#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k1w n ASN 5 N 0.00 2.94 -4.63 1.61 5.15 -1.08 -3.75 115.26 115.49 3k1w n ASN 5 Ca 0.00 -3.09 -0.35 0.00 -0.60 0.00 0.00 54.58 50.55 3k1w n ASN 5 Cb 0.00 -0.48 -0.10 0.00 -0.53 0.00 0.00 39.78 38.67 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 -4.20 4.18 0.08 -0.44 2.01 -0.39 -4.74 115.64 112.14 3k1w s THR 6 Ca 0.37 -0.29 0.09 0.00 0.31 0.00 0.00 61.69 62.17 3k1w s THR 6 Cb 0.42 -2.77 -0.03 0.00 0.01 0.00 0.00 72.50 70.13 3k1w s THR 6 CO -0.05 0.58 -0.24 0.42 -0.69 0.00 0.00 174.62 174.64 3k1w s THR 7 N -0.61 1.99 -0.07 -0.82 -4.23 -1.26 -0.85 115.64 109.80 3k1w s THR 7 Ca 0.10 -1.49 0.03 0.00 -1.18 0.00 0.00 61.69 59.15 3k1w s THR 7 Cb -0.12 -1.75 0.00 0.00 1.34 0.00 0.00 72.50 71.98 3k1w s THR 7 CO 0.02 0.17 -0.17 -0.55 -0.54 0.00 0.00 174.62 173.55 3k1w s SER 8 N -1.59 2.23 0.10 3.99 0.15 -0.09 -4.87 113.70 113.62 3k1w s SER 8 Ca 0.10 -0.38 0.09 0.00 0.70 0.00 0.00 55.95 56.47 3k1w s SER 8 Cb -0.10 -0.91 -0.04 0.00 -1.71 0.00 0.00 66.02 63.26 3k1w s SER 8 CO 0.04 0.10 -0.23 -0.94 1.20 0.00 0.00 173.24 173.41 3k1w s SER 9 N 0.40 3.53 -0.07 5.45 1.04 -1.26 0.76 113.70 123.54 3k1w s SER 9 Ca -0.13 -0.61 0.01 0.00 0.48 0.00 0.00 55.95 55.70 3k1w s SER 9 Cb -0.15 -0.39 0.02 0.00 0.10 0.00 0.00 66.02 65.60 3k1w s SER 9 CO 0.05 0.21 -0.07 -0.69 0.98 0.00 0.00 173.24 173.71 3k1w s VAL 10 N -1.02 0.84 0.17 5.02 1.01 -0.01 -4.59 120.40 121.83 3k1w s VAL 10 Ca 0.15 -0.26 -0.30 0.00 0.00 0.00 0.00 61.98 61.57 3k1w s VAL 10 Cb -0.10 -0.84 -0.08 0.00 0.00 0.00 0.00 36.38 35.36 3k1w s VAL 10 CO 0.06 0.31 1.25 -0.63 0.00 0.00 0.00 175.10 176.09 3k1w s ILE 11 N 1.12 3.50 0.13 2.22 -1.09 -1.26 -1.38 121.20 124.44 3k1w s ILE 11 Ca -0.07 1.21 0.06 0.00 -2.23 0.00 0.00 60.65 59.62 3k1w s ILE 11 Cb -0.14 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.93 3k1w s ILE 11 CO -0.01 0.17 0.00 -0.76 -1.23 0.00 0.00 174.94 173.11 3k1w s LEU 12 N 0.10 3.39 -0.15 2.97 1.43 0.16 -4.40 118.68 122.17 3k1w s LEU 12 Ca 0.56 -0.27 -0.08 0.00 -1.03 0.00 0.00 54.13 53.31 3k1w s LEU 12 Cb -0.34 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.75 3k1w s LEU 12 CO 0.35 0.14 0.12 -0.89 0.23 0.00 0.00 176.35 176.30 3k1w s THR 13 N -1.49 5.32 -0.42 5.49 2.01 0.10 -1.97 115.64 124.68 3k1w s THR 13 Ca 0.26 0.14 -0.16 0.00 0.31 0.00 0.00 61.69 62.25 3k1w s THR 13 Cb -0.11 -3.35 0.02 0.00 0.01 0.00 0.00 72.50 69.07 3k1w s THR 13 CO 0.18 0.55 0.38 0.21 -0.69 0.00 0.00 174.62 175.24 3k1w s ASN 14 N -0.43 6.15 -0.45 3.53 2.47 -1.26 -1.77 114.94 123.18 3k1w s ASN 14 Ca 0.11 -0.81 -0.18 0.00 0.42 0.00 0.00 52.86 52.40 3k1w s ASN 14 Cb -0.12 -2.19 0.03 0.00 -1.45 0.00 0.00 41.25 37.52 3k1w s ASN 14 CO 0.02 -0.53 0.50 -0.47 -3.72 0.00 0.00 177.10 172.90 3k1w s TYR 15 N 1.91 3.13 -1.39 0.43 5.04 0.30 -4.67 117.35 122.11 3k1w s TYR 15 Ca 0.08 -0.42 0.00 0.00 -2.44 0.00 0.00 57.07 54.30 3k1w s TYR 15 Cb -0.18 -3.12 0.00 0.00 0.35 0.00 0.00 41.96 39.00 3k1w s TYR 15 CO 0.12 -0.81 0.00 -1.33 -1.34 0.00 0.00 175.55 172.19 3k1w n MET 16 N 5.79 -1.94 -0.99 4.97 2.81 -1.26 -1.38 117.12 125.12 3k1w n MET 16 Ca -0.07 0.79 0.00 0.00 -1.81 0.00 0.00 57.70 56.61 3k1w n MET 16 Cb 0.47 -5.39 0.00 0.00 -0.71 0.00 0.00 33.22 27.59 3k1w n MET 16 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 3k1w n ASP 17 N -1.80 -5.05 0.00 7.83 8.00 -1.24 -4.78 116.55 119.51 3k1w n ASP 17 Ca -0.19 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.31 3k1w n ASP 17 Cb 0.63 -2.71 0.00 0.00 -0.02 0.00 0.00 41.12 39.02 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 -2.24 0.00 -4.02 -3.53 -2.24 -0.48 -4.82 114.28 96.95 3k1w n THR 18 Ca 0.00 -0.12 -0.20 0.00 -2.27 0.00 0.00 64.05 61.46 3k1w n THR 18 Cb 0.36 0.58 -0.17 0.00 -2.10 0.00 0.00 70.33 69.01 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 -1.45 0.69 -0.13 -0.78 -0.21 -0.89 -4.33 119.66 112.56 3k1w s GLN 19 Ca 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 55.36 55.36 3k1w s GLN 19 Cb 0.00 -0.82 0.02 0.00 1.00 0.00 0.00 33.01 33.21 3k1w s GLN 19 CO 0.00 -0.15 -0.12 0.71 -2.12 0.00 0.00 175.29 173.61 3k1w s TYR 20 N 1.20 1.92 0.05 0.91 2.02 -1.26 -0.54 117.35 121.66 3k1w s TYR 20 Ca -0.07 -1.02 -0.04 0.00 -0.37 0.00 0.00 57.07 55.57 3k1w s TYR 20 Cb -0.14 -1.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.95 3k1w s TYR 20 CO -0.02 -0.59 0.07 1.52 -1.57 0.00 0.00 175.55 174.97 3k1w s TYR 21 N 1.45 0.31 0.32 2.71 1.13 -0.73 -4.38 117.35 118.16 3k1w s TYR 21 Ca 0.03 -0.73 -0.04 0.00 -1.41 0.00 0.00 57.07 54.91 3k1w s TYR 21 Cb -0.13 -0.21 0.00 0.00 -1.10 0.00 0.00 41.96 40.51 3k1w s TYR 21 CO -0.08 -0.41 0.46 0.20 -2.51 0.00 0.00 175.55 173.21 3k1w s GLY 22 N -2.58 1.31 0.09 5.49 0.00 -0.35 0.01 107.32 111.28 3k1w s GLY 22 Ca 0.02 -1.41 -0.11 0.00 0.00 0.00 0.00 44.72 43.21 3k1w s GLY 22 CO -0.08 -0.95 0.43 1.85 0.00 0.00 0.00 173.10 174.36 3k1w s GLU 23 N -3.26 3.83 0.25 2.90 2.12 -1.26 -0.33 118.70 122.94 3k1w s GLU 23 Ca 0.29 0.27 0.05 0.00 0.36 0.00 0.00 54.97 55.95 3k1w s GLU 23 Cb -0.00 -3.00 -0.05 0.00 0.26 0.00 0.00 34.13 31.33 3k1w s GLU 23 CO 0.18 0.56 -0.05 0.96 -0.54 0.00 0.00 175.26 176.37 3k1w s ILE 24 N -1.38 1.40 -0.04 -3.70 -4.36 -0.40 -4.61 121.20 108.11 3k1w s ILE 24 Ca 0.33 -2.09 0.06 0.00 -0.26 0.00 0.00 60.65 58.69 3k1w s ILE 24 Cb -0.14 -2.35 -0.01 0.00 1.25 0.00 0.00 42.46 41.20 3k1w s ILE 24 CO 0.18 -0.35 -0.23 -0.83 0.24 0.00 0.00 174.94 173.94 3k1w s GLY 25 N -3.37 1.17 -0.09 6.27 0.00 -0.67 -1.06 107.32 109.57 3k1w s GLY 25 Ca 0.28 -0.97 0.03 0.00 0.00 0.00 0.00 44.72 44.05 3k1w s GLY 25 CO 0.10 -0.69 -0.17 -0.42 0.00 0.00 0.00 173.10 171.91 3k1w s ILE 26 N -0.32 1.56 0.00 0.90 1.01 0.68 -0.52 121.20 124.50 3k1w s ILE 26 Ca 0.02 -0.72 0.00 0.00 0.00 0.00 0.00 60.65 59.96 3k1w s ILE 26 Cb -0.11 -1.38 0.00 0.00 0.01 0.00 0.00 42.46 40.97 3k1w s ILE 26 CO 0.01 0.45 0.00 0.61 0.00 0.00 0.00 174.94 176.01 3k1w n GLY 27 N 3.76 0.53 2.85 6.18 0.00 0.02 -0.41 105.19 118.13 3k1w n GLY 27 Ca -0.21 -2.09 -0.28 0.00 0.00 0.00 0.00 46.02 43.44 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 -1.15 0.98 0.92 2.61 2.01 -1.26 -2.34 115.64 117.41 3k1w s THR 28 Ca 0.00 -0.66 -0.12 0.00 0.31 0.00 0.00 61.69 61.22 3k1w s THR 28 Cb 0.00 -1.26 0.14 0.00 0.01 0.00 0.00 72.50 71.40 3k1w s THR 28 CO 0.00 0.01 1.09 -2.16 -0.69 0.00 0.00 174.62 172.88 3k1w s PRO 29 N 1.67 1.05 0.21 4.92 0.04 -1.26 -1.30 135.00 140.33 3k1w s PRO 29 Ca -0.01 0.74 -0.31 0.00 0.04 0.00 0.00 61.00 61.47 3k1w s PRO 29 Cb -0.16 -1.79 -0.10 0.00 0.04 0.00 0.00 34.50 32.49 3k1w s PRO 29 CO -0.07 -2.36 1.45 -1.25 0.04 0.00 0.00 177.00 174.81 3k1w s PRO 30 N -4.94 4.27 -0.26 0.56 0.04 -0.99 -4.91 135.00 128.78 3k1w s PRO 30 Ca 0.64 2.27 -0.11 0.00 0.04 0.00 0.00 61.00 63.84 3k1w s PRO 30 Cb -0.18 -3.15 -0.05 0.00 0.04 0.00 0.00 34.50 31.16 3k1w s PRO 30 CO 0.57 -0.45 0.18 -0.65 0.04 0.00 0.00 177.00 176.69 3k1w s GLN 31 N 0.22 4.02 0.10 4.56 -0.21 0.46 -4.84 119.66 123.97 3k1w s GLN 31 Ca 0.62 -0.27 -0.06 0.00 0.02 0.00 0.00 55.36 55.67 3k1w s GLN 31 Cb -0.41 -3.59 -0.05 0.00 1.00 0.00 0.00 33.01 29.95 3k1w s GLN 31 CO 0.38 -0.05 0.36 0.95 -2.12 0.00 0.00 175.29 174.80 3k1w s THR 32 N 1.39 5.18 -0.00 -0.19 -4.23 -1.26 -0.23 115.64 116.29 3k1w s THR 32 Ca 0.08 0.16 0.01 0.00 -1.18 0.00 0.00 61.69 60.76 3k1w s THR 32 Cb -0.15 -3.62 0.00 0.00 1.34 0.00 0.00 72.50 70.08 3k1w s THR 32 CO 0.08 0.17 -0.02 -0.36 -0.54 0.00 0.00 174.62 173.95 3k1w s PHE 33 N -1.51 0.20 -0.03 3.99 0.08 -0.22 -4.98 117.98 115.51 3k1w s PHE 33 Ca 0.36 -0.03 -0.28 0.00 0.12 0.00 0.00 56.93 57.10 3k1w s PHE 33 Cb -0.13 -0.15 -0.03 0.00 -0.57 0.00 0.00 43.02 42.14 3k1w s PHE 33 CO 0.21 -0.02 0.90 0.15 -0.10 0.00 0.00 175.22 176.36 3k1w s LYS 34 N 0.07 4.51 0.02 0.44 1.02 -1.26 -1.28 119.74 123.26 3k1w s LYS 34 Ca -0.00 1.26 0.01 0.00 0.02 0.00 0.00 55.97 57.25 3k1w s LYS 34 Cb -0.02 -3.46 -0.02 0.00 -0.52 0.00 0.00 37.83 33.81 3k1w s LYS 34 CO -0.00 -0.03 -0.04 0.14 -0.92 0.00 0.00 175.35 174.49 3k1w s VAL 35 N 1.01 0.25 0.00 3.17 -7.23 0.55 0.27 120.40 118.43 3k1w s VAL 35 Ca 0.47 -0.76 -0.28 0.00 -1.81 0.00 0.00 61.98 59.60 3k1w s VAL 35 Cb -0.20 -0.34 -0.04 0.00 0.56 0.00 0.00 36.38 36.37 3k1w s VAL 35 CO 0.24 -0.34 0.87 -0.69 -0.31 0.00 0.00 175.10 174.88 3k1w s VAL 36 N -1.10 4.85 -0.35 1.32 1.01 -0.88 -1.22 120.40 124.03 3k1w s VAL 36 Ca -0.10 1.84 -0.18 0.00 0.00 0.00 0.00 61.98 63.54 3k1w s VAL 36 Cb -0.08 -4.22 -0.00 0.00 0.00 0.00 0.00 36.38 32.08 3k1w s VAL 36 CO -0.00 0.23 0.49 -0.36 0.00 0.00 0.00 175.10 175.46 3k1w s PHE 37 N 0.68 3.18 -0.28 5.22 0.40 -1.26 -0.50 117.98 125.42 3k1w s PHE 37 Ca 0.46 0.14 0.03 0.00 -0.60 0.00 0.00 56.93 56.95 3k1w s PHE 37 Cb -0.20 -2.89 0.08 0.00 0.51 0.00 0.00 43.02 40.52 3k1w s PHE 37 CO 0.25 -0.53 -0.04 0.34 0.70 0.00 0.00 175.22 175.95 3k1w s ASP 38 N 1.76 4.43 0.00 1.36 2.15 -0.03 -4.26 116.67 122.08 3k1w s ASP 38 Ca 0.18 -1.63 0.17 0.00 0.43 0.00 0.00 52.55 51.70 3k1w s ASP 38 Cb -0.16 -1.48 0.75 0.00 -0.30 0.00 0.00 42.92 41.74 3k1w s ASP 38 CO 0.13 -0.27 1.56 0.35 -0.17 0.00 0.00 175.17 176.77 3k1w n THR 39 N 4.43 0.79 0.50 1.71 -2.24 -1.26 -0.21 114.28 118.00 3k1w n THR 39 Ca -0.07 0.20 0.07 0.00 -2.27 0.00 0.00 64.05 61.98 3k1w n THR 39 Cb 0.42 -0.90 0.20 0.00 -2.10 0.00 0.00 70.33 67.96 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 0.30 1.22 3.60 3.38 0.00 -1.26 -4.09 105.19 108.34 3k1w n GLY 40 Ca 0.04 -0.50 -0.10 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.96 0.04 0.00 1.61 1.04 -1.13 -5.01 113.70 109.28 3k1w s SER 41 Ca 0.31 -1.00 0.00 0.00 0.48 0.00 0.00 55.95 55.73 3k1w s SER 41 Cb 0.17 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.90 3k1w s SER 41 CO 0.20 -1.20 0.31 -1.20 0.98 0.00 0.00 173.24 172.33 3k1w n SER 42 N -0.58 0.60 -4.69 7.02 7.64 -1.26 -0.51 113.62 121.84 3k1w n SER 42 Ca -0.02 -1.02 -0.25 0.00 1.01 0.00 0.00 58.87 58.59 3k1w n SER 42 Cb 0.62 0.00 -0.07 0.00 -1.01 0.00 0.00 64.21 63.75 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 -0.02 4.88 -0.21 6.43 -0.87 -1.26 -4.44 114.94 119.45 3k1w s ASN 43 Ca 0.00 -0.41 -0.11 0.00 -1.57 0.00 0.00 52.86 50.77 3k1w s ASN 43 Cb 0.00 -1.06 -0.05 0.00 -0.02 0.00 0.00 41.25 40.12 3k1w s ASN 43 CO 0.00 0.05 0.17 -0.69 -2.57 0.00 0.00 177.10 174.05 3k1w s VAL 44 N -1.93 5.37 -0.04 1.60 1.01 -1.26 -0.75 120.40 124.41 3k1w s VAL 44 Ca 0.29 0.24 0.03 0.00 0.00 0.00 0.00 61.98 62.54 3k1w s VAL 44 Cb -0.08 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 32.79 3k1w s VAL 44 CO 0.20 0.39 -0.13 0.26 0.00 0.00 0.00 175.10 175.82 3k1w s TRP 45 N 0.68 1.40 0.07 5.22 0.52 -0.19 -0.50 118.94 126.15 3k1w s TRP 45 Ca 0.09 -0.41 0.02 0.00 0.02 0.00 0.00 56.10 55.82 3k1w s TRP 45 Cb -0.12 -0.98 -0.03 0.00 -1.15 0.00 0.00 33.47 31.19 3k1w s TRP 45 CO 0.01 -0.16 -0.07 0.14 0.02 0.00 0.00 176.95 176.89 3k1w s VAL 46 N 0.21 0.61 0.41 4.03 -7.23 -0.57 -1.12 120.40 116.75 3k1w s VAL 46 Ca -0.06 -1.48 -0.25 0.00 -1.81 0.00 0.00 61.98 58.38 3k1w s VAL 46 Cb -0.11 -1.11 -0.08 0.00 0.56 0.00 0.00 36.38 35.63 3k1w s VAL 46 CO 0.02 -0.62 1.26 -2.84 -0.31 0.00 0.00 175.10 172.61 3k1w s PRO 47 N -2.64 3.94 0.29 4.82 0.02 -1.26 -0.91 135.00 139.26 3k1w s PRO 47 Ca 0.00 2.04 -0.15 0.00 0.02 0.00 0.00 61.00 62.92 3k1w s PRO 47 Cb -0.03 -2.69 -0.09 0.00 0.02 0.00 0.00 34.50 31.72 3k1w s PRO 47 CO -0.02 -0.48 0.70 0.45 -0.33 0.00 0.00 177.00 177.33 3k1w s SER 48 N -0.90 6.80 0.44 2.53 0.15 0.36 -0.47 113.70 122.61 3k1w s SER 48 Ca 0.58 1.25 0.30 0.00 0.70 0.00 0.00 55.95 58.78 3k1w s SER 48 Cb -0.35 -2.36 1.56 0.00 -1.71 0.00 0.00 66.02 63.16 3k1w s SER 48 CO 0.45 -0.14 1.92 0.77 1.20 0.00 0.00 173.24 177.44 3k1w h SER 49 N 2.51 0.00 0.25 5.45 4.64 -1.32 -0.60 113.55 124.49 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 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3k1w h SER 49 CO 0.66 0.00 -0.05 0.29 -0.87 0.00 0.00 176.83 176.86 3k1w n LYS 50 N -2.58 0.84 -2.26 4.77 4.01 -1.26 -4.82 118.16 116.85 3k1w n LYS 50 Ca -0.01 -0.20 -0.42 0.00 -0.51 0.00 0.00 58.31 57.16 3k1w n LYS 50 Cb 0.09 -1.50 -0.03 0.00 -0.51 0.00 0.00 35.03 33.09 3k1w n LYS 50 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3k1w n SER 52 N 6.08 1.56 0.00 0.00 2.88 -1.26 -4.84 113.62 118.03 3k1w n SER 52 Ca 0.14 1.08 0.07 0.00 -1.33 0.00 0.00 58.87 58.83 3k1w n SER 52 Cb 0.44 -1.37 0.36 0.00 -0.75 0.00 0.00 64.21 62.89 3k1w n SER 52 CO 0.00 0.00 0.00 -2.11 -1.23 0.00 0.00 175.04 171.70 3k1w n ARG 53 N 0.26 0.16 -0.24 -1.46 1.85 -1.26 -1.88 116.66 114.10 3k1w n ARG 53 Ca 0.09 0.17 0.03 0.00 -1.00 0.00 0.00 57.85 57.14 3k1w n ARG 53 Cb 0.38 -1.50 0.13 0.00 -1.05 0.00 0.00 32.46 30.42 3k1w n ARG 53 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 3k1w n LEU 54 N -1.34 2.13 -4.31 2.89 4.32 -1.26 -4.64 117.00 114.78 3k1w n LEU 54 Ca 0.06 -1.07 -0.37 0.00 -0.02 0.00 0.00 56.01 54.61 3k1w n LEU 54 Cb 0.13 -0.38 -0.13 0.00 -1.62 0.00 0.00 43.42 41.42 3k1w n LEU 54 CO 0.12 0.38 -0.29 -0.31 -1.22 0.00 0.00 177.39 176.06 3k1w s TYR 55 N -1.64 3.15 0.44 -1.77 2.02 -0.79 -4.98 117.35 113.78 3k1w s TYR 55 Ca 0.19 -1.12 0.20 0.00 -0.37 0.00 0.00 57.07 55.97 3k1w s TYR 55 Cb 0.12 -2.22 1.21 0.00 -0.40 0.00 0.00 41.96 40.67 3k1w s TYR 55 CO 0.09 -0.62 2.03 1.79 -1.57 0.00 0.00 175.55 177.27 3k1w h THR 56 N 5.95 0.88 0.00 -0.71 1.35 -1.89 -0.11 112.91 118.38 3k1w h THR 56 Ca -0.31 -0.57 0.00 0.00 -0.55 0.00 0.00 66.41 64.98 3k1w h THR 56 Cb 1.12 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 68.87 3k1w h THR 56 CO 0.60 0.15 0.00 0.00 -0.25 0.00 0.00 175.52 176.02 3k1w h ALA 57 N 1.85 1.00 0.00 6.62 0.00 -1.83 -3.16 119.26 123.74 3k1w h ALA 57 Ca -0.00 0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.63 3k1w h ALA 57 Cb 0.32 0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.06 3k1w h ALA 57 CO 0.02 0.00 -2.07 0.00 0.00 0.00 0.00 179.25 177.20 3k1w h VAL 59 N 0.00 0.93 -0.64 0.00 3.04 -1.03 -1.74 116.25 116.82 3k1w h VAL 59 Ca -0.42 -0.22 0.00 0.00 -1.01 0.00 0.00 66.70 65.05 3k1w h VAL 59 Cb 1.78 0.23 0.00 0.00 -2.01 0.00 0.00 31.29 31.29 3k1w h VAL 59 CO -0.03 0.12 0.00 -1.22 -1.01 0.00 0.00 177.57 175.43 3k1w n TYR 60 N -4.50 0.85 -4.20 3.17 0.53 -1.25 -4.94 117.16 106.82 3k1w n TYR 60 Ca 0.12 -0.44 -0.24 0.00 -1.02 0.00 0.00 57.90 56.32 3k1w n TYR 60 Cb 0.34 -0.00 -0.07 0.00 -1.03 0.00 0.00 39.34 38.58 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 -1.11 2.62 0.41 -0.72 3.76 -0.65 -5.08 115.29 114.52 3k1w s HIS 61 Ca 0.46 -0.46 -0.24 0.00 -0.15 0.00 0.00 55.06 54.67 3k1w s HIS 61 Cb 0.24 -1.66 -0.08 0.00 1.11 0.00 0.00 32.58 32.19 3k1w s HIS 61 CO 0.32 0.36 1.11 0.15 -0.85 0.00 0.00 174.74 175.83 3k1w s LYS 62 N -3.81 4.04 -0.07 1.40 -0.14 -1.26 -5.00 119.74 114.90 3k1w s LYS 62 Ca 0.37 1.66 0.06 0.00 -1.36 0.00 0.00 55.97 56.70 3k1w s LYS 62 Cb 0.00 -2.55 -0.01 0.00 -1.68 0.00 0.00 37.83 33.60 3k1w s LYS 62 CO 0.21 -0.28 -0.24 -0.51 -0.76 0.00 0.00 175.35 173.77 3k1w s LEU 63 N -2.69 2.06 -0.06 3.17 1.43 -1.26 -4.33 118.68 117.01 3k1w s LEU 63 Ca 0.59 -0.51 -0.30 0.00 -1.03 0.00 0.00 54.13 52.88 3k1w s LEU 63 Cb -0.26 -1.35 -0.03 0.00 0.03 0.00 0.00 46.19 44.58 3k1w s LEU 63 CO 0.32 0.22 1.11 0.12 0.23 0.00 0.00 176.35 178.35 3k1w s PHE 64 N -0.05 3.37 -0.35 0.29 5.36 0.38 -4.66 117.98 122.32 3k1w s PHE 64 Ca -0.07 1.40 -0.02 0.00 -0.96 0.00 0.00 56.93 57.28 3k1w s PHE 64 Cb -0.14 -3.31 0.07 0.00 -0.34 0.00 0.00 43.02 39.30 3k1w s PHE 64 CO 0.05 -0.81 0.09 0.34 -1.46 0.00 0.00 175.22 173.42 3k1w s ASP 65 N 1.26 5.06 0.43 6.13 -1.08 -1.26 -0.97 116.67 126.24 3k1w s ASP 65 Ca 0.53 -1.60 0.11 0.00 -0.52 0.00 0.00 52.55 51.08 3k1w s ASP 65 Cb -0.23 -1.76 0.92 0.00 -1.46 0.00 0.00 42.92 40.39 3k1w s ASP 65 CO 0.22 -0.38 1.99 0.00 0.52 0.00 0.00 175.17 177.52 3k1w h ALA 66 N 8.02 1.66 0.00 3.66 0.00 -1.95 -1.39 119.26 129.26 3k1w h ALA 66 Ca -0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3k1w h ALA 66 Cb 1.06 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.78 3k1w h ALA 66 CO 0.60 0.25 0.00 0.43 0.00 0.00 0.00 179.25 180.53 3k1w n SER 67 N -4.36 0.00 -0.83 0.00 7.64 -1.26 -1.54 113.62 113.27 3k1w n SER 67 Ca -0.01 0.47 0.09 0.00 1.01 0.00 0.00 58.87 60.43 3k1w n SER 67 Cb 0.21 -0.48 0.14 0.00 -1.01 0.00 0.00 64.21 63.06 3k1w n SER 67 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3k1w n ASP 68 N -1.48 2.86 -4.19 6.43 8.00 -0.52 -4.95 116.55 122.70 3k1w n ASP 68 Ca 0.02 -1.84 -0.34 0.00 0.71 0.00 0.00 54.79 53.35 3k1w n ASP 68 Cb 0.10 -0.14 -0.15 0.00 -0.02 0.00 0.00 41.12 40.90 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 -1.30 3.57 0.26 -2.24 0.15 -0.59 -4.23 113.70 109.32 3k1w s SER 69 Ca 0.27 -0.55 0.25 0.00 0.70 0.00 0.00 55.95 56.62 3k1w s SER 69 Cb 0.17 -1.58 0.88 0.00 -1.71 0.00 0.00 66.02 63.78 3k1w s SER 69 CO 0.23 -0.00 1.75 0.77 1.20 0.00 0.00 173.24 177.19 3k1w h SER 70 N 7.98 0.00 -0.02 5.45 4.64 -1.48 -3.22 113.55 126.90 3k1w h SER 70 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 3k1w h SER 70 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3k1w h SER 70 CO 0.62 0.00 -0.34 -1.54 -0.87 0.00 0.00 176.83 174.71 3k1w n SER 71 N -2.36 2.25 -4.78 4.97 3.41 -1.26 -4.98 113.62 110.87 3k1w n SER 71 Ca 0.04 -1.62 -0.41 0.00 -0.26 0.00 0.00 58.87 56.62 3k1w n SER 71 Cb 0.35 0.35 -0.00 0.00 -0.26 0.00 0.00 64.21 64.65 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 -2.28 2.61 -0.13 7.33 6.14 -1.22 -4.63 117.35 125.19 3k1w s TYR 72 Ca 0.20 1.21 -0.00 0.00 0.64 0.00 0.00 57.07 59.12 3k1w s TYR 72 Cb 0.18 -3.97 0.03 0.00 0.42 0.00 0.00 41.96 38.62 3k1w s TYR 72 CO 0.48 -2.86 -0.07 0.15 0.64 0.00 0.00 175.55 173.89 3k1w s LYS 73 N -2.13 1.54 0.69 4.97 -0.14 -0.25 -5.02 119.74 119.40 3k1w s LYS 73 Ca 0.54 -0.32 -0.16 0.00 -1.36 0.00 0.00 55.97 54.67 3k1w s LYS 73 Cb -0.45 -1.69 0.02 0.00 -1.68 0.00 0.00 37.83 34.02 3k1w s LYS 73 CO 0.61 -0.30 1.19 -3.38 -0.76 0.00 0.00 175.35 172.71 3k1w s HIS 74 N 1.68 2.22 0.06 3.18 -3.43 -1.26 -1.55 115.29 116.20 3k1w s HIS 74 Ca 0.04 1.58 0.00 0.00 -0.80 0.00 0.00 55.06 55.88 3k1w s HIS 74 Cb -0.13 -3.41 0.00 0.00 -1.43 0.00 0.00 32.58 27.61 3k1w s HIS 74 CO -0.08 -2.35 0.00 -1.71 -2.00 0.00 0.00 174.74 168.59 3k1w n ASN 75 N -2.47 -0.02 0.00 7.38 2.85 -1.22 -4.81 115.26 116.98 3k1w n ASN 75 Ca 0.13 0.10 0.00 0.00 -0.11 0.00 0.00 54.58 54.70 3k1w n ASN 75 Cb 0.50 0.08 0.00 0.00 1.24 0.00 0.00 39.78 41.60 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 1.65 0.87 3.66 8.20 0.00 0.76 -4.97 105.19 115.36 3k1w n GLY 76 Ca 0.00 0.00 -0.47 0.00 0.00 0.00 0.00 46.02 45.55 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 0.02 -2.48 2.61 -1.04 -1.26 -4.53 114.28 105.60 3k1w n THR 77 Ca 0.00 -0.00 -0.39 0.00 -2.04 0.00 0.00 64.05 61.61 3k1w n THR 77 Cb 0.00 -1.46 -0.04 0.00 -1.82 0.00 0.00 70.33 67.01 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 0.96 4.47 0.02 -2.82 2.02 -1.26 -0.59 118.70 121.50 3k1w s GLU 78 Ca 0.80 1.73 0.01 0.00 0.02 0.00 0.00 54.97 57.53 3k1w s GLU 78 Cb -0.72 -2.98 -0.01 0.00 0.10 0.00 0.00 34.13 30.52 3k1w s GLU 78 CO 0.39 0.08 -0.04 -0.48 0.02 0.00 0.00 175.26 175.23 3k1w s LEU 79 N -1.83 2.13 -0.00 1.80 2.34 -0.53 -4.90 118.68 117.69 3k1w s LEU 79 Ca 0.49 -0.30 0.00 0.00 0.06 0.00 0.00 54.13 54.38 3k1w s LEU 79 Cb -0.29 -0.08 0.00 0.00 -0.56 0.00 0.00 46.19 45.25 3k1w s LEU 79 CO 0.37 -0.12 -0.00 -0.89 -1.06 0.00 0.00 176.35 174.65 3k1w s THR 80 N -0.78 0.05 -0.14 5.48 2.01 -1.26 -1.20 115.64 119.79 3k1w s THR 80 Ca -0.06 -0.01 0.00 0.00 0.31 0.00 0.00 61.69 61.92 3k1w s THR 80 Cb -0.06 -0.06 0.03 0.00 0.01 0.00 0.00 72.50 72.42 3k1w s THR 80 CO -0.00 0.02 -0.12 -0.22 -0.69 0.00 0.00 174.62 173.61 3k1w s LEU 81 N 0.05 1.59 -1.35 4.42 2.96 0.50 -5.01 118.68 121.84 3k1w s LEU 81 Ca -0.00 -0.48 -0.15 0.00 -0.22 0.00 0.00 54.13 53.28 3k1w s LEU 81 Cb -0.01 -1.08 0.08 0.00 0.50 0.00 0.00 46.19 45.69 3k1w s LEU 81 CO -0.00 -0.09 1.92 0.54 -1.32 0.00 0.00 176.35 177.40 3k1w n ARG 82 N 4.82 3.14 -1.42 1.98 1.74 -1.26 -1.15 116.66 124.51 3k1w n ARG 82 Ca -0.15 -3.11 -0.31 0.00 -0.77 0.00 0.00 57.85 53.51 3k1w n ARG 82 Cb 0.50 -3.28 0.07 0.00 -1.02 0.00 0.00 32.46 28.73 3k1w n ARG 82 CO 0.00 0.00 0.00 -0.47 -1.52 0.00 0.00 177.63 175.64 3k1w s TYR 83 N 2.93 2.85 0.26 -1.55 6.14 -0.82 -4.96 117.35 122.20 3k1w s TYR 83 Ca 0.48 1.48 -0.02 0.00 0.64 0.00 0.00 57.07 59.64 3k1w s TYR 83 Cb 0.08 -2.97 0.50 0.00 0.42 0.00 0.00 41.96 40.00 3k1w s TYR 83 CO -0.01 -1.52 1.76 0.77 0.64 0.00 0.00 175.55 177.19 3k1w h SER 84 N -0.93 0.51 0.07 4.32 0.02 -1.98 -2.35 113.55 113.21 3k1w h SER 84 Ca -0.44 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 60.60 3k1w h SER 84 Cb 1.22 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.77 3k1w h SER 84 CO 0.54 0.23 -0.23 0.35 -1.14 0.00 0.00 176.83 176.58 3k1w n THR 85 N -4.87 0.00 -0.52 -2.27 -2.24 -1.26 -5.03 114.28 98.09 3k1w n THR 85 Ca 0.16 -0.26 0.00 0.00 -2.27 0.00 0.00 64.05 61.69 3k1w n THR 85 Cb 0.41 0.87 0.00 0.00 -2.10 0.00 0.00 70.33 69.50 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 1.33 -1.81 3.74 3.38 0.00 -0.88 -4.87 105.19 106.09 3k1w n GLY 86 Ca 0.13 -1.46 -0.40 0.00 0.00 0.00 0.00 46.02 44.29 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 -1.93 4.67 -0.28 2.61 2.01 -1.26 -1.94 115.64 119.51 3k1w s THR 87 Ca 0.00 1.72 -0.09 0.00 0.31 0.00 0.00 61.69 63.63 3k1w s THR 87 Cb 0.00 -4.16 -0.03 0.00 0.01 0.00 0.00 72.50 68.33 3k1w s THR 87 CO 0.00 0.36 0.14 -0.69 -0.69 0.00 0.00 174.62 173.74 3k1w s VAL 88 N -0.10 4.72 0.10 3.82 1.01 -0.30 -3.87 120.40 125.78 3k1w s VAL 88 Ca 0.40 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.24 