#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k1u s LEU 7 N 0.00 4.17 0.10 1.39 1.43 -1.26 -4.98 118.68 119.52 3k1u s LEU 7 Ca 0.00 0.36 0.06 0.00 -1.03 0.00 0.00 54.13 53.52 3k1u s LEU 7 Cb 0.00 -2.84 -0.04 0.00 0.03 0.00 0.00 46.19 43.34 3k1u s LEU 7 CO 0.00 -0.54 -0.03 0.20 0.23 0.00 0.00 176.35 176.21 3k1u s ASN 8 N 1.69 4.81 0.61 2.29 0.01 -1.26 -3.93 114.94 119.17 3k1u s ASN 8 Ca 0.26 -0.26 -0.14 0.00 -0.71 0.00 0.00 52.86 52.01 3k1u s ASN 8 Cb -0.15 -1.07 -0.03 0.00 0.41 0.00 0.00 41.25 40.42 3k1u s ASN 8 CO 0.13 0.17 1.05 -2.16 -1.51 0.00 0.00 177.10 174.78 3k1u s PRO 9 N -2.30 3.28 0.01 -0.60 0.04 -1.26 -0.93 135.00 133.23 3k1u s PRO 9 Ca 0.24 1.10 -0.01 0.00 0.04 0.00 0.00 61.00 62.37 3k1u s PRO 9 Cb -0.11 -2.03 -0.27 0.00 0.04 0.00 0.00 34.50 32.13 3k1u s PRO 9 CO 0.17 -0.83 0.88 -0.84 0.04 0.00 0.00 177.00 176.41 3k1u h ILE 10 N 0.14 1.17 -3.29 0.56 3.07 -1.18 -3.46 117.51 114.53 3k1u h ILE 10 Ca -0.46 -2.84 -0.32 0.00 1.55 0.00 0.00 64.86 62.79 3k1u h ILE 10 Cb 1.21 2.74 -0.36 0.00 -0.27 0.00 0.00 36.82 40.14 3k1u h ILE 10 CO 0.58 0.81 -0.69 -0.63 -1.05 0.00 0.00 178.15 177.16 3k1u s ILE 11 N -2.62 -0.13 0.43 0.16 1.01 -1.12 -4.06 121.20 114.86 3k1u s ILE 11 Ca -0.08 0.34 -0.22 0.00 0.00 0.00 0.00 60.65 60.69 3k1u s ILE 11 Cb 0.07 -0.18 -0.10 0.00 0.01 0.00 0.00 42.46 42.25 3k1u s ILE 11 CO 0.85 0.14 0.97 0.27 0.00 0.00 0.00 174.94 177.17 3k1u s ILE 12 N 1.86 4.21 -1.31 2.92 -4.36 -1.26 -0.40 121.20 122.85 3k1u s ILE 12 Ca -0.00 1.44 -0.04 0.00 -0.26 0.00 0.00 60.65 61.79 3k1u s ILE 12 Cb -0.12 -3.62 0.01 0.00 1.25 0.00 0.00 42.46 39.98 3k1u s ILE 12 CO -0.04 -0.23 0.98 0.00 0.24 0.00 0.00 174.94 175.89 3k1u n GLN 13 N -0.54 -6.49 -3.84 0.37 6.02 -1.19 -4.86 117.38 106.85 3k1u n GLN 13 Ca 0.07 0.76 -0.19 0.00 -0.01 0.00 0.00 57.00 57.64 3k1u n GLN 13 Cb 0.53 -5.68 -0.17 0.00 1.02 0.00 0.00 30.24 25.94 3k1u n GLN 13 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3k1u s ARG 14 N -5.91 0.26 0.26 -1.09 1.81 -0.81 -4.47 118.95 108.99 3k1u s ARG 14 Ca 0.24 0.15 0.08 0.00 -1.72 0.00 0.00 55.73 54.48 3k1u s ARG 14 Cb -0.11 -0.56 -0.04 0.00 -0.45 0.00 0.00 34.95 33.79 3k1u s ARG 14 CO 0.76 -0.21 0.15 0.00 -0.68 0.00 0.00 175.30 175.33 3k1u s ALA 15 N 1.43 3.49 -1.26 2.13 0.00 -0.90 -3.04 121.76 123.61 3k1u s ALA 15 Ca -0.04 -1.49 -0.00 0.00 0.00 0.00 0.00 51.96 50.43 3k1u s ALA 15 Cb -0.13 -1.17 0.00 0.00 0.00 0.00 0.00 23.12 21.83 3k1u s ALA 15 CO -0.03 0.24 0.85 -0.25 0.00 0.00 0.00 175.76 176.58 3k1u n ASP 16 N -1.12 -1.74 -3.09 0.00 8.00 -1.26 -0.47 116.55 116.86 3k1u n ASP 16 Ca -0.07 -0.72 -0.17 0.00 0.71 0.00 0.00 54.79 54.54 3k1u n ASP 16 Cb 0.58 -4.57 0.14 0.00 -0.02 0.00 0.00 41.12 37.25 3k1u n ASP 16 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 3k1u n PRO 17 N -4.23 -1.99 -3.62 -0.24 -0.04 -1.26 -4.18 135.00 119.44 3k1u n PRO 17 Ca -0.28 -1.00 0.01 0.00 -0.04 0.00 0.00 63.50 62.19 3k1u n PRO 17 Cb 0.67 -0.89 -0.06 0.00 -0.04 0.00 0.00 33.50 33.17 3k1u n PRO 17 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3k1u s ILE 19 N -2.19 -0.01 -0.18 0.52 1.01 -1.26 -4.05 121.20 115.05 3k1u s ILE 19 Ca 0.40 0.00 0.01 0.00 0.00 0.00 0.00 60.65 61.06 3k1u s ILE 19 Cb -0.03 -1.00 0.02 0.00 0.01 0.00 0.00 42.46 41.46 3k1u s ILE 19 CO 0.30 0.00 -0.20 -0.47 0.00 0.00 0.00 174.94 174.58 3k1u s TYR 20 N 1.19 2.76 -0.39 3.97 5.04 0.11 -4.56 117.35 125.47 3k1u