.00 0.00 175.26 174.92 3k1w s PHE 327 N 0.85 3.22 -0.45 5.30 0.08 0.11 -0.57 117.98 126.51 3k1w s PHE 327 Ca 0.00 -0.65 -0.08 0.00 0.12 0.00 0.00 56.93 56.31 3k1w s PHE 327 Cb -0.14 -2.43 0.11 0.00 -0.57 0.00 0.00 43.02 39.98 3k1w s PHE 327 CO 0.02 -0.52 0.30 0.34 -0.10 0.00 0.00 175.22 175.25 3k1w s ASP 328 N 1.62 5.61 0.18 1.36 -1.08 -0.09 -1.27 116.67 123.00 3k1w s ASP 328 Ca 0.04 -1.80 0.02 0.00 -0.52 0.00 0.00 52.55 50.29 3k1w s ASP 328 Cb -0.18 -1.98 0.05 0.00 -1.46 0.00 0.00 42.92 39.35 3k1w s ASP 328 CO 0.07 -0.62 1.42 0.03 0.52 0.00 0.00 175.17 176.59 3k1w h ARG 329 N 8.38 0.25 -0.90 4.34 2.47 -1.43 -1.24 114.38 126.25 3k1w h ARG 329 Ca -0.21 -0.24 0.04 0.00 -1.26 0.00 0.00 59.98 58.32 3k1w h ARG 329 Cb 1.07 0.06 -0.06 0.00 -1.65 0.00 0.00 29.97 29.40 3k1w h ARG 329 CO 0.81 0.93 0.58 -0.09 0.56 0.00 0.00 179.97 182.76 3k1w h ARG 330 N 0.15 1.09 -0.11 0.04 9.65 -1.88 -3.17 114.38 120.15 3k1w h ARG 330 Ca -0.04 -0.07 0.00 0.00 -1.10 0.00 0.00 59.98 58.78 3k1w h ARG 330 Cb 1.40 -0.25 0.00 0.00 -1.39 0.00 0.00 29.97 29.74 3k1w h ARG 330 CO 0.13 0.72 0.00 0.09 2.80 0.00 0.00 179.97 183.71 3k1w n ASN 331 N -4.53 2.10 -3.69 -3.80 5.03 -1.24 -5.02 115.26 104.11 3k1w n ASN 331 Ca 0.12 -1.61 -0.29 0.00 0.87 0.00 0.00 54.58 53.67 3k1w n ASN 331 Cb 0.11 -0.07 0.03 0.00 -1.02 0.00 0.00 39.78 38.82 3k1w n ASN 331 CO 0.00 0.00 0.00 0.59 -1.83 0.00 0.00 177.26 176.02 3k1w n ASN 332 N 0.39 -5.36 -3.79 6.41 3.02 -0.53 -4.86 115.26 110.55 3k1w n ASN 332 Ca 0.06 -0.94 -0.09 0.00 -0.03 0.00 0.00 54.58 53.58 3k1w n ASN 332 Cb 0.28 -2.99 -0.04 0.00 -0.61 0.00 0.00 39.78 36.42 3k1w n ASN 332 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k1w s ARG 333 N -5.64 1.40 -0.06 3.52 1.70 -0.84 -1.31 118.95 117.73 3k1w s ARG 333 Ca 0.33 -0.93 0.04 0.00 -0.47 0.00 0.00 55.73 54.70 3k1w s ARG 333 Cb -0.13 0.51 -0.00 0.00 -0.57 0.00 0.00 34.95 34.76 3k1w s ARG 333 CO 0.87 -0.59 -0.20 0.42 -1.08 0.00 0.00 175.30 174.73 3k1w s ILE 334 N -3.90 1.66 0.06 4.99 1.01 -0.10 -0.91 121.20 124.01 3k1w s ILE 334 Ca 0.11 -0.83 0.06 0.00 0.00 0.00 0.00 60.65 59.99 3k1w s ILE 334 Cb -0.01 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 40.99 3k1w s ILE 334 CO -0.01 0.47 -0.13 -0.83 0.00 0.00 0.00 174.94 174.45 3k1w s GLY 335 N 0.12 1.70 0.02 6.18 0.00 0.26 -0.62 107.32 114.98 3k1w s GLY 335 Ca -0.08 -1.18 0.06 0.00 0.00 0.00 0.00 44.72 43.52 3k1w s GLY 335 CO 0.04 -1.10 -0.18 -1.36 0.00 0.00 0.00 173.10 170.50 3k1w s PHE 336 N -1.06 1.61 0.02 1.90 0.08 0.10 -0.62 117.98 120.01 3k1w s PHE 336 Ca 0.18 -0.34 -0.00 0.00 0.12 0.00 0.00 56.93 56.89 3k1w s PHE 336 Cb -0.11 -1.00 -0.02 0.00 -0.57 0.00 0.00 43.02 41.33 3k1w s PHE 336 CO 0.09 0.03 -0.02 0.00 -0.10 0.00 0.00 175.22 175.22 3k1w s ALA 337 N -0.63 0.09 0.19 5.36 0.00 -0.46 -1.96 121.76 124.35 3k1w s ALA 337 Ca 0.06 -0.53 -0.32 0.00 0.00 0.00 0.00 51.96 51.17 3k1w s ALA 337 Cb -0.08 0.14 -0.12 0.00 0.00 0.00 0.00 23.12 23.06 3k1w s ALA 337 CO 0.01 -0.16 1.74 -0.11 0.00 0.00 0.00 175.76 177.24 3k1w n LEU 338 N 1.66 3.99 -4.79 0.00 7.94 -1.25 -0.38 117.00 124.16 3k1w n LEU 338 Ca -0.23 1.05 -0.35 0.00 -1.11 0.00 0.00 56.01 55.37 3k1w n LEU 338 Cb 0.55 -1.57 -0.03 0.00 0.53 0.00 0.00 43.42 42.91 3k1w n LEU 338 CO 0.20 0.17 0.74 0.00 -1.11 0.00 0.00 177.39 177.39 3k1w s ALA 339 N 1.47 2.85 -0.22 1.96 0.00 -0.30 -0.88 121.76 126.63 3k1w s ALA 339 Ca 0.77 0.68 -0.05 0.00 0.00 0.00 0.00 51.96 53.36 3k1w s ALA 339 Cb -0.51 -3.29 -0.02 0.00 0.00 0.00 0.00 23.12 19.31 3k1w s ALA 339 CO 0.33 -0.43 -0.00 0.50 0.00 0.00 0.00 175.76 176.16 3k1w s ARG 340 N -3.16 3.51 0.00 0.00 3.52 -0.18 -4.71 118.95 117.93 3k1w s ARG 340 Ca 0.68 -0.56 0.13 0.00 -0.13 0.00 0.00 55.73 55.85 3k1w s ARG 340 Cb -0.19 -3.10 0.11 0.00 -1.56 0.00 0.00 34.95 30.20 3k1w s ARG 340 CO 0.23 -0.13 0.93 0.72 -0.81 0.00 0.00 175.30 176.23