3k1w s VAL 88 Cb -0.21 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.83 3k1w s VAL 88 CO 0.24 0.20 -0.08 -0.94 0.00 0.00 0.00 175.10 174.52 3k1w s SER 89 N 1.66 1.33 0.00 3.32 1.04 -0.70 -0.37 113.70 119.97 3k1w s SER 89 Ca 0.06 -0.92 0.00 0.00 0.48 0.00 0.00 55.95 55.57 3k1w s SER 89 Cb -0.16 0.05 0.00 0.00 0.10 0.00 0.00 66.02 66.00 3k1w s SER 89 CO 0.07 -0.36 0.00 0.61 0.98 0.00 0.00 173.24 174.53 3k1w n GLY 90 N 0.21 2.43 3.12 7.32 0.00 -0.34 -1.32 105.19 116.61 3k1w n GLY 90 Ca -0.14 -0.45 -0.08 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.33 0.34 0.15 1.61 -0.12 -0.50 -1.45 117.98 116.67 3k1w s PHE 91 Ca 0.00 -0.78 -0.29 0.00 -0.05 0.00 0.00 56.93 55.81 3k1w s PHE 91 Cb 0.00 -0.23 -0.07 0.00 -0.63 0.00 0.00 43.02 42.08 3k1w s PHE 91 CO 0.00 -0.41 0.90 -0.51 -0.05 0.00 0.00 175.22 175.15 3k1w s LEU 92 N -2.66 4.55 0.05 -1.99 1.43 0.24 -0.59 118.68 119.71 3k1w s LEU 92 Ca 0.03 1.78 -0.03 0.00 -1.03 0.00 0.00 54.13 54.88 3k1w s LEU 92 Cb 0.04 -3.51 -0.02 0.00 0.03 0.00 0.00 46.19 42.73 3k1w s LEU 92 CO -0.09 0.05 0.03 -0.44 0.23 0.00 0.00 176.35 176.14 3k1w s SER 93 N -0.55 0.32 -0.04 2.29 0.01 -0.12 -0.17 113.70 115.45 3k1w s SER 93 Ca 0.42 -0.75 0.06 0.00 1.31 0.00 0.00 55.95 56.99 3k1w s SER 93 Cb -0.24 0.21 -0.01 0.00 0.21 0.00 0.00 66.02 66.19 3k1w s SER 93 CO 0.29 -0.55 -0.23 -1.58 0.41 0.00 0.00 173.24 171.58 3k1w s GLN 94 N -3.18 2.23 0.39 12.44 0.74 -0.59 -0.29 119.66 131.39 3k1w s GLN 94 Ca 0.00 -0.84 -0.14 0.00 0.05 0.00 0.00 55.36 54.43 3k1w s GLN 94 Cb 0.02 -1.96 0.05 0.00 1.10 0.00 0.00 33.01 32.22 3k1w s GLN 94 CO -0.07 0.40 0.77 0.34 -0.55 0.00 0.00 175.29 176.17 3k1w s ASP 95 N -0.24 0.09 -0.03 6.67 -1.08 -0.75 -1.09 116.67 120.23 3k1w s ASP 95 Ca 0.00 -1.19 -0.26 0.00 -0.52 0.00 0.00 52.55 50.58 3k1w s ASP 95 Cb -0.12 0.84 -0.04 0.00 -1.46 0.00 0.00 42.92 42.15 3k1w s ASP 95 CO 0.02 -1.67 0.80 -0.63 0.52 0.00 0.00 175.17 174.20 3k1w s ILE 96 N -2.32 4.94 -0.09 4.11 1.01 -1.26 -0.96 121.20 126.64 3k1w s ILE 96 Ca 0.17 1.66 0.04 0.00 0.00 0.00 0.00 60.65 62.52 3k1w s ILE 96 Cb -0.05 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.29 3k1w s ILE 96 CO 0.12 0.24 -0.22 -0.63 0.00 0.00 0.00 174.94 174.46 3k1w s ILE 97 N 0.73 1.87 -0.16 2.92 1.01 0.51 -0.80 121.20 127.27 3k1w s ILE 97 Ca 0.42 -0.91 -0.06 0.00 0.00 0.00 0.00 60.65 60.10 3k1w s ILE 97 Cb -0.19 -1.62 -0.04 0.00 0.01 0.00 0.00 42.46 40.62 3k1w s ILE 97 CO 0.22 0.52 0.04 0.42 0.00 0.00 0.00 174.94 176.13 3k1w s THR 98 N 0.36 4.57 -0.21 2.92 -4.23 0.32 -0.54 115.64 118.82 3k1w s THR 98 Ca -0.17 -0.12 -0.01 0.00 -1.18 0.00 0.00 61.69 60.21 3k1w s THR 98 Cb -0.17 -3.03 0.06 0.00 1.34 0.00 0.00 72.50 70.70 3k1w s THR 98 CO 0.07 0.50 -0.00 -0.69 -0.54 0.00 0.00 174.62 173.96 3k1w s VAL 99 N 0.12 0.98 0.00 2.29 1.01 -0.04 -1.68 120.40 123.09 3k1w s VAL 99 Ca 0.03 -0.87 0.00 0.00 0.00 0.00 0.00 61.98 61.15 3k1w s VAL 99 Cb -0.13 -1.38 0.00 0.00 0.00 0.00 0.00 36.38 34.87 3k1w s VAL 99 CO 0.01 -0.17 0.00 0.61 0.00 0.00 0.00 175.10 175.56 3k1w n GLY 100 N 4.88 3.20 0.00 4.51 0.00 -1.26 -1.73 105.19 114.79 3k1w n GLY 100 Ca -0.10 0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.11 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 0.00 -1.21 3.81 -0.02 0.00 -1.26 -4.86 105.19 101.65 3k1w n GLY 101 Ca 0.00 -0.12 -0.36 0.00 0.00 0.00 0.00 46.02 45.54 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 -2.67 5.18 -0.13 -0.61 1.01 -0.71 -5.08 121.20 118.19 3k1w s ILE 102 Ca 0.22 0.09 0.02 0.00 0.00 0.00 0.00 60.65 60.97 3k1w s ILE 102 Cb 0.17 -3.25 0.01 0.00 0.01 0.00 0.00 42.46 39.41 3k1w s ILE 102 CO 0.42 0.59 -0.17 -0.89 0.00 0.00 0.00 174.94 174.88 3k1w s THR 103 N -0.80 1.71 -0.02 2.92 2.01 -1.26 -0.86 115.64 119.35 3k1w s THR 103 Ca 0.13 -0.76 0.01 0.00 0.31 0.00 0.00 61.69 61.38 3k1w s THR 103 Cb -0.12 -1.55 0.01 0.00 0.01 0.00 0.00 72.50 70.85 3k1w s THR 103 CO 0.03 0.48 -0.01 0.54 -0.69 0.00 0.00 174.62 174.97 3k1w s VAL 104 N 1.04 0.20 -0.13 3.82 0.11 0.30 -4.96 120.40 120.77 3k1w s VAL 104 Ca -0.04 -0.01 -0.29 0.00 -2.93 0.00 0.00 61.98 58.71 3k1w s VAL 104 Cb -0.15 -0.24 -0.01 0.00 -1.53 0.00 0.00 36.38 34.45 3k1w s VAL 104 CO -0.04 0.11 1.11 -0.89 -3.33 0.00 0.00 175.10 172.06 3k1w s THR 105 N 0.54 4.54 -0.01 5.04 2.01 -1.26 -0.36 115.64 126.13 3k1w s THR 105 Ca -0.05 1.84 0.00 0.00 0.31 0.00 0.00 61.69 63.79 3k1w s THR 105 Cb -0.08 -4.18 0.01 0.00 0.01 0.00 0.00 72.50 68.25 3k1w s THR 105 CO -0.01 -0.06 -0.01 -1.58 -0.69 0.00 0.00 174.62 172.27 3k1w s GLN 106 N 2.59 0.16 -0.02 4.92 2.00 -0.13 -4.97 119.66 124.21 3k1w s GLN 106 Ca 0.50 -0.01 -0.24 0.00 -2.00 0.00 0.00 55.36 53.62 3k1w s GLN 106 Cb -0.20 -0.23 -0.04 0.00 0.80 0.00 0.00 33.01 33.34 3k1w s GLN 106 CO 0.16 -0.02 0.72 1.41 -0.50 0.00 0.00 175.29 177.05 3k1w s MET 107 N 0.31 4.44 0.09 1.67 -2.45 -1.26 -1.81 119.30 120.29 3k1w s MET 107 Ca -0.03 0.94 -0.03 0.00 -1.25 0.00 0.00 55.69 55.32 3k1w s MET 107 Cb -0.05 -3.41 -0.03 0.00 1.25 0.00 0.00 34.83 32.59 3k1w s MET 107 CO -0.01 0.17 0.05 -0.59 1.05 0.00 0.00 175.02 175.70 3k1w s PHE 108 N 0.40 0.57 -0.09 4.11 -0.71 0.60 -4.67 117.98 118.19 3k1w s PHE 108 Ca 0.37 -1.03 -0.16 0.00 -1.04 0.00 0.00 56.93 55.07 3k1w s PHE 108 Cb -0.19 -0.35 -0.05 0.00 -1.21 0.00 0.00 43.02 41.23 3k1w s PHE 108 CO 0.20 -0.47 0.39 0.20 -1.34 0.00 0.00 175.22 174.20 3k1w s GLY 109 N -2.96 2.37 -0.41 1.99 0.00 0.35 -0.94 107.32 107.72 3k1w s GLY 109 Ca 0.13 -0.28 -0.16 0.00 0.00 0.00 0.00 44.72 44.41 3k1w s GLY 109 CO -0.06 0.44 0.35 -0.54 0.00 0.00 0.00 173.10 173.29 3k1w s GLU 110 N -0.05 3.07 0.03 2.90 2.02 0.24 -1.51 118.70 125.42 3k1w s GLU 110 Ca 0.22 -0.87 -0.30 0.00 0.02 0.00 0.00 54.97 54.03 3k1w s GLU 110 Cb -0.15 -3.96 -0.05 0.00 0.10 0.00 0.00 34.13 30.07 3k1w s GLU 110 CO 0.09 -0.76 1.25 0.08 0.02 0.00 0.00 175.26 175.93 3k1w s VAL 111 N 1.87 3.96 -0.40 2.63 1.01 -0.09 -1.41 120.40 127.97 3k1w s VAL 111 Ca 0.08 1.38 0.10 0.00 0.00 0.00 0.00 61.98 63.55 3k1w s VAL 111 Cb -0.18 -3.89 -0.12 0.00 0.00 0.00 0.00 36.38 32.19 3k1w s VAL 111 CO 0.11 0.07 0.41 0.35 0.00 0.00 0.00 175.10 176.04 3k1w n THR 112 N 4.17 0.00 -3.67 3.92 -2.24 -0.44 -0.48 114.28 115.54 3k1w n THR 112 Ca 0.10 -0.25 -0.14 0.00 -2.27 0.00 0.00 64.05 61.49 3k1w n THR 112 Cb 0.46 0.86 -0.08 0.00 -2.10 0.00 0.00 70.33 69.46 3k1w n THR 112 CO 0.00 0.00 0.00 -1.83 -0.57 0.00 0.00 175.07 172.67 3k1w s GLU 113 N -2.13 0.71 -0.05 -0.78 -1.05 -1.09 -4.13 118.70 110.18 3k1w s GLU 113 Ca 0.02 0.67 -0.30 0.00 -0.15 0.00 0.00 54.97 55.22 3k1w s GLU 113 Cb 0.08 0.34 0.08 0.00 -0.44 0.00 0.00 34.13 34.20 3k1w s GLU 113 CO 0.43 -0.11 0.75 0.00 0.95 0.00 0.00 175.26 177.28 3k1w s MET 114 N 0.03 0.97 0.58 -4.83 0.23 -1.26 -1.73 119.30 113.29 3k1w s MET 114 Ca -0.02 0.12 -0.20 0.00 -1.03 0.00 0.00 55.69 54.56 3k1w s MET 114 Cb -0.04 0.46 -0.04 0.00 -1.53 0.00 0.00 34.83 33.68 3k1w s MET 114 CO 0.02 -0.33 1.29 -1.25 -2.03 0.00 0.00 175.02 172.72 3k1w s PRO 115 N -1.56 2.99 0.32 3.16 0.04 -1.25 -4.69 135.00 134.01 3k1w s PRO 115 Ca -0.07 2.05 0.01 0.00 0.04 0.00 0.00 61.00 63.04 3k1w s PRO 115 Cb -0.00 -2.08 0.54 0.00 0.04 0.00 0.00 34.50 33.00 3k1w s PRO 115 CO 0.05 -1.25 1.90 0.00 0.04 0.00 0.00 177.00 177.74 3k1w h ALA 116 N 1.12 1.37 -3.48 8.56 0.00 -1.96 -3.34 119.26 121.52 3k1w h ALA 116 Ca -0.51 -0.15 -0.66 0.00 0.00 0.00 0.00 54.91 53.60 3k1w h ALA 116 Cb 1.31 -0.21 -0.24 0.00 0.00 0.00 0.00 17.79 18.65 3k1w h ALA 116 CO 0.56 0.47 -0.73 -0.51 0.00 0.00 0.00 179.25 179.04 3k1w s LEU 117 N -9.41 2.93 0.00 0.00 1.43 -1.26 -0.07 118.68 112.31 3k1w s LEU 117 Ca -0.09 -0.20 0.28 0.00 -1.03 0.00 0.00 54.13 53.08 3k1w s LEU 117 Cb 0.16 -1.66 0.98 0.00 0.03 0.00 0.00 46.19 45.70 3k1w s LEU 117 CO 0.78 0.23 1.70 -0.81 0.23 0.00 0.00 176.35 178.48 3k1w n PRO 118 N 3.11 1.13 0.26 1.29 -0.04 -1.26 -4.76 135.00 134.74 3k1w n PRO 118 Ca -0.18 -0.61 0.12 0.00 -0.04 0.00 0.00 63.50 62.80 3k1w n PRO 118 Cb 0.53 -1.49 0.73 0.00 -0.04 0.00 0.00 33.50 33.23 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 1.49 0.00 0.00 0.54 0.04 -1.65 -0.39 116.94 116.97 3k1w h PHE 119 Ca 0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3k1w h PHE 119 Cb 0.46 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.61 3k1w h PHE 119 CO 0.00 0.11 0.00 0.00 -0.60 0.00 0.00 178.31 177.82 3k1w h MET 120 N 0.00 0.00 -0.03 1.51 -0.00 -0.70 -2.62 114.93 113.08 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 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.89 3k1w h MET 120 CO 0.01 0.00 0.00 1.28 -0.00 0.00 0.00 176.91 178.20 3k1w n LEU 121 N -2.94 2.32 -4.72 -0.10 4.77 -0.16 -4.87 117.00 111.31 3k1w n LEU 121 Ca -0.00 -0.78 -0.42 0.00 -0.03 0.00 0.00 56.01 54.78 3k1w n LEU 121 Cb 0.22 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.27 3k1w n LEU 121 CO 0.23 0.39 0.91 0.00 -1.33 0.00 0.00 177.39 177.60 3k1w s ALA 122 N -1.99 3.44 -0.89 -1.18 0.00 -0.99 -4.92 121.76 115.24 3k1w s ALA 122 Ca 0.33 0.93 0.26 0.00 0.00 0.00 0.00 51.96 53.48 3k1w s ALA 122 Cb 0.20 -3.45 0.77 0.00 0.00 0.00 0.00 23.12 20.64 3k1w s ALA 122 CO 0.32 -0.44 1.63 0.39 0.00 0.00 0.00 175.76 177.65 3k1w n GLU 123 N 3.43 0.10 -3.49 0.00 -0.58 -1.26 -4.86 120.64 113.98 3k1w n GLU 123 Ca 0.08 0.05 -0.21 0.00 -0.42 0.00 0.00 57.16 56.66 3k1w n GLU 123 Cb 0.45 -1.59 -0.01 0.00 -0.57 0.00 0.00 31.44 29.73 3k1w n GLU 123 CO 0.00 0.00 0.00 -0.59 -0.48 0.00 0.00 177.13 176.06 3k1w s PHE 124 N -3.05 3.31 -0.09 -0.32 -0.71 -1.26 -4.99 117.98 110.87 3k1w s PHE 124 Ca 0.11 0.04 0.21 0.00 -1.04 0.00 0.00 56.93 56.26 3k1w s PHE 124 Cb 0.16 -1.92 -0.26 0.00 -1.21 0.00 0.00 43.02 39.79 3k1w s PHE 124 CO 0.63 0.07 0.57 -0.25 -1.34 0.00 0.00 175.22 174.90 3k1w n ASP 125 N -1.70 0.21 -2.23 1.98 8.00 0.14 -4.99 116.55 117.96 3k1w n ASP 125 Ca -0.03 0.08 -0.06 0.00 0.71 0.00 0.00 54.79 55.48 3k1w n ASP 125 Cb 0.57 1.52 0.02 0.00 -0.02 0.00 0.00 41.12 43.21 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 1.30 1.42 2.97 0.44 0.00 -0.64 -4.08 105.19 106.59 3k1w n GLY 126 Ca -0.06 -1.21 -0.20 0.00 0.00 0.00 0.00 46.02 44.55 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 -2.42 0.66 -0.34 1.61 1.01 -0.27 -2.08 120.40 118.57 3k1w s VAL 127 Ca 0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 61.98 61.81 3k1w s VAL 127 Cb -0.03 -0.61 0.07 0.00 0.00 0.00 0.00 36.38 35.81 3k1w s VAL 127 CO 0.09 0.22 0.06 -0.69 0.00 0.00 0.00 175.10 174.78 3k1w s VAL 128 N 0.33 2.99 -0.02 2.92 1.01 0.35 -1.02 120.40 126.96 3k1w s VAL 128 Ca -0.05 -1.69 -0.30 0.00 0.00 0.00 0.00 61.98 59.94 3k1w s VAL 128 Cb -0.09 -2.87 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 3k1w s VAL 128 CO 0.00 -0.33 1.22 -0.83 0.00 0.00 0.00 175.10 175.16 3k1w s GLY 129 N 1.39 2.17 -0.05 4.51 0.00 0.07 -0.85 107.32 114.56 3k1w s GLY 