s TYR 20 Ca -0.08 -1.65 -0.22 0.00 -2.44 0.00 0.00 57.07 52.69 3k1u s TYR 20 Cb -0.02 -1.91 0.01 0.00 0.35 0.00 0.00 41.96 40.39 3k1u s TYR 20 CO -0.11 -0.81 0.70 0.21 -1.34 0.00 0.00 175.55 174.20 3k1u s LYS 21 N 1.29 3.58 0.61 4.97 2.20 -1.26 -0.50 119.74 130.63 3k1u s LYS 21 Ca 0.05 0.02 -0.01 0.00 -0.36 0.00 0.00 55.97 55.67 3k1u s LYS 21 Cb -0.13 -3.86 0.05 0.00 -1.51 0.00 0.00 37.83 32.38 3k1u s LYS 21 CO -0.13 -0.88 0.86 -1.58 -0.36 0.00 0.00 175.35 173.26 3k1u s HIS 22 N 2.94 2.78 0.23 4.03 5.65 -0.26 -4.99 115.29 125.66 3k1u s HIS 22 Ca 0.27 0.10 0.34 0.00 0.25 0.00 0.00 55.06 56.02 3k1u s HIS 22 Cb -0.14 -2.90 1.80 0.00 -1.18 0.00 0.00 32.58 30.16 3k1u s HIS 22 CO 0.18 -1.10 2.04 -0.91 -0.65 0.00 0.00 174.74 174.30 3k1u h ASN 23 N -0.17 0.00 -0.34 9.88 2.35 -1.96 -3.21 115.58 122.12 3k1u h ASN 23 Ca -0.42 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.33 3k1u h ASN 23 Cb 1.30 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.67 3k1u h ASN 23 CO 0.53 0.00 0.00 -0.90 -1.65 0.00 0.00 177.43 175.41 3k1u n ASP 24 N -2.73 1.93 0.00 5.81 3.85 -1.26 -4.91 116.55 119.24 3k1u n ASP 24 Ca -0.02 -1.96 0.00 0.00 -0.71 0.00 0.00 54.79 52.10 3k1u n ASP 24 Cb 0.09 -0.23 0.00 0.00 -1.35 0.00 0.00 41.12 39.63 3k1u n ASP 24 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3k1u n GLY 25 N 1.09 0.51 3.38 6.12 0.00 -1.21 -5.04 105.19 110.03 3k1u n GLY 25 Ca 0.13 -0.20 -0.23 0.00 0.00 0.00 0.00 46.02 45.72 3k1u n GLY 25 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3k1u s TYR 26 N -2.00 2.01 -0.12 1.61 1.51 -1.26 -4.66 117.35 114.44 3k1u s TYR 26 Ca 0.00 -0.43 -0.13 0.00 -1.01 0.00 0.00 57.07 55.50 3k1u s TYR 26 Cb 0.00 -0.98 -0.05 0.00 -0.11 0.00 0.00 41.96 40.82 3k1u s TYR 26 CO 0.00 0.43 0.30 0.71 -1.11 0.00 0.00 175.55 175.88 3k1u s TYR 27 N -2.06 3.55 -0.08 2.71 2.02 0.40 -1.10 117.35 122.79 3k1u s TYR 27 Ca 0.19 0.68 0.02 0.00 -0.37 0.00 0.00 57.07 57.60 3k1u s TYR 27 Cb -0.06 -2.27 -0.02 0.00 -0.40 0.00 0.00 41.96 39.21 3k1u s TYR 27 CO 0.09 0.41 -0.13 0.71 -1.57 0.00 0.00 175.55 175.06 3k1u s TYR 28 N -0.13 2.77 -0.03 2.71 2.02 0.34 -1.38 117.35 123.64 3k1u s TYR 28 Ca 0.18 -0.28 0.03 0.00 -0.37 0.00 0.00 57.07 56.63 3k1u s TYR 28 Cb -0.14 -1.71 0.00 0.00 -0.40 0.00 0.00 41.96 39.72 3k1u s TYR 28 CO 0.06 0.08 -0.12 0.12 -1.57 0.00 0.00 175.55 174.13 3k1u s PHE 29 N -0.40 1.22 0.22 2.71 5.36 0.02 -0.71 117.98 126.40 3k1u s PHE 29 Ca 0.05 -0.33 0.01 0.00 -0.96 0.00 0.00 56.93 55.69 3k1u s PHE 29 Cb -0.12 -0.85 -0.05 0.00 -0.34 0.00 0.00 43.02 41.66 3k1u s PHE 29 CO 0.02 -0.13 0.09 -0.08 -1.46 0.00 0.00 175.22 173.66 3k1u s THR 30 N 0.20 0.38 0.07 0.12 -1.32 -1.26 -1.72 115.64 112.11 3k1u s THR 30 Ca -0.04 -1.99 -0.27 0.00 -1.21 0.00 0.00 61.69 58.17 3k1u s THR 30 Cb -0.10 -2.48 0.09 0.00 -1.51 0.00 0.00 72.50 68.50 3k1u s THR 30 CO 0.01 -0.10 1.14 0.00 -2.21 0.00 0.00 174.62 173.46 3k1u s ALA 31 N -3.88 -1.96 -0.07 11.08 0.00 -1.26 -4.56 121.76 121.10 3k1u s ALA 31 Ca 0.35 0.33 -0.30 0.00 0.00 0.00 0.00 51.96 52.35 3k1u s ALA 31 Cb 0.07 0.54 -0.03 0.00 0.00 0.00 0.00 23.12 23.70 3k1u s ALA 31 CO 0.11 -1.06 1.16 -1.12 0.00 0.00 0.00 175.76 174.85 3k1u s SER 32 N -3.06 7.08 0.41 0.00 0.01 0.37 -4.53 113.70 114.00 3k1u s SER 32 Ca 0.15 1.75 -0.09 0.00 1.31 0.00 0.00 55.95 59.07 3k1u s SER 32 Cb 0.01 -2.56 -0.06 0.00 0.21 0.00 0.00 66.02 63.63 3k1u s SER 32 CO -0.00 -0.57 