129 Ca 0.00 0.71 0.18 0.00 0.00 0.00 0.00 44.72 45.61 3k1w s GLY 129 CO -0.03 2.19 1.49 1.03 0.00 0.00 0.00 173.10 177.79 3k1w n MET 130 N 4.86 3.09 -0.60 2.90 2.81 0.70 -4.46 117.12 126.43 3k1w n MET 130 Ca 0.11 -2.60 -0.09 0.00 -1.81 0.00 0.00 57.70 53.30 3k1w n MET 130 Cb 0.46 -1.62 0.06 0.00 -0.71 0.00 0.00 33.22 31.42 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 1.09 -1.18 3.95 3.03 0.00 0.33 -4.80 105.19 107.61 3k1w n GLY 131 Ca 0.22 -1.69 -0.23 0.00 0.00 0.00 0.00 46.02 44.32 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 -1.85 3.46 0.53 1.61 0.40 -1.26 -4.78 117.98 116.09 3k1w s PHE 132 Ca 0.23 0.20 0.22 0.00 -0.60 0.00 0.00 56.93 56.97 3k1w s PHE 132 Cb -0.01 -1.80 1.35 0.00 0.51 0.00 0.00 43.02 43.08 3k1w s PHE 132 CO 0.16 0.21 2.06 0.97 0.70 0.00 0.00 175.22 179.32 3k1w h ILE 133 N 0.89 0.83 -0.60 0.64 2.10 -1.89 -1.73 117.51 117.74 3k1w h ILE 133 Ca -0.50 0.00 0.18 0.00 1.08 0.00 0.00 64.86 65.61 3k1w h ILE 133 Cb 1.22 0.84 -0.02 0.00 -1.09 0.00 0.00 36.82 37.77 3k1w h ILE 133 CO 0.61 0.00 0.45 -0.33 -1.08 0.00 0.00 178.15 177.80 3k1w h GLU 134 N 0.00 0.00 -0.24 2.19 3.07 -1.95 -1.09 114.58 116.56 3k1w h GLU 134 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.01 3k1w h GLU 134 Cb 0.60 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.51 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 -4.28 2.86 -2.37 2.33 6.02 -0.66 -5.00 117.38 116.28 3k1w n GLN 135 Ca 0.12 -2.00 -0.42 0.00 -0.01 0.00 0.00 57.00 54.69 3k1w n GLN 135 Cb 0.69 -1.26 -0.03 0.00 1.02 0.00 0.00 30.24 30.66 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 -1.23 3.48 0.22 -1.58 0.00 -0.42 -4.57 121.76 117.67 3k1w s ALA 136 Ca 0.19 0.81 -0.32 0.00 0.00 0.00 0.00 51.96 52.65 3k1w s ALA 136 Cb 0.11 -3.51 -0.12 0.00 0.00 0.00 0.00 23.12 19.61 3k1w s ALA 136 CO 0.11 -0.65 1.69 0.42 0.00 0.00 0.00 175.76 177.33 3k1w s ILE 137 N 1.69 2.08 0.00 0.00 1.01 -1.26 -1.29 121.20 123.43 3k1w s ILE 137 Ca 0.60 0.06 0.00 0.00 0.00 0.00 0.00 60.65 61.30 3k1w s ILE 137 Cb -0.29 -3.04 0.00 0.00 0.01 0.00 0.00 42.46 39.14 3k1w s ILE 137 CO 0.27 0.01 0.00 0.61 0.00 0.00 0.00 174.94 175.82 3k1w n GLY 138 N 3.66 0.34 3.28 6.18 0.00 -1.26 -3.18 105.19 114.21 3k1w n GLY 138 Ca 0.14 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 3k1w n GLY 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k1w n ARG 139 N -1.59 -3.75 -2.49 1.61 3.00 -0.41 -4.92 116.66 108.11 3k1w n ARG 139 Ca 0.00 0.58 -0.42 0.00 -0.01 0.00 0.00 57.85 58.00 3k1w n ARG 139 Cb 0.17 -5.32 -0.03 0.00 0.00 0.00 0.00 32.46 27.27 3k1w n ARG 139 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 3k1w s VAL 140 N -2.99 4.15 -0.04 1.55 1.01 -1.19 -4.92 120.40 117.98 3k1w s VAL 140 Ca 0.37 1.60 -0.31 0.00 0.00 0.00 0.00 61.98 63.65 3k1w s VAL 140 Cb -0.19 -4.03 -0.09 0.00 0.00 0.00 0.00 36.38 32.07 3k1w s VAL 140 CO 0.46 0.16 2.00 0.41 0.00 0.00 0.00 175.10 178.13 3k1w n THR 141 N 3.59 0.66 -1.07 3.92 -1.04 -1.26 -4.82 114.28 114.25 3k1w n THR 141 Ca 0.07 -0.18 -0.31 0.00 -2.04 0.00 0.00 64.05 61.59 3k1w n THR 141 Cb 0.47 -2.25 0.12 0.00 -1.82 0.00 0.00 70.33 66.85 3k1w n THR 141 CO 0.00 0.00 0.00 -2.84 -0.64 0.00 0.00 175.07 171.59 3k1w s PRO 142 N 4.72 1.76 0.26 -2.82 0.02 -1.26 -4.71 135.00 132.96 3k1w s PRO 142 Ca 0.92 1.26 -0.05 0.00 0.02 0.00 0.00 61.00 63.15 3k1w s PRO 142 Cb -0.49 -1.83 0.29 0.00 0.02 0.00 0.00 34.50 32.49 3k1w s PRO 142 CO 0.43 -2.02 1.89 0.97 -0.33 0.00 0.00 177.00 177.94 3k1w h ILE 143 N -1.41 1.24 -0.01 2.83 2.10 -1.83 -1.87 117.51 118.56 3k1w h ILE 143 Ca -0.44 -0.58 -0.13 0.00 1.08 0.00 0.00 64.86 64.78 3k1w h ILE 143 Cb 1.25 0.07 -0.02 0.00 -1.09 0.00 0.00 36.82 37.03 3k1w h ILE 143 CO 0.48 0.27 -0.62 0.15 -1.08 0.00 0.00 178.15 177.36 3k1w h PHE 144 N 1.19 0.05 -0.44 2.19 3.57 -1.91 -0.40 116.94 121.20 3k1w h PHE 144 Ca 0.30 -0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 3k1w h PHE 144 Cb 0.00 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.71 3k1w h PHE 144 CO 0.01 0.65 0.25 -0.44 -2.23 0.00 0.00 178.31 176.55 3k1w h ASP 145 N 0.03 0.54 -0.07 0.41 5.19 -1.72 -0.09 116.42 120.71 3k1w h ASP 145 Ca -0.01 -0.08 -0.06 0.00 -0.62 0.00 0.00 57.03 56.26 3k1w h ASP 145 Cb 1.10 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 40.45 3k1w h ASP 145 CO 0.08 0.46 -0.13 0.78 -3.12 0.00 0.00 179.24 177.31 3k1w h ASN 146 N 0.58 0.38 -0.21 6.45 2.35 -0.83 -1.81 115.58 122.50 3k1w h ASN 146 Ca 0.16 -0.09 -0.08 0.00 -0.55 0.00 0.00 56.30 55.73 3k1w h ASN 146 Cb 0.03 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.29 3k1w h ASN 146 CO -0.03 0.55 -0.19 0.40 -1.65 0.00 0.00 177.43 176.51 3k1w h ILE 147 N 0.37 1.32 -0.81 2.81 2.04 -0.76 -2.93 117.51 119.55 3k1w h ILE 147 Ca 0.07 -1.35 0.14 0.00 1.00 0.00 0.00 64.86 64.73 3k1w h ILE 147 Cb 0.46 1.72 -0.09 0.00 -0.74 0.00 0.00 36.82 38.17 3k1w h ILE 147 CO 0.03 0.41 0.39 0.40 0.00 0.00 0.00 178.15 179.38 3k1w h ILE 148 N 0.19 0.71 0.00 -0.67 2.04 -0.80 -1.81 117.51 117.17 3k1w h ILE 148 Ca 0.04 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.69 3k1w h ILE 148 Cb 0.74 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.91 3k1w h ILE 148 CO 0.05 0.10 -0.05 0.28 0.00 0.00 0.00 178.15 178.53 3k1w h SER 149 N 0.56 0.00 1.14 1.72 0.02 -1.19 -2.20 113.55 113.61 3k1w h SER 149 Ca 0.44 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 61.38 3k1w h SER 149 Cb 0.64 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.18 3k1w h SER 149 CO -0.37 0.05 -0.07 1.56 -1.14 0.00 0.00 176.83 176.86 3k1w h GLN 150 N 0.00 0.00 -3.85 3.45 4.20 -1.15 -3.47 115.11 114.29 3k1w h GLN 150 Ca -0.00 0.00 -0.28 0.00 0.06 0.00 0.00 58.65 58.43 3k1w h GLN 150 Cb 0.22 0.00 0.07 0.00 0.30 0.00 0.00 27.48 28.07 3k1w h GLN 150 CO 0.01 0.07 -0.45 0.41 -0.67 0.00 0.00 178.83 178.20 3k1w n GLY 151 N 0.24 -0.13 0.03 3.46 0.00 -0.83 -4.94 105.19 103.03 3k1w n GLY 151 Ca 0.01 -0.08 -0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 -4.20 0.42 -2.31 1.61 0.24 -1.26 -2.91 118.33 109.92 3k1w n VAL 152 Ca -0.04 -0.40 -0.41 0.00 -2.04 0.00 0.00 64.34 61.46 3k1w n VAL 152 Cb 0.56 -0.26 -0.03 0.00 -1.47 0.00 0.00 33.84 32.64 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 -4.39 4.48 0.19 1.34 1.43 -1.26 -1.26 118.68 119.21 3k1w s LEU 153 Ca -0.05 2.44 -0.12 0.00 -1.03 0.00 0.00 54.13 55.37 3k1w s LEU 153 Cb 0.06 -3.63 0.15 0.00 0.03 0.00 0.00 46.19 42.80 3k1w s LEU 153 CO 0.50 -0.34 1.81 0.50 0.23 0.00 0.00 176.35 179.05 3k1w h LYS 154 N 3.90 0.64 -3.72 1.70 3.64 -1.08 -3.38 116.57 118.25 3k1w h LYS 154 Ca -0.47 -0.04 -0.16 0.00 -1.27 0.00 0.00 60.65 58.71 3k1w h LYS 154 Cb 1.22 -0.14 -0.21 0.00 -0.41 0.00 0.00 32.23 32.68 3k1w h LYS 154 CO 0.68 0.42 -0.59 -1.21 -2.27 0.00 0.00 179.45 176.48 3k1w s GLU 155 N -6.12 0.39 -1.40 1.90 2.02 -0.97 -4.93 118.70 109.58 3k1w s GLU 155 Ca -0.13 -0.47 -0.08 0.00 0.02 0.00 0.00 54.97 54.30 3k1w s GLU 155 Cb 0.14 0.15 0.07 0.00 0.10 0.00 0.00 34.13 34.60 3k1w s GLU 155 CO 0.75 -0.08 2.38 -0.25 0.02 0.00 0.00 175.26 178.08 3k1w n ASP 156 N 1.58 7.07 -4.18 -0.19 8.00 -1.26 -4.00 116.55 123.57 3k1w n ASP 156 Ca -0.23 -2.97 -0.11 0.00 0.71 0.00 0.00 54.79 52.19 3k1w n ASP 156 Cb 0.55 -1.47 -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 0.44 0.42 0.01 2.53 -7.23 -1.26 -1.12 120.40 114.19 3k1w s VAL 157 Ca 0.54 -1.93 -0.05 0.00 -1.81 0.00 0.00 61.98 58.73 3k1w s VAL 157 Cb 0.16 -1.94 -0.00 0.00 0.56 0.00 0.00 36.38 35.15 3k1w s VAL 157 CO -0.06 -0.61 0.09 0.72 -0.31 0.00 0.00 175.10 174.93 3k1w s PHE 158 N -3.82 0.10 0.06 2.82 -0.12 -0.54 -0.43 117.98 116.06 3k1w s PHE 158 Ca 0.20 -0.25 0.04 0.00 -0.05 0.00 0.00 56.93 56.87 3k1w s PHE 158 Cb 0.07 -0.09 -0.03 0.00 -0.63 0.00 0.00 43.02 42.34 3k1w s PHE 158 CO -0.00 -0.27 -0.12 -1.12 -0.05 0.00 0.00 175.22 173.66 3k1w s SER 159 N -1.43 1.41 -0.11 1.98 0.01 0.05 -0.57 113.70 115.04 3k1w s SER 159 Ca -0.15 -0.61 0.02 0.00 1.31 0.00 0.00 55.95 56.52 3k1w s SER 159 Cb -0.08 -0.02 0.01 0.00 0.21 0.00 0.00 66.02 66.14 3k1w s SER 159 CO 0.01 -0.13 -0.18 -0.36 0.41 0.00 0.00 173.24 172.99 3k1w s PHE 160 N -1.40 2.16 -0.18 2.43 0.40 0.56 -0.76 117.98 121.18 3k1w s PHE 160 Ca -0.04 -0.97 -0.01 0.00 -0.60 0.00 0.00 56.93 55.31 3k1w s PHE 160 Cb -0.09 -1.51 0.00 0.00 0.51 0.00 0.00 43.02 41.93 3k1w s PHE 160 CO 0.02 -0.46 -0.12 -0.47 0.70 0.00 0.00 175.22 174.88 3k1w s TYR 161 N 0.75 2.85 -0.19 0.36 5.04 -0.08 -1.95 117.35 124.13 3k1w s TYR 161 Ca -0.11 -1.12 -0.01 0.00 -2.44 0.00 0.00 57.07 53.39 3k1w s TYR 161 Cb -0.16 -1.97 0.00 0.00 0.35 0.00 0.00 41.96 40.18 3k1w s TYR 161 CO 0.02 -0.56 -0.13 0.71 -1.34 0.00 0.00 175.55 174.25 3k1w s TYR 162 N 1.13 2.85 0.62 4.97 2.02 -1.26 -0.47 117.35 127.21 3k1w s TYR 162 Ca 0.01 -1.17 -0.06 0.00 -0.37 0.00 0.00 57.07 55.47 3k1w s TYR 162 Cb -0.14 -1.97 0.02 0.00 -0.40 0.00 0.00 41.96 39.46 3k1w s TYR 162 CO -0.04 -0.59 0.94 1.21 -1.57 0.00 0.00 175.55 175.49 3k1w s ASN 163 N 1.18 5.38 0.91 2.29 2.47 -0.14 -4.30 114.94 122.74 3k1w s ASN 163 Ca 0.02 0.65 -0.12 0.00 0.42 0.00 0.00 52.86 53.83 3k1w s ASN 163 Cb -0.14 -1.55 0.14 0.00 -1.45 0.00 0.00 41.25 38.25 3k1w s ASN 163 CO -0.05 -1.21 1.11 -0.13 -3.72 0.00 0.00 177.10 173.10 3k1w s ARG 164 N -5.07 1.12 0.00 0.43 0.52 -1.26 -4.94 118.95 109.75 3k1w s ARG 164 Ca 0.56 0.45 0.00 0.00 -0.52 0.00 0.00 55.73 56.22 3k1w s ARG 164 Cb -0.11 -1.82 0.00 0.00 0.52 0.00 0.00 34.95 33.54 3k1w s ARG 164 CO 0.45 -2.25 0.00 -0.25 0.02 0.00 0.00 175.30 173.27 3k1w n ASP 165 N -3.83 0.00 -0.01 0.23 9.92 -1.26 -4.95 116.55 116.65 3k1w n ASP 165 Ca 0.06 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.32 3k1w n ASP 165 Cb 0.58 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.06 3k1w n ASP 165 CO 0.00 0.00 0.00 -0.24 0.13 0.00 0.00 177.20 177.09 3k1w n SER 171 N 0.00 -0.77 -4.66 -2.24 2.88 -1.26 -3.65 113.62 103.92 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 0.35 -0.03 0.00 -0.75 0.00 0.00 64.21 63.78 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 -0.37 4.12 0.31 2.46 2.96 -1.26 -4.94 118.68 121.96 3k1w s LEU 172 Ca 0.00 1.25 0.05 0.00 -0.22 0.00 0.00 54.13 55.22 3k1w s LEU 172 Cb 0.00 -3.38 0.53 0.00 0.50 0.00 0.00 46.19 43.84 3k1w s LEU 172 CO 0.00 -0.55 1.78 1.23 -1.32 0.00 0.00 176.35 177.49 3k1w h GLY 173 N 9.03 0.40 0.00 7.98 0.00 -1.87 -3.41 103.07 115.20 3k1w h GLY 173 Ca -0.23 -0.31 0.00 0.00 0.00 0.00 0.00 47.33 46.79 3k1w h GLY 173 CO 0.91 0.28 0.00 0.61 0.00 0.00 0.00 176.54 178.34 3k1w n GLY 174 N -0.50 -1.97 3.55 4.60 0.00 -0.83 -0.96 105.19 109.07 3k1w n GLY 174 Ca -0.00 -1.17 -0.11 0.00 0.00 0.00 0.00 46.02 44.74 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 -1.78 0.69 -0.11 1.61 0.74 0.38 -0.67 119.66 120.53 3k1w s GLN 175 Ca 0.00 1.01 -0.02 0.00 0.05 0.00 0.00 55.36 56.40 3k1w s GLN 175 Cb 0.00 0.24 -0.03 0.00 1.10 0.00 0.00 33.01 34.32 3k1w s GLN 175 CO 0.00 -0.12 -0.04 -1.50 -0.55 0.00 0.00 175.29 173.08 3k1w s ILE 176 N 0.95 3.94 -0.14 -2.34 2.07 -0.48 -0.91 121.20 124.30 3k1w s ILE 176 Ca -0.05 -0.37 -0.00 0.00 -1.41 0.00 0.00 60.65 58.82 3k1w s ILE 176 Cb -0.05 -2.68 -0.01 0.00 0.13 0.00 0.00 42.46 39.85 3k1w s ILE 176 CO -0.08 0.55 -0.13 -0.69 -1.91 0.00 0.00 174.94 172.68 3k1w s VAL 177 N -0.29 3.07 -0.24 4.00 1.01 0.06 -0.83 120.40 127.18 3k1w s VAL 177 Ca 0.05 -0.65 -0.10 0.00 0.00 0.00 0.00 61.98 61.28 3k1w s VAL 177 Cb -0.13 -2.30 -0.05 0.00 0.00 0.00 0.00 36.38 33.91 3k1w s VAL 177 CO 0.02 0.52 0.16 -0.76 0.00 0.00 0.00 175.10 175.04 3k1w s LEU 178 N 0.42 4.06 0.00 3.92 1.43 0.23 -0.77 118.68 127.96 3k1w s LEU 178 Ca -0.10 0.08 0.00 0.00 -1.03 0.00 0.00 54.13 53.08 3k1w s LEU 178 Cb -0.16 -2.09 0.00 0.00 0.03 0.00 0.00 46.19 43.97 3k1w s LEU 178 CO 0.05 0.05 0.00 0.61 0.23 0.00 0.00 176.35 177.29 3k1w n GLY 179 N 4.41 0.42 0.00 -3.19 0.00 0.43 -0.91 105.19 106.35 3k1w n GLY 179 Ca -0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.87 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 -2.00 -0.68 3.31 -0.02 0.00 -1.23 -2.30 105.19 102.27 3k1w n GLY 180 Ca 0.00 -0.47 -0.16 0.00 0.00 0.00 0.00 46.02 45.39 3k1w n GLY 180 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k1w s SER 181 N -4.00 1.26 -0.29 1.61 1.04 -1.26 -3.53 113.70 108.52 3k1w s SER 181 Ca 0.00 -1.34 0.03 0.00 0.48 0.00 0.00 55.95 55.12 3k1w s SER 181 Cb 0.00 0.14 0.08 0.00 0.10 0.00 0.00 66.02 66.34 3k1w s SER 181 CO 0.00 -0.69 -0.04 -0.62 0.98 0.00 0.00 173.24 172.87 3k1w s ASP 182 N -3.29 4.58 0.40 7.02 -1.08 -1.26 -4.98 116.67 118.05 3k1w s ASP 182 Ca 0.35 -1.73 0.29 0.00 -0.52 0.00 0.00 52.55 50.94 3k1w s ASP 182 Cb 0.07 -1.58 1.32 0.00 -1.46 0.00 0.00 42.92 41.28 3k1w s ASP 182 CO 0.12 -0.27 1.86 -0.65 0.52 0.00 0.00 175.17 176.74 3k1w h PRO 183 N 7.70 0.00 -0.04 4.34 0.11 -2.01 -1.08 132.00 141.02 3k1w h PRO 183 Ca -0.12 0.00 0.01 0.00 0.11 0.00 0.00 66.00 66.00 3k1w h PRO 183 Cb 1.03 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 3k1w h PRO 183 CO 0.49 0.00 0.04 0.37 -0.21 0.00 0.00 178.00 178.69 3k1w h GLN 184 N 0.00 0.00 -0.52 1.05 4.15 -2.01 -3.03 115.11 114.75 3k1w h GLN 184 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 3k1w h GLN 184 Cb 0.27 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.96 3k1w h GLN 184 CO 0.00 0.00 0.00 0.72 -1.93 0.00 0.00 178.83 177.62 3k1w n HIS 185 N -4.02 0.69 -4.06 3.99 8.25 -0.41 -4.80 115.22 114.86 3k1w n HIS 185 Ca -0.02 -0.48 -0.10 0.00 -0.26 0.00 0.00 57.72 56.86 3k1w n HIS 185 Cb 0.13 -0.01 -0.08 0.00 1.12 0.00 0.00 29.99 31.15 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 -1.02 0.66 0.07 4.41 1.13 -1.14 -1.04 117.35 120.42 3k1w s TYR 186 Ca 0.35 -0.98 0.08 0.00 -1.41 0.00 0.00 57.07 55.11 3k1w s TYR 186 Cb 0.19 -0.18 -0.03 0.00 -1.10 0.00 0.00 41.96 40.84 3k1w s TYR 186 CO 0.24 -0.76 -0.23 -1.83 -2.51 0.00 0.00 175.55 170.47 3k1w s GLU 187 N -4.05 1.41 3.81 -3.49 -1.05 -0.10 -4.72 118.70 110.52 3k1w s GLU 187 Ca 0.26 -1.07 0.00 0.00 -0.15 0.00 0.00 54.97 54.01 3k1w s GLU 187 Cb 0.04 -1.62 0.00 0.00 -0.44 0.00 0.00 34.13 32.11 3k1w s GLU 187 CO 0.07 0.40 0.00 0.41 0.95 0.00 0.00 175.26 177.09 3k1w n GLY 188 N 1.56 0.62 3.56 -3.83 0.00 -1.26 -4.06 105.19 101.79 3k1w n GLY 188 Ca -0.18 -0.80 -0.25 0.00 0.00 0.00 0.00 46.02 44.79 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 4.15 0.51 1.61 0.01 -1.26 -5.05 114.94 110.91 3k1w s ASN 189 Ca 0.00 -0.71 -0.21 0.00 -0.71 0.00 0.00 52.86 51.23 3k1w s ASN 189 Cb 0.00 -0.64 -0.06 0.00 0.41 0.00 0.00 41.25 40.96 3k1w s ASN 189 CO 0.00 0.06 1.18 -0.36 -1.51 0.00 0.00 177.10 176.47 3k1w s PHE 190 N -2.06 2.68 -0.08 2.20 0.08 -1.26 -4.69 117.98 114.85 3k1w s PHE 190 Ca 0.28 1.52 0.02 0.00 0.12 0.00 0.00 56.93 58.86 3k1w s PHE 190 Cb -0.07 -3.41 -0.02 0.00 -0.57 0.00 0.00 43.02 38.94 3k1w s PHE 190 CO 0.16 -1.77 -0.13 -1.01 -0.10 0.00 0.00 175.22 172.37 3k1w s HIS 191 N -1.59 2.78 0.09 0.36 3.76 -0.51 -4.92 115.29 115.26 3k1w s HIS 191 Ca 0.69 -0.32 0.05 0.00 -0.15 0.00 0.00 55.06 55.34 3k1w s HIS 191 Cb -0.29 -1.73 -0.04 0.00 1.11 0.00 0.00 32.58 31.64 3k1w s HIS 191 CO 0.33 0.05 -0.03 0.71 -0.85 0.00 0.00 174.74 174.96 3k1w s TYR 192 N -0.31 2.92 -0.05 1.40 2.02 -1.26 -1.04 117.35 121.03 3k1w s TYR 192 Ca 0.03 -0.06 0.02 0.00 -0.37 0.00 0.00 57.07 56.69 3k1w s TYR 192 Cb -0.13 -1.51 0.02 0.00 -0.40 0.00 0.00 41.96 39.94 3k1w s TYR 192 CO 0.03 0.47 -0.08 0.42 -1.57 0.00 0.00 175.55 174.81 3k1w s ILE 193 N -1.28 0.77 0.43 2.71 1.09 -0.14 -4.80 121.20 119.97 3k1w s ILE 193 Ca 0.25 -0.28 -0.24 0.00 -1.10 0.00 0.00 60.65 59.27 3k1w s ILE 193 Cb -0.12 -0.73 -0.08 0.00 -1.06 0.00 0.00 42.46 40.47 3k1w s ILE 193 CO 0.17 0.27 1.17 0.20 -0.10 0.00 0.00 174.94 176.65 3k1w s ASN 194 N 0.67 6.36 0.54 3.58 0.02 -1.26 -1.14 114.94 123.71 3k1w s ASN 194 Ca -0.11 2.33 -0.22 0.00 -1.02 0.00 0.00 52.86 53.84 3k1w s ASN 194 Cb -0.14 -2.61 -0.05 0.00 0.02 0.00 0.00 41.25 38.47 3k1w s ASN 194 CO 0.01 -0.79 1.35 0.18 0.02 0.00 0.00 177.10 177.88 3k1w n LEU 195 N -0.19 5.47 -0.04 0.60 4.77 -0.68 -4.61 117.00 122.32 3k1w n LEU 195 Ca 0.06 0.98 -0.10 0.00 -0.03 0.00 0.00 56.01 56.92 3k1w n LEU 195 Cb 0.47 -1.57 -0.03 0.00 -2.33 0.00 0.00 43.42 39.96 3k1w n LEU 195 CO 0.49 -0.59 0.92 0.40 -1.33 0.00 0.00 177.39 177.28 3k1w h ILE 196 N 1.45 0.98 -3.37 -0.08 2.04 -1.71 -3.45 117.51 113.38 3k1w h ILE 196 Ca -0.51 -0.06 -0.11 0.00 1.00 0.00 0.00 64.86 65.18 3k1w h ILE 196 Cb 1.30 0.78 -0.18 0.00 -0.74 0.00 0.00 36.82 37.98 3k1w h ILE 196 CO 0.57 0.03 -0.33 -1.59 0.00 0.00 0.00 178.15 176.83 3k1w s LYS 197 N -6.18 0.70 0.61 2.37 -2.85 -1.26 -5.12 119.74 108.01 3k1w s LYS 197 Ca -0.13 -0.48 -0.18 0.00 -1.00 0.00 0.00 55.97 54.18 3k1w s LYS 197 Cb 0.09 0.30 -0.02 0.00 -2.06 0.00 0.00 37.83 36.13 3k1w s LYS 197 CO 0.69 -0.21 1.20 -0.08 0.10 0.00 0.00 175.35 177.05 3k1w s THR 198 N -2.18 2.65 0.00 3.79 -1.32 -1.26 -3.72 115.64 113.60 3k1w s THR 198 Ca -0.08 0.39 0.00 0.00 -1.21 0.00 0.00 61.69 60.79 3k1w s THR 198 Cb -0.03 -3.10 0.00 0.00 -1.51 0.00 0.00 72.50 67.87 3k1w s THR 198 CO -0.01 -0.11 0.00 0.61 -2.21 0.00 0.00 174.62 172.90 3k1w n GLY 199 N 0.40 2.55 3.12 6.08 0.00 -1.26 -5.06 105.19 111.01 3k1w n GLY 199 Ca 0.13 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 0.54 0.00 0.00 0.00 173.32 173.86 3k1w s VAL 200 N -2.27 -0.01 -1.41 1.61 0.11 -1.24 -4.29 120.40 112.91 3k1w s VAL 200 Ca 0.00 0.03 -0.14 0.00 -2.93 0.00 0.00 61.98 58.95 3k1w s VAL 200 Cb 0.00 -0.37 0.07 0.00 -1.53 0.00 0.00 36.38 34.55 3k1w s VAL 200 CO 0.00 0.01 2.11 0.79 -3.33 0.00 0.00 175.10 174.68 3k1w n TRP 201 N 3.24 3.58 -3.95 1.54 7.02 -1.26 -4.79 117.44 122.82 3k1w n TRP 201 Ca -0.16 -2.94 -0.16 0.00 -1.02 0.00 0.00 57.50 53.22 3k1w n TRP 201 Cb 0.57 -2.46 -0.16 0.00 -2.42 0.00 0.00 31.31 26.85 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 2.79 0.29 0.25 -0.99 0.74 -1.26 -1.29 119.66 120.19 3k1w s GLN 202 Ca 0.46 0.04 0.10 0.00 0.05 0.00 0.00 55.36 56.01 3k1w s GLN 202 Cb 0.12 -0.43 -0.05 0.00 1.10 0.00 0.00 33.01 33.75 3k1w s GLN 202 CO -0.06 -0.09 -0.16 0.96 -0.55 0.00 0.00 175.29 175.39 3k1w s ILE 203 N 0.79 2.09 0.30 -2.34 -4.36 0.42 -1.93 121.20 116.16 3k1w s ILE 203 Ca -0.08 -2.30 -0.29 0.00 -0.26 0.00 0.00 60.65 57.72 3k1w s ILE 203 Cb -0.11 -2.21 -0.10 0.00 1.25 0.00 0.00 42.46 41.29 3k1w s ILE 203 CO -0.01 -0.47 1.30 -1.58 0.24 0.00 0.00 174.94 174.41 3k1w s GLN 204 N -3.59 4.38 -0.04 0.37 2.00 -1.26 -0.40 119.66 121.12 3k1w s GLN 204 Ca 0.27 2.16 0.05 0.00 -2.00 0.00 0.00 55.36 55.84 3k1w s GLN 204 Cb -0.02 -3.10 -0.02 0.00 0.80 0.00 0.00 33.01 30.66 3k1w s GLN 204 CO 0.11 -0.18 -0.19 1.41 -0.50 0.00 0.00 175.29 175.95 3k1w s MET 205 N -1.37 2.40 0.00 1.67 -2.45 -0.24 -4.53 119.30 114.79 3k1w s MET 205 Ca 0.51 -0.78 0.19 0.00 -1.25 0.00 0.00 55.69 54.36 3k1w s MET 205 Cb -0.39 -2.26 0.10 0.00 1.25 0.00 0.00 34.83 33.53 3k1w s MET 205 CO 0.49 0.58 1.06 1.63 1.05 0.00 0.00 175.02 179.83 3k1w n LYS 206 N 2.42 1.66 0.00 4.11 5.02 -0.39 -1.65 118.16 129.33 3k1w n LYS 206 Ca -0.17 -1.40 0.00 0.00 -2.02 0.00 0.00 58.31 54.72 3k1w n LYS 206 Cb 0.52 -1.37 0.00 0.00 -0.02 0.00 0.00 35.03 34.16 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 1.16 3.34 3.02 0.72 0.00 -1.20 -4.57 105.19 107.66 3k1w n GLY 207 Ca 0.10 -0.89 -0.27 0.00 0.00 0.00 0.00 46.02 44.97 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 1.29 -0.00 1.61 1.01 -0.02 -1.42 120.40 120.87 3k1w s VAL 208 Ca 0.00 -0.53 0.03 0.00 0.00 0.00 0.00 61.98 61.48 3k1w s VAL 208 Cb 0.00 -1.20 -0.03 0.00 0.00 0.00 0.00 36.38 35.15 3k1w s VAL 208 CO 0.00 0.40 -0.08 -0.44 0.00 0.00 0.00 175.10 174.98 3k1w s SER 209 N 0.96 4.52 -0.17 3.32 0.01 0.35 -1.26 113.70 121.43 3k1w s SER 209 Ca -0.08 -0.16 -0.04 0.00 1.31 0.00 0.00 55.95 56.98 3k1w s SER 209 Cb -0.15 -1.03 -0.02 0.00 0.21 0.00 0.00 66.02 65.03 3k1w s SER 209 CO -0.00 0.29 -0.03 -0.69 0.41 0.00 0.00 173.24 173.21 3k1w s VAL 210 N -0.96 3.78 0.00 3.43 1.01 -0.83 -0.53 120.40 126.30 3k1w s VAL 210 Ca 0.16 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.75 3k1w s VAL 210 Cb -0.11 -2.67 0.00 0.00 0.00 0.00 0.00 36.38 33.60 3k1w s VAL 210 CO 0.06 0.47 0.00 0.61 0.00 0.00 0.00 175.10 176.24 3k1w n GLY 211 N 3.89 3.07 0.13 4.51 0.00 -0.31 -2.59 105.19 113.89 3k1w n GLY 211 Ca -0.17 -0.14 0.13 0.00 0.00 0.00 0.00 46.02 45.84 3k1w n GLY 211 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3k1w n SER 212 N 2.77 0.65 -4.36 1.61 3.41 -1.26 -4.83 113.62 111.60 3k1w n SER 212 Ca 0.00 -0.54 -0.32 0.00 -0.26 0.00 0.00 58.87 57.74 3k1w n SER 212 Cb 0.00 0.04 -0.15 0.00 -0.26 0.00 0.00 64.21 63.84 3k1w n SER 212 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3k1w s SER 213 N -2.63 3.62 -0.14 4.04 1.04 -1.07 -5.09 113.70 113.48 3k1w s SER 213 Ca 0.22 -0.37 -0.29 0.00 0.48 0.00 0.00 55.95 55.99 3k1w s SER 213 Cb 0.19 -1.10 -0.04 0.00 0.10 0.00 0.00 66.02 65.16 3k1w s SER 213 CO 0.54 0.25 1.71 -0.89 0.98 0.00 0.00 173.24 175.82 3k1w s THR 214 N -0.14 3.55 -0.22 2.02 2.01 -1.26 -1.96 115.64 119.64 3k1w s THR 214 Ca -0.02 0.63 0.06 0.00 0.31 0.00 0.00 61.69 62.67 3k1w s THR 214 Cb -0.14 -3.51 -0.20 0.00 0.01 0.00 0.00 72.50 68.66 3k1w s THR 214 CO 0.04 -0.16 -0.04 0.18 -0.69 0.00 0.00 174.62 173.94 3k1w n LEU 215 N 8.17 1.98 -4.26 4.42 7.99 -0.59 -4.95 117.00 129.77 3k1w n LEU 215 Ca 0.19 -0.04 -0.14 0.00 -0.01 0.00 0.00 56.01 56.01 3k1w n LEU 215 Cb 0.44 -0.47 -0.10 0.00 -0.11 0.00 0.00 43.42 43.18 3k1w n LEU 215 CO 0.64 0.78 -0.33 -0.76 -1.51 0.00 0.00 177.39 176.21 3k1w s LEU 216 N -6.25 2.11 -1.50 2.23 1.43 -0.39 -4.82 118.68 111.50 3k1w s LEU 216 Ca -0.25 -1.19 -0.06 0.00 -1.03 0.00 0.00 54.13 51.60 3k1w s LEU 216 Cb 0.08 -0.10 0.02 