0.76 0.68 0.41 0.00 0.00 173.24 174.52 3k1u s VAL 33 N 2.24 4.82 0.37 3.43 -7.23 -1.26 -2.11 120.40 120.65 3k1u s VAL 33 Ca 0.54 0.52 0.27 0.00 -1.81 0.00 0.00 61.98 61.51 3k1u s VAL 33 Cb -0.23 -3.76 0.29 0.00 0.56 0.00 0.00 36.38 33.24 3k1u s VAL 33 CO 0.21 -0.57 2.03 -0.65 -0.31 0.00 0.00 175.10 175.81 3k1u h PRO 34 N 1.09 0.00 0.00 4.82 0.11 -1.92 0.54 132.00 136.64 3k1u h PRO 34 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 3k1u h PRO 34 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3k1u h PRO 34 CO 0.64 0.13 0.00 0.39 -0.21 0.00 0.00 178.00 178.95 3k1u n GLU 35 N -3.57 0.17 -4.02 1.05 4.71 -1.26 -4.95 120.64 112.77 3k1u n GLU 35 Ca -0.01 0.20 -0.29 0.00 -0.01 0.00 0.00 57.16 57.04 3k1u n GLU 35 Cb 0.27 -1.72 -0.01 0.00 -1.01 0.00 0.00 31.44 28.97 3k1u n GLU 35 CO 0.00 0.00 0.00 0.66 0.09 0.00 0.00 177.13 177.88 3k1u n TYR 36 N -2.01 -1.78 -0.41 -0.32 4.01 0.18 -4.86 117.16 111.97 3k1u n TYR 36 Ca 0.05 0.79 0.00 0.00 -0.16 0.00 0.00 57.90 58.58 3k1u n TYR 36 Cb 0.36 -3.55 0.00 0.00 -0.31 0.00 0.00 39.34 35.83 3k1u n TYR 36 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 3k1u n ASP 37 N -2.87 0.78 -3.68 7.72 5.75 -1.26 -0.83 116.55 122.17 3k1u n ASP 37 Ca -0.14 -1.19 -0.03 0.00 -0.01 0.00 0.00 54.79 53.42 3k1u n ASP 37 Cb 0.60 0.00 -0.01 0.00 -1.03 0.00 0.00 41.12 40.68 3k1u n ASP 37 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3k1u s ARG 38 N -0.19 0.90 -0.28 0.11 1.70 -1.26 -1.25 118.95 118.67 3k1u s ARG 38 Ca 0.00 -0.47 -0.02 0.00 -0.47 0.00 0.00 55.73 54.77 3k1u s ARG 38 Cb 0.00 0.32 0.04 0.00 -0.57 0.00 0.00 34.95 34.74 3k1u s ARG 38 CO 0.00 -0.41 -0.01 0.42 -1.08 0.00 0.00 175.30 174.22 3k1u s ILE 39 N -3.00 3.03 -0.00 4.99 1.01 -0.11 -4.66 121.20 122.45 3k1u s ILE 39 Ca 0.12 -1.23 -0.00 0.00 0.00 0.00 0.00 60.65 59.53 3k1u s ILE 39 Cb 0.00 -2.67 -0.04 0.00 0.01 0.00 0.00 42.46 39.77 3k1u s ILE 39 CO -0.01 -0.00 0.07 -1.83 0.00 0.00 0.00 174.94 173.17 3k1u s GLU 40 N 1.29 3.03 0.03 2.79 -1.05 -1.26 -0.97 118.70 122.57 3k1u s GLU 40 Ca -0.03 -0.50 0.03 0.00 -0.15 0.00 0.00 54.97 54.32 3k1u s GLU 40 Cb -0.19 -2.84 -0.02 0.00 -0.44 0.00 0.00 34.13 30.65 3k1u s GLU 40 CO -0.02 0.65 -0.10 0.08 0.95 0.00 0.00 175.26 176.81 3k1u s VAL 41 N -1.18 0.80 0.11 1.83 1.01 -0.07 -4.24 120.40 118.66 3k1u s VAL 41 Ca 0.22 -0.90 -0.05 0.00 0.00 0.00 0.00 61.98 61.26 3k1u s VAL 41 Cb -0.12 -0.76 -0.02 0.00 0.00 0.00 0.00 36.38 35.47 3k1u s VAL 41 CO 0.13 -0.11 0.12 0.00 0.00 0.00 0.00 175.10 175.24 3k1u s ARG 42 N -1.12 0.89 0.02 2.72 1.70 -0.70 -0.38 118.95 122.09 3k1u s ARG 42 Ca -0.02 -1.22 0.00 0.00 -0.47 0.00 0.00 55.73 54.02 3k1u s ARG 42 Cb -0.08 0.29 -0.02 0.00 -0.57 0.00 0.00 34.95 34.57 3k1u s ARG 42 CO 0.01 -0.27 -0.03 -1.59 -1.08 0.00 0.00 175.30 172.34 3k1u s LYS 43 N -3.96 0.31 0.15 3.89 -2.85 -1.26 -0.80 119.74 115.23 3k1u s LYS 43 Ca 0.14 -0.60 -0.20 0.00 -1.00 0.00 0.00 55.97 54.31 3k1u s LYS 43 Cb 0.06 0.08 0.06 0.00 -2.06 0.00 0.00 37.83 35.97 3k1u s LYS 43 CO -0.04 -0.04 0.53 0.00 0.10 0.00 0.00 175.35 175.90 3k1u s ALA 44 N -1.41 -1.34 -0.07 0.59 0.00 -0.48 -4.77 121.76 114.27 3k1u s ALA 44 Ca -0.15 0.26 0.25 0.00 0.00 0.00 0.00 51.96 52.32 3k1u s ALA 44 Cb -0.10 0.82 0.76 0.00 0.00 0.00 0.00 23.12 24.61 3k1u s ALA 44 CO -0.01 -0.73 1.76 -0.22 0.00 0.00 0.00 175.76 176.55 3k1u h LYS 45 N 2.13 0.00 -5.02 0.00 1.63 -1.86 0.11 116.57 113.56 3k1u