0.00 0.03 0.00 0.00 46.19 46.22 3k1w s LEU 216 CO 0.69 -0.56 0.71 0.00 0.23 0.00 0.00 176.35 177.43 3k1w h GLU 218 N -1.60 0.84 -0.01 0.00 5.08 -1.88 -2.22 114.58 114.80 3k1w h GLU 218 Ca -0.53 -0.22 0.00 0.00 -1.00 0.00 0.00 59.36 57.61 3k1w h GLU 218 Cb 1.36 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.51 3k1w h GLU 218 CO 0.57 0.82 -0.17 -0.25 -1.00 0.00 0.00 179.01 178.98 3k1w n ASP 219 N -4.22 0.73 0.00 1.42 8.00 -1.26 -4.87 116.55 116.34 3k1w n ASP 219 Ca 0.03 -0.72 0.00 0.00 0.71 0.00 0.00 54.79 54.81 3k1w n ASP 219 Cb 0.29 0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.41 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 1.31 2.54 3.61 0.44 0.00 -0.84 -5.08 105.19 107.16 3k1w n GLY 220 Ca 0.13 -1.86 -0.06 0.00 0.00 0.00 0.00 46.02 44.23 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 3.40 -0.20 0.00 1.43 -1.26 -1.08 118.68 120.97 3k1w s LEU 222 Ca 0.18 -0.11 -0.00 0.00 -1.03 0.00 0.00 54.13 53.16 3k1w s LEU 222 Cb -0.04 -2.03 0.05 0.00 0.03 0.00 0.00 46.19 44.20 3k1w s LEU 222 CO 0.09 0.24 -0.05 0.00 0.23 0.00 0.00 176.35 176.85 3k1w s ALA 223 N -1.15 1.68 -0.04 4.21 0.00 0.46 -0.85 121.76 126.07 3k1w s ALA 223 Ca 0.21 -1.05 -0.26 0.00 0.00 0.00 0.00 51.96 50.87 3k1w s ALA 223 Cb -0.11 -1.25 -0.03 0.00 0.00 0.00 0.00 23.12 21.72 3k1w s ALA 223 CO 0.13 -0.95 0.82 -1.17 0.00 0.00 0.00 175.76 174.59 3k1w s LEU 224 N 1.54 4.34 -0.48 0.00 2.96 0.02 -0.44 118.68 126.62 3k1w s LEU 224 Ca -0.02 1.39 -0.14 0.00 -0.22 0.00 0.00 54.13 55.14 3k1w s LEU 224 Cb -0.17 -3.29 0.10 0.00 0.50 0.00 0.00 46.19 43.33 3k1w s LEU 224 CO -0.07 -0.17 0.40 -0.69 -1.32 0.00 0.00 176.35 174.49 3k1w s VAL 225 N 0.87 4.94 -0.39 1.68 1.01 -0.41 -0.25 120.40 127.85 3k1w s VAL 225 Ca 0.44 -1.33 0.01 0.00 0.00 0.00 0.00 61.98 61.10 3k1w s VAL 225 Cb -0.19 -4.06 0.11 0.00 0.00 0.00 0.00 36.38 32.24 3k1w s VAL 225 CO 0.22 -0.67 0.14 -0.62 0.00 0.00 0.00 175.10 174.17 3k1w s ASP 226 N 2.82 4.91 0.35 3.32 -1.08 -0.35 -4.61 116.67 122.03 3k1w s ASP 226 Ca 0.04 -2.24 0.26 0.00 -0.52 0.00 0.00 52.55 50.09 3k1w s ASP 226 Cb -0.26 -1.71 1.18 0.00 -1.46 0.00 0.00 42.92 40.68 3k1w s ASP 226 CO 0.04 -0.42 1.79 0.71 0.52 0.00 0.00 175.17 177.81 3k1w h THR 227 N 6.35 0.00 -0.01 1.71 1.35 -1.84 -2.32 112.91 118.15 3k1w h THR 227 Ca -0.07 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.57 3k1w h THR 227 Cb 1.01 0.96 0.00 0.00 -1.73 0.00 0.00 68.15 68.39 3k1w h THR 227 CO 0.60 0.00 -0.34 0.61 -0.25 0.00 0.00 175.52 176.14 3k1w n GLY 228 N -0.34 -0.55 3.83 5.82 0.00 -1.26 -4.72 105.19 107.97 3k1w n GLY 228 Ca 0.01 -0.45 -0.37 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 -2.55 3.62 0.18 4.61 0.00 -0.87 -5.00 121.76 121.75 3k1w s ALA 229 Ca 0.22 -0.09 0.03 0.00 0.00 0.00 0.00 51.96 52.12 3k1w s ALA 229 Cb 0.19 -2.53 0.05 0.00 0.00 0.00 0.00 23.12 20.83 3k1w s ALA 229 CO 0.56 0.44 1.42 0.77 0.00 0.00 0.00 175.76 178.94 3k1w h SER 230 N 4.30 0.25 -1.83 0.00 0.02 -1.88 -0.04 113.55 114.37 3k1w h SER 230 Ca -0.50 -0.19 -0.60 0.00 -0.84 0.00 0.00 61.79 59.66 3k1w h SER 230 Cb 1.21 -0.08 -0.13 0.00 0.14 0.00 0.00 62.40 63.54 3k1w h SER 230 CO 0.64 0.96 -0.58 -0.31 -1.14 0.00 0.00 176.83 176.39 3k1w s TYR 231 N -3.32 2.24 0.04 3.45 2.02 -1.26 -2.78 117.35 117.74 3k1w s TYR 231 Ca -0.03 -0.82 -0.28 0.00 -0.37 0.00 0.00 57.07 55.58 3k1w s TYR 231 Cb 0.11 -1.61 -0.05 0.00 -0.40 0.00 0.00 41.96 40.01 3k1w s TYR 231 CO 0.82 0.27 0.87 0.42 -1.57 0.00 0.00 175.55 176.37 3k1w s ILE 232 N -2.89 4.73 0.11 2.71 1.01 -1.03 -1.69 121.20 124.16 3k1w s ILE 232 Ca 0.29 1.85 0.08 0.00 0.00 0.00 0.00 60.65 62.87 3k1w s ILE 232 Cb 0.08 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 38.29 3k1w s ILE 232 CO 0.14 0.28 -0.19 -0.94 0.00 0.00 0.00 174.94 174.24 3k1w s SER 233 N 0.34 2.42 0.29 3.58 1.04 -0.13 -1.04 113.70 120.20 3k1w s SER 233 Ca 0.44 -0.73 0.04 0.00 0.48 0.00 0.00 55.95 56.18 3k1w s SER 233 Cb -0.21 -0.13 -0.03 0.00 0.10 0.00 0.00 66.02 65.75 3k1w s SER 233 CO 0.26 0.00 0.21 -0.83 0.98 0.00 0.00 173.24 173.86 3k1w s GLY 234 N -2.11 2.01 0.81 7.32 0.00 -1.00 -0.95 107.32 113.41 3k1w s GLY 234 Ca 0.08 -1.90 -0.13 0.00 0.00 0.00 0.00 44.72 42.77 3k1w s GLY 234 CO 0.04 -1.47 1.17 -1.14 0.00 0.00 0.00 173.10 171.70 3k1w n SER 235 N -1.05 0.89 -0.25 1.64 3.41 -1.25 -0.70 113.62 116.32 3k1w n SER 235 Ca 0.05 0.58 0.06 0.00 -0.26 0.00 0.00 58.87 59.29 3k1w n SER 235 Cb 0.64 -1.49 0.18 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 -0.93 0.44 -0.36 6.66 2.02 -1.92 -0.98 112.91 117.84 3k1w h THR 236 Ca -0.46 -0.07 -0.07 0.00 0.77 0.00 0.00 66.41 66.58 3k1w h THR 236 Cb 1.30 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.92 3k1w h THR 236 CO 0.45 0.04 -0.04 0.77 0.37 0.00 0.00 175.52 177.11 3k1w h SER 237 N 0.20 0.66 -0.52 4.18 4.64 -1.99 -1.01 113.55 119.71 3k1w h SER 237 Ca 0.42 -0.34 -0.01 0.00 -0.47 0.00 0.00 61.79 61.40 3k1w h SER 237 Cb 0.75 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.64 3k1w h SER 237 CO -0.57 0.84 0.29 0.28 -0.87 0.00 0.00 176.83 176.80 3k1w h SER 238 N 0.46 0.64 -0.38 4.97 0.02 -1.77 -2.76 113.55 114.73 3k1w h SER 238 Ca 0.10 -0.08 -0.13 0.00 -0.84 0.00 0.00 61.79 60.84 3k1w h SER 238 Cb 0.53 -0.16 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 3k1w h SER 238 CO 0.03 0.53 -0.23 0.40 -1.14 0.00 0.00 176.83 176.42 3k1w h ILE 239 N 0.69 1.27 -0.87 3.27 1.08 -1.13 -1.14 117.51 120.69 3k1w h ILE 239 Ca 0.18 -1.37 0.09 0.00 -0.39 0.00 0.00 64.86 63.38 3k1w h ILE 239 Cb 0.03 1.18 -0.07 0.00 -3.07 0.00 0.00 36.82 34.88 3k1w h ILE 239 CO -0.03 0.47 0.51 -0.33 -0.69 0.00 0.00 178.15 178.08 3k1w h GLU 240 N 0.76 0.84 -0.15 2.37 5.08 -1.07 -0.17 114.58 122.25 3k1w h GLU 240 Ca 0.10 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.39 3k1w h GLU 240 Cb 0.77 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 3k1w h GLU 240 CO 0.06 0.56 -0.00 -0.22 -1.00 0.00 0.00 179.01 178.41 3k1w h LYS 241 N 0.86 0.26 -0.50 2.33 1.63 -1.20 -1.59 116.57 118.36 3k1w h LYS 241 Ca 0.41 -0.08 0.01 0.00 -0.85 0.00 0.00 60.65 60.14 3k1w h LYS 241 Cb 0.35 -0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 31.93 3k1w h LYS 241 CO -0.24 0.49 0.33 1.25 -3.45 0.00 0.00 179.45 177.83 3k1w h LEU 242 N -0.00 0.56 -0.56 5.20 5.85 -0.69 -1.78 115.31 123.88 3k1w h LEU 242 Ca 0.04 -0.01 -0.16 0.00 0.84 0.00 0.00 57.88 58.59 3k1w h LEU 242 Cb 0.37 -0.14 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 3k1w h LEU 242 CO 0.01 0.40 -0.63 0.24 -0.34 0.00 0.00 178.44 178.12 3k1w h MET 243 N 0.66 0.33 -0.35 1.25 2.86 -1.03 -1.73 114.93 116.92 3k1w h MET 243 Ca 0.19 -0.24 0.05 0.00 -2.06 0.00 0.00 59.70 57.64 3k1w h MET 243 Cb -0.06 0.04 -0.05 0.00 0.06 0.00 0.00 31.60 31.59 3k1w h MET 243 CO -0.05 0.85 0.07 1.49 1.06 0.00 0.00 176.91 180.34 3k1w h GLU 244 N 0.24 0.19 0.00 1.72 4.22 -1.07 0.10 114.58 119.98 3k1w h GLU 244 Ca -0.01 -0.01 -0.03 0.00 0.08 0.00 0.00 59.36 59.39 3k1w h GLU 244 Cb 1.16 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 30.36 3k1w h GLU 244 CO 0.10 0.13 -0.15 0.00 -2.18 0.00 0.00 179.01 176.91 3k1w h ALA 245 N 1.26 1.52 0.00 2.92 0.00 -0.83 -2.33 119.26 121.80 3k1w h ALA 245 Ca 0.17 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.94 3k1w h ALA 245 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.95 3k1w h ALA 245 CO -0.21 0.19 -0.60 -0.07 0.00 0.00 0.00 179.25 178.56 3k1w h LEU 246 N 0.00 0.00 0.41 0.00 3.38 -0.88 -3.48 115.31 114.74 3k1w h LEU 246 Ca -0.00 -0.14 -0.11 0.00 0.09 0.00 0.00 57.88 57.72 3k1w h LEU 246 Cb 0.32 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.04 3k1w h LEU 246 CO 0.02 0.07 -0.11 0.61 0.09 0.00 0.00 178.44 179.12 3k1w n GLY 247 N 1.29 0.57 3.81 0.83 0.00 0.14 -4.99 105.19 106.85 3k1w n GLY 247 Ca 0.03 -0.78 -0.34 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.21 3.07 -0.12 4.61 0.00 -0.01 -4.90 121.76 122.19 3k1w s ALA 248 Ca 0.00 0.41 -0.05 0.00 0.00 0.00 0.00 51.96 52.32 3k1w s ALA 248 Cb 0.00 -3.14 -0.04 0.00 0.00 0.00 0.00 23.12 19.94 3k1w s ALA 248 CO 0.00 0.14 0.05 0.15 0.00 0.00 0.00 175.76 176.10 3k1w s LYS 249 N -3.00 3.39 0.06 0.00 1.02 0.18 -4.63 119.74 116.74 3k1w s LYS 249 Ca 0.60 -0.34 -0.29 0.00 0.02 0.00 0.00 55.97 55.97 3k1w s LYS 249 Cb -0.10 -3.00 -0.05 0.00 -0.52 0.00 0.00 37.83 34.16 3k1w s LYS 249 CO 0.15 0.58 0.92 0.21 -0.92 0.00 0.00 175.35 176.29 3k1w s LYS 250 N -0.52 4.61 0.00 1.68 2.20 -1.26 -0.12 119.74 126.33 3k1w s LYS 250 Ca 0.10 1.35 0.00 0.00 -0.36 0.00 0.00 55.97 57.06 3k1w s LYS 250 Cb -0.12 -3.40 0.00 0.00 -1.51 0.00 0.00 37.83 32.80 3k1w s LYS 250 CO 0.02 0.14 0.00 0.54 -0.36 0.00 0.00 175.35 175.69 3k1w n ARG 251 N 3.18 1.77 0.19 4.03 1.74 0.59 -4.94 116.66 123.22 3k1w n ARG 251 Ca 0.02 0.00 0.08 0.00 -0.77 0.00 0.00 57.85 57.19 3k1w n ARG 251 Cb 0.50 0.00 0.19 0.00 -1.02 0.00 0.00 32.46 32.13 3k1w n ARG 251 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 3k1w h LEU 252 N 0.00 0.00 -0.23 0.55 5.85 -2.03 -3.37 115.31 116.08 3k1w h LEU 252 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3k1w h LEU 252 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3k1w h LEU 252 CO 0.00 0.24 0.00 0.49 -0.34 0.00 0.00 178.44 178.83 3k1w n PHE 253 N -3.20 0.00 -3.58 1.25 3.72 -1.26 -5.12 117.46 109.27 3k1w n PHE 253 Ca 0.02 -0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.35 3k1w n PHE 253 Cb 0.59 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.14 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 -0.00 -1.62 -4.46 4.37 5.68 -1.26 -5.01 116.55 114.25 3k1w n ASP 254 Ca 0.00 -2.15 -0.29 0.00 -0.50 0.00 0.00 54.79 51.85 3k1w n ASP 254 Cb 0.21 2.71 -0.12 0.00 -1.14 0.00 0.00 41.12 42.79 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 -4.09 2.46 0.10 2.11 2.02 -1.26 -0.30 117.35 118.38 3k1w s TYR 255 Ca 0.12 -0.30 0.03 0.00 -0.37 0.00 0.00 57.07 56.54 3k1w s TYR 255 Cb -0.03 -1.31 -0.04 0.00 -0.40 0.00 0.00 41.96 40.18 3k1w s TYR 255 CO 0.09 0.38 -0.09 0.14 -1.57 0.00 0.00 175.55 174.50 3k1w s VAL 256 N -1.14 0.84 0.17 0.71 -7.23 0.82 -2.21 120.40 112.35 3k1w s VAL 256 Ca 0.17 -1.73 0.07 0.00 -1.81 0.00 0.00 61.98 58.68 3k1w s VAL 256 Cb -0.10 -1.44 -0.04 0.00 0.56 0.00 0.00 36.38 35.35 3k1w s VAL 256 CO 0.09 -0.67 -0.14 0.68 -0.31 0.00 0.00 175.10 174.75 3k1w s VAL 257 N -2.84 1.54 0.12 1.32 -7.23 -0.24 0.49 120.40 113.56 3k1w s VAL 257 Ca 0.07 -2.04 -0.32 0.00 -1.81 0.00 0.00 61.98 57.89 3k1w s VAL 257 Cb -0.00 -1.87 -0.11 0.00 0.56 0.00 0.00 36.38 34.96 3k1w s VAL 257 CO -0.02 -0.56 1.80 0.29 -0.31 0.00 0.00 175.10 176.31 3k1w n LYS 258 N -0.06 2.67 -0.30 4.82 5.02 -1.26 0.05 118.16 129.09 3k1w n LYS 258 Ca -0.11 0.97 0.18 0.00 -2.02 0.00 0.00 58.31 57.33 3k1w n LYS 258 Cb 0.59 -2.84 0.44 0.00 -0.02 0.00 0.00 35.03 33.20 3k1w n LYS 258 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3k1w h ASN 260 N 0.54 0.00 0.92 0.00 -1.07 -1.55 -2.59 115.58 111.84 3k1w h ASN 260 Ca 0.54 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.91 3k1w h ASN 260 Cb 1.15 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.40 3k1w h ASN 260 CO -0.28 0.04 -0.58 1.21 0.07 0.00 0.00 177.43 177.89 3k1w n GLU 261 N -3.34 0.29 -0.06 4.14 2.13 0.84 -4.39 120.64 120.25 3k1w n GLU 261 Ca -0.02 0.10 -0.14 0.00 0.66 0.00 0.00 57.16 57.76 3k1w n GLU 261 Cb 0.17 -1.70 -0.09 0.00 0.27 0.00 0.00 31.44 30.09 3k1w n GLU 261 CO 0.00 0.00 0.00 0.78 -0.41 0.00 0.00 177.13 177.50 3k1w h GLY 262 N 4.50 -0.93 2.00 8.31 0.00 -1.42 -2.19 103.07 113.34 3k1w h GLY 262 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 47.33 47.98 3k1w h GLY 262 CO 0.00 -0.18 0.00 -1.05 0.00 0.00 0.00 176.54 175.31 3k1w n PRO 263 N -5.42 0.07 0.00 4.80 -0.02 -1.26 -2.02 135.00 131.15 3k1w n PRO 263 Ca -0.04 0.48 0.12 0.00 -2.02 0.00 0.00 63.50 62.04 3k1w n PRO 263 Cb 0.36 -1.69 0.10 0.00 -0.02 0.00 0.00 33.50 32.25 3k1w n PRO 263 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 3k1w n THR 264 N -1.83 0.00 -2.02 3.45 -2.24 -0.83 -4.91 114.28 105.90 3k1w n THR 264 Ca 0.01 -0.50 -0.37 0.00 -2.27 0.00 0.00 64.05 60.91 3k1w n THR 264 Cb 0.08 1.48 0.02 0.00 -2.10 0.00 0.00 70.33 69.81 3k1w n THR 264 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3k1w s LEU 265 N -1.94 3.88 0.64 3.22 1.43 -0.85 -4.98 118.68 120.07 3k1w s LEU 265 Ca 0.27 2.51 -0.14 0.00 -1.03 0.00 0.00 54.13 55.74 3k1w s LEU 265 Cb 0.19 -4.32 -0.02 0.00 0.03 0.00 0.00 46.19 42.08 3k1w s LEU 265 CO 0.29 -1.31 1.06 -2.16 0.23 0.00 0.00 176.35 174.46 3k1w s PRO 266 N -2.90 3.13 0.55 1.29 0.04 -1.26 -4.36 135.00 131.48 3k1w s PRO 266 Ca 0.69 1.13 -0.21 0.00 0.04 0.00 0.00 61.00 62.66 3k1w s PRO 266 Cb -0.34 -2.01 -0.05 0.00 0.04 0.00 0.00 34.50 32.14 3k1w s PRO 266 CO 0.40 -0.96 1.18 -0.25 0.04 0.00 0.00 177.00 177.41 3k1w n ASP 267 N -2.46 1.84 -4.22 6.66 9.92 -1.26 -4.45 116.55 122.58 3k1w n ASP 267 Ca 0.08 0.92 -0.32 0.00 -0.53 0.00 0.00 54.79 54.95 3k1w n ASP 267 Cb 0.53 -1.49 -0.17 0.00 -0.64 0.00 0.00 41.12 39.36 3k1w n ASP 267 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 3k1w s ILE 268 N -1.36 2.11 -0.02 0.53 1.01 -0.06 -1.16 121.20 122.23 3k1w s ILE 268 Ca 0.73 -1.00 0.08 0.00 0.00 0.00 0.00 60.65 60.45 3k1w s ILE 268 Cb -0.43 -1.81 -0.02 0.00 0.01 0.00 0.00 42.46 40.21 3k1w s ILE 268 CO 0.49 0.56 -0.26 -0.44 0.00 0.00 0.00 174.94 175.29 3k1w s SER 269 N 0.37 3.05 -0.24 3.58 0.01 0.31 -0.50 113.70 120.27 3k1w s SER 269 Ca -0.18 -0.47 -0.03 0.00 1.31 0.00 0.00 55.95 56.58 3k1w s SER 269 Cb -0.18 -0.37 0.01 0.00 0.21 0.00 0.00 66.02 65.69 3k1w s SER 269 CO 0.08 0.31 -0.05 -0.36 0.41 0.00 0.00 173.24 173.64 3k1w s PHE 270 N -0.58 3.01 -0.50 2.43 0.08 -0.29 -0.50 117.98 121.64 3k1w s PHE 270 Ca 0.09 -1.26 -0.23 0.00 0.12 0.00 0.00 56.93 55.65 3k1w s PHE 270 Cb -0.10 -2.09 0.04 0.00 -0.57 0.00 0.00 43.02 40.30 3k1w s PHE 270 CO -0.01 -0.65 0.82 -1.58 -0.10 0.00 0.00 175.22 173.70 3k1w s HIS 271 N 1.40 2.92 -0.09 0.36 5.65 -0.51 -0.61 115.29 124.41 3k1w s HIS 271 Ca 0.03 -0.03 0.00 0.00 0.25 0.00 0.00 55.06 55.31 3k1w s HIS 271 Cb -0.16 -3.81 0.02 0.00 -1.18 0.00 0.00 32.58 27.46 3k1w s HIS 271 CO -0.04 -1.14 -0.07 -0.51 -0.65 0.00 0.00 174.74 172.33 3k1w s LEU 272 N 3.44 1.21 0.00 8.88 1.43 -0.53 -1.26 118.68 131.85 3k1w s LEU 272 Ca 0.27 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 53.12 3k1w s LEU 272 Cb -0.13 -0.75 0.00 0.00 0.03 0.00 0.00 46.19 45.33 3k1w s LEU 272 CO 0.19 -0.09 0.00 0.61 0.23 0.00 0.00 176.35 177.29 3k1w n GLY 273 N 4.67 3.34 1.27 -3.19 0.00 -1.26 -2.44 105.19 107.58 3k1w n GLY 273 Ca -0.15 -0.20 0.06 0.00 0.00 0.00 0.00 46.02 45.73 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 0.00 2.10 3.03 -0.02 0.00 -1.26 -4.94 105.19 104.09 3k1w n GLY 274 Ca 0.00 -0.61 -0.09 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.88 0.41 -0.12 1.61 2.20 -1.02 -5.14 119.74 115.80 3k1w s LYS 275 Ca 0.36 -0.73 -0.13 0.00 -0.36 0.00 0.00 55.97 55.11 3k1w s LYS 275 Cb 0.25 0.15 -0.05 0.00 -1.51 0.00 0.00 37.83 36.67 3k1w s LYS 275 CO 0.16 -0.08 0.31 -1.21 -0.36 0.00 0.00 175.35 174.17 3k1w s GLU 276 N -2.07 4.11 -0.36 4.03 0.41 -1.26 -1.46 118.70 122.10 3k1w s GLU 276 Ca -0.10 0.15 -0.07 0.00 -0.41 0.00 0.00 54.97 54.54 3k1w s GLU 276 Cb -0.05 -3.36 0.05 0.00 -1.78 0.00 0.00 34.13 28.98 3k1w s GLU 276 CO -0.03 0.38 0.14 0.71 -0.49 0.00 0.00 175.26 175.97 3k1w s TYR 277 N 0.02 3.28 -0.19 1.61 2.02 0.22 -4.93 117.35 119.38 3k1w s TYR 277 Ca 0.18 -1.44 -0.07 0.00 -0.37 0.00 0.00 57.07 55.37 3k1w s TYR 277 Cb -0.14 -2.43 -0.04 0.00 -0.40 0.00 0.00 41.96 38.96 3k1w s TYR 277 CO 0.06 -0.75 0.05 0.99 -1.57 0.00 0.00 175.55 174.33 3k1w s THR 278 N 1.41 4.60 -0.15 -0.71 2.01 -1.26 -1.14 115.64 120.40 3k1w s THR 278 Ca -0.00 -0.10 -0.05 0.00 0.31 0.00 0.00 61.69 61.85 3k1w s THR 278 Cb -0.20 -3.08 -0.03 0.00 0.01 0.00 0.00 72.50 69.19 3k1w s THR 278 CO 0.03 0.44 0.02 -0.76 -0.69 0.00 0.00 174.62 173.66 3k1w s LEU 279 N 0.60 3.60 0.69 4.42 1.43 0.34 -4.97 118.68 124.79 3k1w s LEU 279 Ca 0.03 0.04 -0.03 0.00 -1.03 0.00 0.00 54.13 53.14 3k1w s LEU 279 Cb -0.13 -1.87 0.10 0.00 0.03 0.00 0.00 46.19 44.31 3k1w s LEU 279 CO 0.02 0.23 0.97 0.42 0.23 0.00 0.00 176.35 178.22 3k1w s THR 280 N 0.01 2.28 0.32 5.49 -4.23 -1.26 -0.88 115.64 117.37 3k1w s THR 280 Ca 0.04 -0.50 0.07 0.00 -1.18 0.00 0.00 61.69 60.12 3k1w s THR 280 Cb -0.13 -2.78 0.31 0.00 1.34 0.00 0.00 72.50 71.24 3k1w s THR 280 CO 0.02 0.00 1.81 0.77 -0.54 0.00 0.00 174.62 176.67 3k1w h SER 281 N -0.48 0.74 0.06 3.99 4.64 -1.78 0.43 113.55 121.14 3k1w h SER 281 Ca -0.40 0.07 -0.00 0.00 -0.47 0.00 0.00 61.79 60.99 3k1w h SER 281 Cb 1.28 -0.06 -0.00 0.00 -0.31 0.00 0.00 62.40 63.31 3k1w h SER 281 CO 0.47 0.30 -0.01 0.00 -0.87 0.00 0.00 176.83 176.72 3k1w h ALA 282 N 1.62 1.24 0.00 5.18 0.00 -1.88 -0.66 119.26 124.75 3k1w h ALA 282 Ca 0.54 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.44 3k1w h ALA 282 Cb 0.86 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3k1w h ALA 282 CO -0.31 0.01 -0.63 -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 -1.27 -3.40 116.42 115.07 3k1w h ASP 283 Ca -0.00 -0.17 0.00 0.00 0.02 0.00 0.00 57.03 56.88 3k1w h ASP 283 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 3k1w h ASP 283 CO 0.00 0.09 0.00 0.00 -1.72 0.00 0.00 179.24 177.61 3k1w n TYR 284 N -2.22 0.00 -4.20 4.55 0.18 -0.79 -4.93 117.16 109.74 3k1w n TYR 284 Ca 0.03 0.00 -0.34 0.00 1.88 0.00 0.00 57.90 59.47 3k1w n TYR 284 Cb 0.46 0.00 -0.11 0.00 -0.38 0.00 0.00 39.34 39.31 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 -0.03 4.35 -0.99 -3.48 1.01 -0.32 -0.08 120.40 120.86 3k1w s VAL 285 Ca 0.00 -0.19 -0.23 0.00 0.00 0.00 0.00 61.98 61.56 3k1w s VAL 285 Cb 0.00 -2.93 0.06 0.00 0.00 0.00 0.00 36.38 33.50 3k1w s VAL 285 CO 0.00 0.48 1.41 -0.36 0.00 0.00 0.00 175.10 176.63 3k1w s PHE 286 N 0.32 2.56 -1.33 5.22 0.08 0.35 -4.85 117.98 120.33 3k1w s PHE 286 Ca -0.00 -0.83 -0.17 0.00 0.12 0.00 0.00 56.93 56.05 3k1w s PHE 286 Cb -0.13 -4.66 0.03 0.00 -0.57 0.00 0.00 43.02 37.69 3k1w s PHE 286 CO 0.01 -1.91 2.00 0.94 -0.10 0.00 0.00 175.22 176.17 3k1w n GLN 287 N 8.71 2.82 0.00 0.44 -0.06 -1.26 -3.99 117.38 124.04 3k1w n GLN 287 Ca 0.30 -2.80 0.14 0.00 -2.00 0.00 0.00 57.00 52.64 3k1w n GLN 287 Cb 0.51 -3.37 0.65 0.00 -4.06 0.00 0.00 30.24 23.97 3k1w n GLN 287 CO 0.00 0.00 0.00 0.39 -0.20 0.00 0.00 177.06 177.25 3k1w n GLU 288 N 7.16 0.24 -3.66 3.69 1.02 -1.26 -4.85 120.64 122.98 3k1w n GLU 288 Ca 0.50 -0.03 -0.07 0.00 -0.02 0.00 0.00 57.16 57.55 3k1w n GLU 288 Cb 0.42 -1.50 -0.02 0.00 -0.02 0.00 0.00 31.44 30.33 3k1w n GLU 288 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 3k1w s SER 289 N -2.78 -0.30 -0.03 1.62 0.15 -1.26 -5.04 113.70 106.06 3k1w s SER 289 Ca 0.21 -0.29 0.07 0.00 0.70 0.00 0.00 55.95 56.64 3k1w s SER 289 Cb 0.20 0.53 0.16 0.00 -1.71 0.00 0.00 66.02 65.20 3k1w s SER 289 CO 0.51 -0.94 1.12 -1.22 1.20 0.00 0.00 173.24 173.92 3k1w n TYR 290 N -0.40 0.20 -2.60 3.44 4.01 -1.26 -4.71 117.16 115.84 3k1w n TYR 290 Ca -0.08 -0.59 -0.41 0.00 -0.16 0.00 0.00 57.90 56.67 3k1w n TYR 290 Cb 0.61 -0.08 -0.05 0.00 -0.31 0.00 0.00 39.34 39.52 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 -1.30 7.41 0.16 7.72 0.15 -1.26 -3.36 113.70 123.23 3k1w s SER 291 Ca 0.14 2.05 0.17 0.00 0.70 0.00 0.00 55.95 59.01 3k1w s SER 291 Cb 0.09 -2.61 0.78 0.00 -1.71 0.00 0.00 66.02 62.57 3k1w s SER 291 CO 0.06 -0.07 1.53 -1.54 1.20 0.00 0.00 173.24 174.41 3k1w n SER 292 N 1.88 0.37 -0.80 5.45 3.41 -1.26 -2.60 113.62 120.06 3k1w n SER 292 Ca 0.00 0.62 0.12 0.00 -0.26 0.00 0.00 58.87 59.35 3k1w n SER 292 Cb 0.46 -0.69 0.29 0.00 -0.26 0.00 0.00 64.21 64.02 3k1w n SER 292 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3k1w n LYS 293 N -1.94 2.08 -4.33 4.33 4.01 -1.26 -4.81 118.16 116.24 3k1w n LYS 293 Ca 0.01 -1.59 -0.22 0.00 -0.51 0.00 0.00 58.31 56.00 3k1w n LYS 293 Cb 0.14 -1.46 -0.11 0.00 -0.51 0.00 0.00 35.03 33.08 3k1w n LYS 293 CO 0.00 0.00 0.00 0.15 -1.11 0.00 0.00 177.40 176.44 3k1w s LYS 294 N -1.82 1.26 -0.11 1.97 -0.14 -1.07 -5.06 119.74 114.76 3k1w s LYS 294 Ca 0.34 -1.39 -0.01 0.00 -1.36 0.00 0.00 55.97 53.55 3k1w s LYS 294 Cb 0.20 -1.32 -0.03 0.00 -1.68 0.00 0.00 37.83 35.00 3k1w s LYS 294 CO 0.30 0.27 -0.05 -0.51 -0.76 0.00 0.00 175.35 174.61 3k1w s LEU 295 N -2.62 3.26 -0.12 3.17 1.43 -1.26 -0.90 118.68 121.65 3k1w s LEU 295 Ca 0.15 -0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 3k1w s LEU 295 Cb -0.06 -1.75 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 3k1w s LEU 295 CO 0.06 0.28 -0.14 0.00 0.23 0.00 0.00 176.35 176.79 3k1w s THR 297 N 0.16 4.51 0.01 0.00 2.01 -1.26 -1.08 115.64 120.00 3k1w s THR 297 Ca -0.07 1.32 -0.03 0.00 0.31 0.00 0.00 61.69 63.21 3k1w s THR 297 Cb -0.15 -3.79 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 3k1w s THR 297 CO 0.05 0.02 0.22 -0.76 -0.69 0.00 0.00 174.62 173.46 3k1w s LEU 298 N -2.42 4.36 -0.22 4.42 1.43 -0.94 -0.50 118.68 124.82 3k1w s LEU 298 Ca 0.50 0.41 -0.00 0.00 -1.03 0.00 0.00 54.13 54.00 3k1w s LEU 298 Cb -0.14 -2.72 0.19 0.00 0.03 0.00 0.00 46.19 43.55 3k1w s LEU 298 CO 0.19 0.24 1.79 0.00 0.23 0.00 0.00 176.35 178.80 3k1w n ALA 299 N 0.85 4.47 -3.70 4.21 0.00 0.89 -4.71 120.51 122.51 3k1w n ALA 299 Ca -0.10 -1.22 -0.20 0.00 0.00 0.00 0.00 53.44 51.93 3k1w n ALA 299 Cb 0.52 -1.25 -0.17 0.00 0.00 0.00 0.00 19.45 18.56 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 -1.60 0.32 0.18 0.00 1.01 -1.26 -2.46 121.20 117.38 3k1w s ILE 300 Ca 0.23 0.06 0.03 0.00 0.00 0.00 0.00 60.65 60.97 3k1w s ILE 300 Cb 0.19 -0.42 -0.05 0.00 0.01 0.00 0.00 42.46 42.19 3k1w s ILE 300 CO 0.01 0.20 -0.04 -1.00 0.00 0.00 0.00 174.94 