h LYS 45 Ca -0.33 0.00 -0.34 0.00 -0.85 0.00 0.00 60.65 59.13 3k1u h LYS 45 Cb 1.29 0.00 -0.14 0.00 -0.60 0.00 0.00 32.23 32.77 3k1u h LYS 45 CO 0.41 0.14 -0.68 0.95 -3.45 0.00 0.00 179.45 176.81 3k1u s THR 46 N -3.44 1.03 0.06 1.00 -4.23 -1.26 -4.67 115.64 104.13 3k1u s THR 46 Ca 0.03 -2.03 -0.24 0.00 -1.18 0.00 0.00 61.69 58.27 3k1u s THR 46 Cb 0.08 -2.08 -0.16 0.00 1.34 0.00 0.00 72.50 71.68 3k1u s THR 46 CO 0.64 -0.54 1.60 0.40 -0.54 0.00 0.00 174.62 176.17 3k1u h ILE 47 N 2.65 1.12 -0.62 2.99 2.04 -1.96 -2.21 117.51 121.53 3k1u h ILE 47 Ca -0.37 -0.35 0.08 0.00 1.00 0.00 0.00 64.86 65.22 3k1u h ILE 47 Cb 1.20 1.33 -0.04 0.00 -0.74 0.00 0.00 36.82 38.58 3k1u h ILE 47 CO 0.64 0.09 0.41 -0.08 0.00 0.00 0.00 178.15 179.21 3k1u h GLU 48 N -0.12 0.50 -0.00 2.37 4.22 -1.97 -1.60 114.58 117.98 3k1u h GLU 48 Ca 0.01 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.42 3k1u h GLU 48 Cb 0.15 -0.11 -0.00 0.00 0.50 0.00 0.00 28.75 29.28 3k1u h GLU 48 CO -0.00 0.33 0.02 0.78 -2.18 0.00 0.00 179.01 177.96 3k1u h GLY 49 N 0.52 0.00 2.00 1.92 0.00 -1.80 -2.14 103.07 103.57 3k1u h GLY 49 Ca 0.28 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.57 3k1u h GLY 49 CO -0.08 0.00 -0.17 1.41 0.00 0.00 0.00 176.54 177.70 3k1u h LEU 50 N 0.00 0.00 -0.40 3.11 3.38 -1.21 -2.61 115.31 117.58 3k1u h LEU 50 Ca 0.00 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.04 3k1u h LEU 50 Cb 0.04 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.73 3k1u h LEU 50 CO -0.00 0.17 0.07 -0.09 0.09 0.00 0.00 178.44 178.67 3k1u h ARG 51 N 0.00 0.19 -0.02 1.13 2.43 -1.53 -2.85 114.38 113.73 3k1u h ARG 51 Ca -0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3k1u h ARG 51 Cb 0.43 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.94 3k1u h ARG 51 CO 0.02 0.12 -0.05 0.09 -1.51 0.00 0.00 179.97 178.65 3k1u n ASN 52 N -5.11 2.29 -4.76 -3.80 3.02 -1.12 -4.94 115.26 100.83 3k1u n ASN 52 Ca 0.03 -1.73 -0.40 0.00 -0.03 0.00 0.00 54.58 52.45 3k1u n ASN 52 Cb 0.19 0.04 -0.04 0.00 -0.61 0.00 0.00 39.78 39.36 3k1u n ASN 52 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k1u s ALA 53 N -2.06 3.38 -0.19 5.41 0.00 -1.00 -4.97 121.76 122.33 3k1u s ALA 53 Ca 0.31 0.91 -0.28 0.00 0.00 0.00 0.00 51.96 52.89 3k1u s ALA 53 Cb 0.20 -3.33 -0.00 0.00 0.00 0.00 0.00 23.12 19.99 3k1u s ALA 53 CO 0.34 -0.21 0.99 -1.21 0.00 0.00 0.00 175.76 175.68 3k1u s GLU 54 N -1.58 4.31 0.39 0.00 0.41 -1.26 -4.92 118.70 116.04 3k1u s GLU 54 Ca 0.46 1.30 -0.18 0.00 -0.41 0.00 0.00 54.97 56.15 3k1u s GLU 54 Cb -0.32 -3.60 -0.10 0.00 -1.78 0.00 0.00 34.13 28.33 3k1u s GLU 54 CO 0.41 -0.50 0.85 -1.25 -0.49 0.00 0.00 175.26 174.28 3k1u s PRO 55 N 2.70 4.09 -0.09 0.39 0.04 -1.26 -4.66 135.00 136.22 3k1u s PRO 55 Ca 0.44 0.88 0.03 0.00 0.04 0.00 0.00 61.00 62.38 3k1u s PRO 55 Cb -0.16 -2.30 0.01 0.00 0.04 0.00 0.00 34.50 32.09 3k1u s PRO 55 CO 0.10 0.04 -0.17 0.08 0.04 0.00 0.00 177.00 177.09 3k1u s VAL 56 N -2.13 1.53 -0.52 -0.36 1.01 0.49 -4.94 120.40 115.48 3k1u s VAL 56 Ca 0.58 -0.70 -0.28 0.00 0.00 0.00 0.00 61.98 61.59 3k1u s VAL 56 Cb -0.10 -1.37 0.03 0.00 0.00 0.00 0.00 36.38 34.95 3k1u s VAL 56 CO 0.17 0.44 1.10 -1.81 0.00 0.00 0.00 175.10 175.00 3k1u s ASP 57 N 0.65 6.52 0.11 3.32 1.01 -1.26 -0.90 116.67 126.11 3k1u s ASP 57 Ca -0.14 0.20 0.23 0.00 0.71 0.00 0.00 52.55 53.56 3k1u s ASP 57 Cb -0.16 -2.52 0.11 0.00 1.01 0.00 0.00 42.92 41.35 3k1u s ASP 57 CO 0.04 -1.29 1.09 1.33 0.21 0.00 0.00 175.17 176.55 3k1u n VAL 58 N 6.66 0.33 -3.66 -1.27 0.24 -0.14 -4.92 118.33 115.57 3k1u n VAL 58 Ca 0.09 -0.34 -0.14 0.00 -2.04 0.00 0.00 64.34 61.90 3k1u n VAL 58 Cb 0.49 -0.05 -0.08 0.00 -1.47 0.00 0.00 33.84 32.73 3k1u n VAL 58 CO 0.00 0.00 0.00 0.86 -2.14 0.00 0.00 176.83 175.55 3k1u s TRP 59 N -3.25 -0.64 0.09 6.34 -0.00 -1.21 -4.94 118.94 115.35 3k1u s TRP 59 Ca 0.03 1.50 0.06 0.00 -0.00 0.00 0.00 56.10 57.69 3k1u s TRP 59 Cb 0.13 0.24 -0.03 0.00 -0.00 0.00 0.00 33.47 33.80 3k1u s TRP 59 CO 0.78 -0.35 -0.16 0.50 -0.00 0.00 0.00 176.95 177.72 3k1u s ARG 60 N 0.10 0.97 0.60 5.86 3.52 -1.26 -0.94 118.95 127.79 3k1u s ARG 60 Ca -0.02 -1.09 -0.19 0.00 -0.13 0.00 0.00 55.73 54.31 3k1u s ARG 60 Cb -0.04 -1.04 -0.05 0.00 -1.56 0.00 0.00 34.95 32.26 3k1u s ARG 60 CO 0.02 0.23 0.99 2.89 -0.81 0.00 0.00 175.30 178.62 3k1u n ARG 61 N 1.05 0.95 -1.45 5.12 1.85 -0.38 -4.97 116.66 118.83 3k1u n ARG 61 Ca -0.19 0.37 -0.32 0.00 -1.00 0.00 0.00 57.85 56.71 3k1u n ARG 61 Cb 0.54 -2.19 0.07 0.00 -1.05 0.00 0.00 32.46 29.84 3k1u n ARG 61 CO 0.00 0.00 0.00 -1.01 -0.01 0.00 0.00 177.63 176.61 3k1u s HIS 62 N -1.49 2.60 0.16 2.89 3.76 -1.26 -4.96 115.29 116.99 3k1u s HIS 62 Ca 0.76 1.55 -0.13 0.00 -0.15 0.00 0.00 55.06 57.09 3k1u s HIS 62 Cb -0.42 -3.09 0.04 0.00 1.11 0.00 0.00 32.58 30.22 3k1u s HIS 62 CO 0.47 -1.75 1.67 1.49 -0.85 0.00 0.00 174.74 175.77 3k1u h GLU 63 N -0.69 0.85 -3.98 1.40 4.81 -1.93 -3.38 114.58 111.66 3k1u h GLU 63 Ca -0.45 -0.20 -0.12 0.00 -0.13 0.00 0.00 59.36 58.46 3k1u h GLU 63 Cb 1.24 -0.11 -0.12 0.00 0.63 0.00 0.00 28.75 30.39 3k1u h GLU 63 CO 0.52 0.80 -0.32 -1.54 -0.73 0.00 0.00 179.01 177.75 3k1u s SER 64 N -6.18 0.02 0.00 1.04 1.04 -1.26 -4.95 113.70 103.40 3k1u s SER 64 Ca -0.13 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 55.27 3k1u s SER 64 Cb 0.12 0.48 0.00 0.00 0.10 0.00 0.00 66.02 66.72 3k1u s SER 64 CO 0.80 -0.98 0.00 0.61 0.98 0.00 0.00 173.24 174.65 3k1u n GLY 65 N -0.30 -1.47 3.56 7.32 0.00 -1.26 -4.55 105.19 108.49 3k1u n GLY 65 Ca -0.02 -1.46 -0.31 0.00 0.00 0.00 0.00 46.02 44.23 3k1u n GLY 65 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3k1u s GLU 66 N 0.00 2.86 0.00 1.61 -1.05 -1.26 -4.16 118.70 116.69 3k1u s GLU 66 Ca 0.00 -0.73 0.00 0.00 -0.15 0.00 0.00 54.97 54.09 3k1u s GLU 66 Cb 0.00 -5.19 0.00 0.00 -0.44 0.00 0.00 34.13 28.50 3k1u s GLU 66 CO 0.00 -3.17 0.00 -1.13 0.95 0.00 0.00 175.26 171.91 3k1u n SER 68 N 12.61 0.00 -4.11 0.83 3.41 -1.20 -4.76 113.62 120.41 3k1u n SER 68 Ca 0.40 0.00 -0.12 0.00 -0.26 0.00 0.00 58.87 58.89 3k1u n SER 68 Cb 0.48 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.32 3k1u n SER 68 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 175.04 175.08 3k1u s ASN 69 N 0.00 0.96 -1.08 4.04 0.01 0.13 -4.61 114.94 114.38 3k1u s ASN 69 Ca 0.00 -0.76 -0.21 0.00 -0.71 0.00 0.00 52.86 51.18 3k1u s ASN 69 Cb 0.00 0.07 0.01 0.00 0.41 0.00 0.00 41.25 41.74 3k1u s ASN 69 CO 0.00 -0.33 0.71 0.18 -1.51 0.00 0.00 177.10 176.15 3k1u n LEU 70 N 0.76 -1.94 -4.62 0.60 4.77 -1.23 -1.09 117.00 114.26 3k1u n LEU 70 Ca -0.18 -1.06 -0.43 0.00 -0.03 0.00 0.00 56.01 54.32 3k1u n LEU 70 Cb 0.58 -2.02 -0.02 0.00 -2.33 0.00 0.00 43.42 39.62 3k1u n LEU 70 CO 0.25 0.49 1.26 -0.63 -1.33 0.00 0.00 177.39 177.43 3k1u s ILE 71 N -3.37 3.89 -0.06 -0.08 -1.09 -0.01 -4.32 121.20 