174.12 3k1w s HIS 301 N 1.32 1.34 0.05 3.97 3.76 -0.20 -4.67 115.29 120.86 3k1w s HIS 301 Ca -0.05 -0.90 -0.23 0.00 -0.15 0.00 0.00 55.06 53.73 3k1w s HIS 301 Cb -0.13 -0.74 -0.06 0.00 1.11 0.00 0.00 32.58 32.75 3k1w s HIS 301 CO -0.02 -0.05 0.68 0.00 -0.85 0.00 0.00 174.74 174.50 3k1w s ALA 302 N -3.47 3.45 -0.15 -1.40 0.00 -1.26 -2.38 121.76 116.55 3k1w s ALA 302 Ca 0.23 0.18 -0.06 0.00 0.00 0.00 0.00 51.96 52.31 3k1w s ALA 302 Cb 0.05 -2.86 0.07 0.00 0.00 0.00 0.00 23.12 20.38 3k1w s ALA 302 CO 0.04 0.19 0.33 1.41 0.00 0.00 0.00 175.76 177.73 3k1w s MET 303 N -0.45 0.23 -0.61 0.00 0.00 0.13 -4.89 119.30 113.71 3k1w s MET 303 Ca 0.34 0.84 -0.19 0.00 0.00 0.00 0.00 55.69 56.68 3k1w s MET 303 Cb -0.20 0.09 0.10 0.00 0.00 0.00 0.00 34.83 34.82 3k1w s MET 303 CO 0.21 -0.25 0.74 -0.51 0.00 0.00 0.00 175.02 175.21 3k1w s ASP 304 N 2.33 6.21 -0.18 1.11 1.01 -1.26 -3.87 116.67 122.01 3k1w s ASP 304 Ca -0.01 -1.44 -0.25 0.00 0.71 0.00 0.00 52.55 51.56 3k1w s ASP 304 Cb -0.12 -2.31 -0.01 0.00 1.01 0.00 0.00 42.92 41.49 3k1w s ASP 304 CO -0.10 -1.14 0.83 -0.63 0.21 0.00 0.00 175.17 174.34 3k1w s ILE 305 N 2.76 4.87 0.68 0.77 1.01 -1.26 -5.04 121.20 125.00 3k1w s ILE 305 Ca 0.13 1.63 -0.11 0.00 0.00 0.00 0.00 60.65 62.30 3k1w s ILE 305 Cb -0.23 -4.14 0.00 0.00 0.01 0.00 0.00 42.46 38.11 3k1w s ILE 305 CO 0.06 0.01 1.06 -2.84 0.00 0.00 0.00 174.94 173.23 3k1w s PRO 306 N 2.25 2.98 0.75 2.79 0.02 -1.26 -2.96 135.00 139.57 3k1w s PRO 306 Ca 0.38 0.98 -0.16 0.00 0.02 0.00 0.00 61.00 62.22 3k1w s PRO 306 Cb -0.16 -2.00 -0.04 0.00 0.02 0.00 0.00 34.50 32.32 3k1w s PRO 306 CO 0.12 -1.06 0.42 -2.30 -0.33 0.00 0.00 177.00 173.84 3k1w n PRO 307 N -3.02 0.20 0.07 5.54 -0.02 -0.92 -1.03 135.00 135.82 3k1w n PRO 307 Ca 0.08 0.10 -0.12 0.00 -2.02 0.00 0.00 63.50 61.54 3k1w n PRO 307 Cb 0.53 -1.75 -0.03 0.00 -0.02 0.00 0.00 33.50 32.23 3k1w n PRO 307 CO 0.00 0.00 0.00 -1.00 1.98 0.00 0.00 175.50 176.48 3k1w h PRO 308 N -0.54 0.34 -0.48 0.52 0.13 -2.04 -3.44 132.00 126.49 3k1w h PRO 308 Ca -0.45 -0.37 -0.02 0.00 -0.87 0.00 0.00 66.00 64.30 3k1w h PRO 308 Cb 1.34 0.10 -0.02 0.00 0.13 0.00 0.00 31.00 32.55 3k1w h PRO 308 CO 0.40 1.05 0.22 0.00 -0.23 0.00 0.00 178.00 179.45 3k1w h THR 309 N 0.19 1.20 -1.85 1.56 1.03 -1.93 -3.44 112.91 109.66 3k1w h THR 309 Ca -0.07 -0.57 -0.46 0.00 -0.01 0.00 0.00 66.41 65.30 3k1w h THR 309 Cb 1.55 0.68 0.06 0.00 -1.07 0.00 0.00 68.15 69.37 3k1w h THR 309 CO 0.15 0.22 -0.00 -0.83 -0.01 0.00 0.00 175.52 175.05 3k1w s GLY 310 N -2.95 1.78 0.45 2.99 0.00 -0.20 -4.58 107.32 104.81 3k1w s GLY 310 Ca -0.13 -1.74 -0.24 0.00 0.00 0.00 0.00 44.72 42.62 3k1w s GLY 310 CO 0.76 -1.28 1.18 -4.14 0.00 0.00 0.00 173.10 169.62 3k1w s PRO 311 N -4.89 3.82 -0.05 2.90 0.02 -1.16 -2.16 135.00 133.48 3k1w s PRO 311 Ca 0.62 1.83 -0.29 0.00 0.02 0.00 0.00 61.00 63.18 3k1w s PRO 311 Cb -0.07 -2.49 0.10 0.00 0.02 0.00 0.00 34.50 32.06 3k1w s PRO 311 CO 0.41 -0.52 0.83 -0.08 -0.33 0.00 0.00 177.00 177.31 3k1w s THR 312 N -1.49 0.00 0.67 0.99 -1.32 -1.26 -4.73 115.64 108.50 3k1w s THR 312 Ca 0.62 0.00 -0.11 0.00 -1.21 0.00 0.00 61.69 60.99 3k1w s THR 312 Cb -0.30 -1.00 -0.01 0.00 -1.51 0.00 0.00 72.50 69.68 3k1w s THR 312 CO 0.37 0.00 1.05 0.26 -2.21 0.00 0.00 174.62 174.09 3k1w s TRP 313 N -2.03 3.22 -0.06 9.09 0.52 -0.03 -4.39 118.94 125.25 3k1w s TRP 313 Ca -0.02 1.40 0.02 0.00 0.02 0.00 0.00 56.10 57.52 3k1w s TRP 313 Cb -0.01 -2.86 0.02 0.00 -1.15 0.00 0.00 33.47 29.47 3k1w s TRP 313 CO -0.01 -1.09 -0.10 0.00 0.02 0.00 0.00 176.95 175.77 3k1w s ALA 314 N -3.01 1.08 -0.48 0.98 0.00 -0.12 -0.80 121.76 119.41 3k1w s ALA 314 Ca 0.58 -0.31 -0.13 0.00 0.00 0.00 0.00 51.96 52.10 3k1w s ALA 314 Cb -0.13 -0.53 0.10 0.00 0.00 0.00 0.00 23.12 22.55 3k1w s ALA 314 CO 0.53 0.06 0.39 -0.51 0.00 0.00 0.00 175.76 176.22 3k1w s LEU 315 N 0.78 5.72 0.00 0.00 1.43 0.66 -0.95 118.68 126.31 3k1w s LEU 315 Ca -0.13 -1.62 0.00 0.00 -1.03 0.00 0.00 54.13 51.35 3k1w s LEU 315 Cb -0.15 -2.12 0.00 0.00 0.03 0.00 0.00 46.19 43.95 3k1w s LEU 315 CO 0.02 -0.70 0.00 0.61 0.23 0.00 0.00 176.35 176.51 3k1w n GLY 316 N 5.10 2.31 0.37 -3.19 0.00 -0.68 -1.21 105.19 107.89 3k1w n GLY 316 Ca -0.11 -1.93 0.15 0.00 0.00 0.00 0.00 46.02 44.12 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 -0.79 2.11 -0.99 4.61 0.00 -0.94 -0.05 119.26 123.21 3k1w h ALA 317 Ca 0.00 -0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.07 3k1w h ALA 317 Cb 0.00 -0.06 -0.10 0.00 0.00 0.00 0.00 17.79 17.63 3k1w h ALA 317 CO 0.00 -0.30 0.60 1.15 0.00 0.00 0.00 179.25 180.71 3k1w h THR 318 N 0.39 0.76 0.15 0.00 2.02 -1.77 -0.49 112.91 113.98 3k1w h THR 318 Ca 0.34 -0.28 -0.25 0.00 0.77 0.00 0.00 66.41 67.00 3k1w h THR 318 Cb 0.78 -0.12 0.01 0.00 -1.74 0.00 0.00 68.15 67.09 3k1w h THR 318 CO -0.10 0.15 -1.15 0.15 0.37 0.00 0.00 175.52 174.93 3k1w h PHE 319 N 0.81 0.58 -0.09 3.16 3.04 -1.39 -3.37 116.94 119.69 3k1w h PHE 319 Ca 0.55 -0.42 -0.09 0.00 3.98 0.00 0.00 57.97 61.99 3k1w h PHE 319 Cb 0.77 -0.02 -0.01 0.00 2.56 0.00 0.00 35.95 39.25 3k1w h PHE 319 CO -0.01 1.45 -0.34 0.82 -2.02 0.00 0.00 178.31 178.21 3k1w h ILE 320 N -0.26 1.27 -0.94 1.41 2.04 -0.90 -1.72 117.51 118.41 3k1w h ILE 320 Ca -0.22 -1.29 0.16 0.00 1.00 0.00 0.00 64.86 64.51 3k1w h ILE 320 Cb 1.78 1.58 -0.10 0.00 -0.74 0.00 0.00 36.82 39.34 3k1w h ILE 320 CO 0.14 0.38 0.54 0.03 0.00 0.00 0.00 178.15 179.24 3k1w h ARG 321 N 0.15 0.73 0.14 2.37 3.08 -1.25 -2.61 114.38 116.99 3k1w h ARG 321 Ca 0.02 -0.04 -0.31 0.00 0.07 0.00 0.00 59.98 59.72 3k1w h ARG 321 Cb 0.67 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.56 3k1w h ARG 321 CO 0.05 0.48 -1.48 -0.22 -1.07 0.00 0.00 179.97 177.73 3k1w h LYS 322 N 0.75 0.30 -4.75 0.04 3.64 -1.57 -3.44 116.57 111.54 3k1w h LYS 322 Ca 0.51 -0.51 -0.67 0.00 -1.27 0.00 0.00 60.65 58.71 3k1w h LYS 322 Cb 0.72 0.19 -0.38 0.00 -0.41 0.00 0.00 32.23 32.34 3k1w h LYS 322 CO -0.35 1.19 -0.74 -0.06 -2.27 0.00 0.00 179.45 177.22 3k1w s PHE 323 N -2.62 3.55 0.15 1.91 0.08 -0.71 -0.85 117.98 119.50 3k1w s PHE 323 Ca -0.08 -2.68 -0.33 0.00 0.12 0.00 0.00 56.93 53.95 3k1w s PHE 323 Cb 0.06 -2.54 -0.16 0.00 -0.57 0.00 0.00 43.02 39.82 3k1w s PHE 323 CO 0.87 -0.92 1.12 0.98 -0.10 0.00 0.00 175.22 177.18 3k1w n TYR 324 N 4.35 1.14 -4.52 0.36 4.19 0.28 -4.46 117.16 118.49 3k1w n TYR 324 Ca -0.04 0.73 -0.25 0.00 3.31 0.00 0.00 57.90 61.66 3k1w n TYR 324 Cb 0.42 -2.24 -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 -0.19 1.10 -0.14 2.97 2.01 -0.82 -1.52 115.64 119.05 3k1w s THR 325 Ca 0.75 -0.45 -0.01 0.00 0.31 0.00 0.00 61.69 62.28 3k1w s THR 325 Cb -0.90 -1.02 -0.02 0.00 0.01 0.00 0.00 72.50 70.57 3k1w s THR 325 CO 0.53 0.35 -0.10 -0.70 -0.69 0.00 0.00 174.62 174.00 3k1w s GLU 326 N 0.75 3.46 -0.30 4.92 2.12 0.55 -0.33 118.70 129.88 3k1w s GLU 326 Ca -0.13 -0.64 -0.06 0.00 0.36 0.00 0.00 54.97 54.50 3k1w s GLU 326 Cb -0.16 -2.72 0.02 0.00 0.26 0.00 0.00 34.13 31.53 3k1w s GLU 326 CO 0.03 0.21 0.07 -0.06 -0.54 0.00 0.00 175.26 174.97 3k1w s PHE 327 N 0.38 3.16 -0.35 5.30 0.08 0.26 -0.29 117.98 126.52 3k1w s PHE 327 Ca -0.09 -1.11 -0.04 0.00 0.12 0.00 0.00 56.93 55.82 3k1w s PHE 327 Cb -0.15 -2.24 0.07 0.00 -0.57 0.00 0.00 43.02 40.13 3k1w s PHE 327 CO 0.05 -0.62 0.11 0.34 -0.10 0.00 0.00 175.22 175.00 3k1w s ASP 328 N 1.47 5.15 0.22 1.36 -1.08 -0.21 -1.46 116.67 122.12 3k1w s ASP 328 Ca 0.02 -1.53 0.10 0.00 -0.52 0.00 0.00 52.55 50.62 3k1w s ASP 328 Cb -0.18 -1.80 0.13 0.00 -1.46 0.00 0.00 42.92 39.61 3k1w s ASP 328 CO 0.02 -0.39 1.47 0.03 0.52 0.00 0.00 175.17 176.82 3k1w h ARG 329 N 8.08 0.00 -0.54 4.34 2.47 -1.40 -1.20 114.38 126.13 3k1w h ARG 329 Ca -0.19 0.00 0.03 0.00 -1.26 0.00 0.00 59.98 58.56 3k1w h ARG 329 Cb 1.06 0.00 -0.04 0.00 -1.65 0.00 0.00 29.97 29.34 3k1w h ARG 329 CO 0.62 0.74 0.32 -0.09 0.56 0.00 0.00 179.97 182.11 3k1w h ARG 330 N 0.00 0.61 -0.14 0.04 9.65 -1.90 -3.25 114.38 119.38 3k1w h ARG 330 Ca -0.01 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.84 3k1w h ARG 330 Cb 1.38 -0.14 0.00 0.00 -1.39 0.00 0.00 29.97 29.82 3k1w h ARG 330 CO 0.10 0.40 0.00 0.09 2.80 0.00 0.00 179.97 183.36 3k1w n ASN 331 N -4.79 2.23 -3.73 -3.80 4.13 -1.23 -5.02 115.26 103.05 3k1w n ASN 331 Ca 0.04 -1.68 -0.32 0.00 1.68 0.00 0.00 54.58 54.30 3k1w n ASN 331 Cb 0.09 -0.09 0.03 0.00 -1.54 0.00 0.00 39.78 38.27 3k1w n ASN 331 CO 0.00 0.00 0.00 0.59 0.28 0.00 0.00 177.26 178.13 3k1w n ASN 332 N 0.41 -5.23 -3.90 6.41 3.02 -0.49 -4.88 115.26 110.59 3k1w n ASN 332 Ca 0.07 -1.01 -0.09 0.00 -0.03 0.00 0.00 54.58 53.51 3k1w n ASN 332 Cb 0.30 -3.04 -0.06 0.00 -0.61 0.00 0.00 39.78 36.38 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 -5.99 1.30 -0.06 3.52 1.04 -0.97 -1.68 118.95 116.11 3k1w s ARG 333 Ca 0.42 -1.10 0.06 0.00 -1.04 0.00 0.00 55.73 54.06 3k1w s ARG 333 Cb -0.17 0.44 -0.01 0.00 -2.04 0.00 0.00 34.95 33.17 3k1w s ARG 333 CO 0.88 -0.51 -0.23 0.42 -0.04 0.00 0.00 175.30 175.81 3k1w s ILE 334 N -3.95 1.92 -0.03 4.99 1.01 -0.29 -1.04 121.20 123.81 3k1w s ILE 334 Ca 0.16 -0.99 0.05 0.00 0.00 0.00 0.00 60.65 59.87 3k1w s ILE 334 Cb 0.01 -1.63 -0.03 0.00 0.01 0.00 0.00 42.46 40.82 3k1w s ILE 334 CO 0.01 0.54 -0.16 -0.83 0.00 0.00 0.00 174.94 174.49 3k1w s GLY 335 N -0.07 1.51 0.03 6.18 0.00 0.60 -0.97 107.32 114.60 3k1w s GLY 335 Ca -0.05 -1.02 0.08 0.00 0.00 0.00 0.00 44.72 43.73 3k1w s GLY 335 CO 0.04 -0.83 -0.24 -1.36 0.00 0.00 0.00 173.10 170.71 3k1w s PHE 336 N -0.74 2.40 0.03 1.90 0.08 -0.21 -0.33 117.98 121.11 3k1w s PHE 336 Ca 0.12 -0.37 -0.01 0.00 0.12 0.00 0.00 56.93 56.79 3k1w s PHE 336 Cb -0.11 -1.44 -0.03 0.00 -0.57 0.00 0.00 43.02 40.88 3k1w s PHE 336 CO 0.01 0.13 -0.01 0.00 -0.10 0.00 0.00 175.22 175.25 3k1w s ALA 337 N -0.80 0.25 -0.05 5.36 0.00 -0.58 -1.42 121.76 124.53 3k1w s ALA 337 Ca 0.12 -0.83 -0.30 0.00 0.00 0.00 0.00 51.96 50.95 3k1w s ALA 337 Cb -0.10 0.21 -0.06 0.00 0.00 0.00 0.00 23.12 23.17 3k1w s ALA 337 CO 0.02 -0.27 1.64 -1.17 0.00 0.00 0.00 175.76 175.99 3k1w s LEU 338 N -2.14 4.32 0.54 0.00 1.98 -1.26 -0.56 118.68 121.57 3k1w s LEU 338 Ca -0.05 2.23 -0.21 0.00 -2.89 0.00 0.00 54.13 53.21 3k1w s LEU 338 Cb -0.02 -3.53 -0.05 0.00 0.66 0.00 0.00 46.19 43.25 3k1w s LEU 338 CO -0.05 -0.92 1.26 0.00 -1.89 0.00 0.00 176.35 174.75 3k1w s ALA 339 N 3.97 2.76 -0.21 5.97 0.00 -0.03 -0.92 121.76 133.31 3k1w s ALA 339 Ca 0.73 1.12 -0.11 0.00 0.00 0.00 0.00 51.96 53.70 3k1w s ALA 339 Cb -0.33 -3.48 -0.05 0.00 0.00 0.00 0.00 23.12 19.26 3k1w s ALA 339 CO 0.29 -1.13 0.17 1.03 0.00 0.00 0.00 175.76 176.12 3k1w s ARG 340 N -3.00 4.17 0.00 0.00 0.52 -0.21 -4.76 118.95 115.67 3k1w s ARG 340 Ca 0.72 -0.18 0.07 0.00 -0.52 0.00 0.00 55.73 55.81 3k1w s ARG 340 Cb -0.34 -3.45 0.05 0.00 0.52 0.00 0.00 34.95 31.73 3k1w s ARG 340 CO 0.39 0.22 0.71 0.72 0.02 0.00 0.00 175.30 177.36