116.16 3k1u s ILE 71 Ca 0.37 0.97 0.04 0.00 -2.23 0.00 0.00 60.65 59.80 3k1u s ILE 71 Cb -0.17 -4.03 -0.00 0.00 -1.58 0.00 0.00 42.46 36.68 3k1u s ILE 71 CO 0.90 -0.53 -0.20 0.26 -1.23 0.00 0.00 174.94 174.14 3k1u s TRP 72 N 5.17 2.09 -1.10 3.97 0.51 -0.09 -4.46 118.94 125.02 3k1u s TRP 72 Ca 0.64 -0.70 -0.13 0.00 -2.12 0.00 0.00 56.10 53.79 3k1u s TRP 72 Cb -0.18 -1.40 -0.04 0.00 -0.81 0.00 0.00 33.47 31.04 3k1u s TRP 72 CO 0.29 -0.26 0.85 0.00 -0.51 0.00 0.00 176.95 177.33 3k1u n ALA 73 N 3.27 -2.49 -1.75 0.98 0.00 -1.26 -1.81 120.51 117.46 3k1u n ALA 73 Ca -0.19 -0.05 -0.36 0.00 0.00 0.00 0.00 53.44 52.85 3k1u n ALA 73 Cb 0.52 -4.84 0.02 0.00 0.00 0.00 0.00 19.45 15.16 3k1u n ALA 73 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 3k1u s PRO 74 N -5.20 3.09 -0.03 0.00 0.04 -1.26 -4.61 135.00 127.03 3k1u s PRO 74 Ca 0.44 1.74 0.03 0.00 0.04 0.00 0.00 61.00 63.25 3k1u s PRO 74 Cb -0.11 -1.95 0.00 0.00 0.04 0.00 0.00 34.50 32.48 3k1u s PRO 74 CO 0.80 -1.09 -0.11 -1.21 0.04 0.00 0.00 177.00 175.42 3k1u s GLU 75 N -3.35 1.15 -0.21 4.56 2.02 -0.41 -4.31 118.70 118.15 3k1u s GLU 75 Ca 0.76 -0.38 -0.08 0.00 0.02 0.00 0.00 54.97 55.29 3k1u s GLU 75 Cb -0.28 -1.05 -0.04 0.00 0.10 0.00 0.00 34.13 32.86 3k1u s GLU 75 CO 0.31 0.15 0.08 -1.50 0.02 0.00 0.00 175.26 174.32 3k1u s ILE 76 N 0.15 4.74 0.12 -1.63 2.07 -1.26 -1.30 121.20 124.08 3k1u s ILE 76 Ca -0.03 -0.04 0.04 0.00 -1.41 0.00 0.00 60.65 59.21 3k1u s ILE 76 Cb -0.09 -3.17 -0.04 0.00 0.13 0.00 0.00 42.46 39.29 3k1u s ILE 76 CO 0.01 0.41 -0.11 -1.00 -1.91 0.00 0.00 174.94 172.34 3k1u s HIS 77 N 0.81 1.20 -0.22 3.50 3.76 0.20 -4.72 115.29 119.82 3k1u s HIS 77 Ca 0.04 -0.66 0.01 0.00 -0.15 0.00 0.00 55.06 54.31 3k1u s HIS 77 Cb -0.13 -0.64 0.05 0.00 1.11 0.00 0.00 32.58 32.97 3k1u s HIS 77 CO 0.02 0.06 -0.11 0.12 -0.85 0.00 0.00 174.74 173.98 3k1u s PHE 78 N -2.59 2.71 -0.08 1.40 5.36 -1.26 -0.81 117.98 122.70 3k1u s PHE 78 Ca 0.09 -1.84 -0.00 0.00 -0.96 0.00 0.00 56.93 54.22 3k1u s PHE 78 Cb -0.02 -1.75 0.02 0.00 -0.34 0.00 0.00 43.02 40.93 3k1u s PHE 78 CO 0.01 -0.80 -0.05 0.42 -1.46 0.00 0.00 175.22 173.34 3k1u s ILE 79 N 1.29 0.78 -1.43 3.12 1.01 0.14 -4.85 121.20 121.26 3k1u s ILE 79 Ca -0.03 -0.17 -0.04 0.00 0.00 0.00 0.00 60.65 60.41 3k1u s ILE 79 Cb -0.17 -0.82 0.03 0.00 0.01 0.00 0.00 42.46 41.50 3k1u s ILE 79 CO -0.08 0.31 0.61 -3.20 0.00 0.00 0.00 174.94 172.59 3k1u n ASN 80 N 4.72 -1.48 0.00 3.58 5.15 -1.26 -2.16 115.26 123.81 3k1u n ASN 80 Ca -0.14 -0.93 0.00 0.00 -0.60 0.00 0.00 54.58 52.91 3k1u n ASN 80 Cb 0.50 -3.41 0.00 0.00 -0.53 0.00 0.00 39.78 36.35 3k1u n ASN 80 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3k1u n GLY 81 N -1.77 0.74 3.05 8.20 0.00 -1.26 -5.03 105.19 109.12 3k1u n GLY 81 Ca -0.22 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.71 3k1u n GLY 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3k1u s ALA 82 N -2.69 0.41 0.15 4.61 0.00 -0.92 -4.84 121.76 118.48 3k1u s ALA 82 Ca 0.00 -0.88 -0.20 0.00 0.00 0.00 0.00 51.96 50.88 3k1u s ALA 82 Cb 0.00 0.17 -0.07 0.00 0.00 0.00 0.00 23.12 23.21 3k1u s ALA 82 CO 0.00 -0.20 0.66 -1.58 0.00 0.00 0.00 175.76 174.64 3k1u s TRP 83 N -2.38 3.76 -0.02 0.00 0.52 0.10 -0.68 118.94 120.24 3k1u s TRP 83 Ca -0.05 1.37 0.02 0.00 0.02 0.00 0.00 56.10 57.46 3k1u s TRP 83 Cb -0.03 -2.59 0.00 0.00 -1.15 0.00 0.00 33.47 29.70 3k1u s TRP 83 CO -0.04 0.48 -0.08 0.71 0.02 0.00 0.00 176.95 178.04 3k1u s TYR 84 N -1.28 0.88 -0.18 -1.98 2.02 0.01 -0.78 117.35 116.04 3k1u s TYR 84 Ca 0.36 -0.21 0.01 0.00 -0.37 0.00 0.00 57.07 56.85 3k1u s TYR 84 Cb -0.19 -0.63 0.03 0.00 -0.40 0.00 0.00 41.96 40.76 3k1u s TYR 84 CO 0.21 -0.09 -0.17 0.42 -1.57 0.00 0.00 175.55 174.36 3k1u s ILE 85 N 0.18 1.91 -0.19 2.71 1.01 -0.21 -0.63 121.20 125.99 3k1u s ILE 85 Ca -0.03 -0.95 -0.13 0.00 0.00 0.00 0.00 60.65 59.55 3k1u s ILE 85 Cb -0.08 -1.80 -0.05 0.00 0.01 0.00 0.00 42.46 40.55 3k1u s ILE 85 CO 0.00 0.42 0.26 -0.31 0.00 0.00 0.00 174.94 175.32 3k1u s TYR 86 N 1.33 3.41 0.21 3.97 2.02 -0.42 -1.29 117.35 126.59 3k1u s TYR 86 Ca 0.03 0.50 -0.12 0.00 -0.37 0.00 0.00 57.07 57.11 3k1u s TYR 86 Cb -0.14 -2.33 -0.00 0.00 -0.40 0.00 0.00 41.96 39.09 3k1u s TYR 86 CO -0.11 0.18 0.41 -0.59 -1.57 0.00 0.00 175.55 173.87 3k1u s PHE 87 N 0.69 0.31 0.14 2.71 -0.12 -0.64 -1.29 117.98 119.79 3k1u s PHE 87 Ca 0.14 -0.67 0.10 0.00 -0.05 0.00 0.00 56.93 56.45 3k1u s PHE 87 Cb -0.13 0.12 -0.04 0.00 -0.63 0.00 0.00 43.02 42.34 3k1u s PHE 87 CO 0.04 -0.88 -0.18 0.00 -0.05 0.00 0.00 175.22 174.15 3k1u s ALA 88 N -3.98 2.69 0.03 1.99 0.00 -0.75 -0.81 121.76 120.92 3k1u s ALA 88 Ca 0.19 -1.44 -0.22 0.00 0.00 0.00 0.00 51.96 50.49 3k1u s ALA 88 Cb 0.01 -0.59 0.05 0.00 0.00 0.00 0.00 23.12 22.59 3k1u s ALA 88 CO 0.04 0.53 0.50 0.00 0.00 0.00 0.00 175.76 176.84 3k1u s ALA 89 N -1.34 -1.28 0.24 0.00 0.00 -0.64 -0.91 121.76 117.82 3k1u s ALA 89 Ca 0.20 0.63 0.10 0.00 0.00 0.00 0.00 51.96 52.89 3k1u s ALA 89 Cb -0.10 0.29 -0.04 0.00 0.00 0.00 0.00 23.12 23.27 3k1u s ALA 89 CO 0.11 -0.45 -0.11 0.00 0.00 0.00 0.00 175.76 175.31 3k1u s ALA 90 N -2.15 2.92 -0.90 0.00 0.00 -0.25 -0.83 121.76 120.56 3k1u s ALA 90 Ca -0.07 -1.68 0.27 0.00 0.00 0.00 0.00 51.96 50.48 3k1u s ALA 90 Cb -0.01 -0.56 0.90 0.00 0.00 0.00 0.00 23.12 23.45 3k1u s ALA 90 CO 0.01 0.34 1.73 -0.35 0.00 0.00 0.00 175.76 177.48 3k1u n PRO 91 N -0.47 0.09 -2.61 0.00 -0.04 -1.26 -0.70 135.00 130.02 3k1u n PRO 91 Ca -0.08 0.06 0.00 0.00 -0.04 0.00 0.00 63.50 63.44 3k1u n PRO 91 Cb 0.58 -1.59 0.01 0.00 -0.04 0.00 0.00 33.50 32.46 3k1u n PRO 91 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3k1u n ASP 92 N -1.73 -0.61 -1.50 3.54 5.68 -1.26 -4.45 116.55 116.22 3k1u n ASP 92 Ca 0.06 -1.24 0.05 0.00 -0.50 0.00 0.00 54.79 53.16 3k1u n ASP 92 Cb 0.37 0.97 0.33 0.00 -1.14 0.00 0.00 41.12 41.65 3k1u n ASP 92 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 3k1u n LYS 93 N -0.35 3.85 -1.91 0.11 5.02 -1.26 -4.75 118.16 118.86 3k1u n LYS 93 Ca 0.01 -3.04 -0.37 0.00 -2.02 0.00 0.00 58.31 52.89 3k1u n LYS 93 Cb 0.24 -2.08 0.04 0.00 -0.02 0.00 0.00 35.03 33.21 3k1u n LYS 93 CO 0.00 0.00 0.00 1.21 -0.52 0.00 0.00 177.40 178.09 3k1u s ASN 94 N -1.34 5.14 -0.22 4.39 2.47 -1.26 -4.96 114.94 119.15 3k1u s ASN 94 Ca 0.50 2.53 -0.07 0.00 0.42 0.00 0.00 52.86 56.24 3k1u s ASN 94 Cb 0.39 -2.61 -0.03 0.00 -1.45 0.00 0.00 41.25 37.55 3k1u s ASN 94 CO 0.12 -1.64 0.05 -0.63 -3.72 0.00 0.00 177.10 171.28 3k1u s ILE 95 N -1.47 4.34 -0.03 -5.21 -1.09 -1.26 -4.04 121.20 112.45 3k1u s ILE 95 Ca 0.76 -0.17 0.01 0.00 -2.23 0.00 0.00 60.65 59.02 3k1u s ILE 95 Cb -0.34 -3.00 0.02 0.00 -1.58 0.00 0.00 42.46 37.56 3k1u s ILE 95 CO 0.38 0.39 -0.03 -0.70 -1.23 0.00 0.00 174.94 173.75 3k1u s GLU 96 N 1.18 0.50 -1.52 2.79 2.12 0.18 -4.76 118.70 119.18 3k1u s GLU 96 Ca 0.04 -0.05 -0.03 0.00 0.36 0.00 0.00 54.97 55.29 3k1u s GLU 96 Cb -0.14 -0.56 0.01 0.00 0.26 0.00 0.00 34.13 33.69 3k1u s GLU 96 CO 0.03 -0.05 0.26 -0.25 -0.54 0.00 0.00 175.26 174.71 3k1u n ASP 97 N 3.77 -5.37 0.00 -1.70 8.00 -1.26 -2.84 116.55 117.15 3k1u n ASP 97 Ca -0.23 -0.11 0.00 0.00 0.71 0.00 0.00 54.79 55.17 3k1u n ASP 97 Cb 0.53 -4.43 0.00 0.00 -0.02 0.00 0.00 41.12 37.20 3k1u n ASP 97 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3k1u n ASP 98 N -2.18 0.00 -4.18 -2.24 8.00 -1.26 -4.98 116.55 109.72 3k1u n ASP 98 Ca -0.16 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.22 3k1u n ASP 98 Cb 0.64 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.63 3k1u n ASP 98 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3k1u s THR 99 N -3.40 0.82 1.25 -3.53 -4.23 -1.13 -5.05 115.64 100.38 3k1u s THR 99 Ca 0.00 -1.83 -0.18 0.00 -1.18 0.00 0.00 61.69 58.50 3k1u s THR 99 Cb 0.00 -1.56 0.28 0.00 1.34 0.00 0.00 72.50 72.56 3k1u s THR 99 CO 0.00 -0.74 0.70 0.49 -0.54 0.00 0.00 174.62 174.53 3k1u n PHE 100 N 0.17 -2.27 -2.01 3.99 3.72 -1.26 -0.65 117.46 119.16 3k1u n PHE 100 Ca -0.13 -0.31 -0.25 0.00 -0.05 0.00 0.00 57.45 56.70 3k1u n PHE 100 Cb 0.60 -1.52 0.02 0.00 -0.94 0.00 0.00 39.48 37.64 3k1u n PHE 100 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3k1u n ASN 101 N -4.23 5.18 -4.59 4.37 3.02 -1.26 -4.37 115.26 113.38 3k1u n ASN 101 Ca 0.06 -3.75 -0.39 0.00 -0.03 0.00 0.00 54.58 50.46 3k1u n ASN 101 Cb 0.55 -0.42 0.03 0.00 -0.61 0.00 0.00 39.78 39.34 3k1u n ASN 101 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 3k1u n HIS 102 N -0.70 0.72 0.00 3.10 8.25 -1.26 -4.53 115.22 120.80 3k1u n HIS 102 Ca 0.45 0.49 0.00 0.00 -0.26 0.00 0.00 57.72 58.40 3k1u n HIS 102 Cb 0.90 -2.15 0.00 0.00 1.12 0.00 0.00 29.99 29.86 3k1u n HIS 102 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3k1u n ARG 103 N -0.33 1.67 0.00 -0.41 5.12 -0.01 -1.67 116.66 121.03 3k1u n ARG 103 Ca 0.11 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.03 3k1u n ARG 103 Cb 0.44 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.74 3k1u n ARG 103 CO 0.00 0.00 0.00 1.19 -1.93 0.00 0.00 177.63 176.89 3k1u n PHE 105 N 0.00 0.00 -3.80 -1.55 3.72 0.01 -1.63 117.46 114.21 3k1u n PHE 105 Ca 0.00 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.27 3k1u n PHE 105 Cb 0.00 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.42 3k1u n PHE 105 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 3k1u s VAL 106 N -2.00 0.01 0.02 -4.37 0.11 -1.26 -1.61 120.40 111.29 3k1u s VAL 106 Ca 0.00 -0.05 0.04 0.00 -2.93 0.00 0.00 61.98 59.05 3k1u s VAL 106 Cb 0.00 -0.33 -0.03 0.00 -1.53 0.00 0.00 36.38 34.48 3k1u s VAL 106 CO 0.00 -0.03 -0.10 0.27 -3.33 0.00 0.00 175.10 171.92 3k1u s ILE 107 N 0.00 3.42 0.02 7.04 -4.36 -0.41 -2.03 121.20 124.88 3k1u s ILE 107 Ca -0.01 -0.89 0.08 0.00 -0.26 0.00 0.00 60.65 59.56 3k1u s ILE 107 Cb -0.02 -2.48 -0.03 0.00 1.25 0.00 0.00 42.46 41.18 3k1u s ILE 107 CO 0.00 0.37 -0.23 -1.58 0.24 0.00 0.00 174.94 173.74 3k1u s GLN 108 N -1.45 2.01 -0.19 0.37 0.74 0.21 -1.04 119.66 120.32 3k1u s GLN 108 Ca 0.17 -0.99 -0.03 0.00 0.05 0.00 0.00 55.36 54.56 3k1u s GLN 108 Cb -0.11 -2.08 0.06 0.00 1.10 0.00 0.00 33.01 31.98 3k1u s GLN 108 CO 0.07 0.54 0.03 1.21 -0.55 0.00 0.00 175.29 176.60 3k1u s ASN 109 N -1.04 2.85 0.00 6.67 3.84 0.04 -0.47 114.94 126.83 3k1u s ASN 109 Ca 0.12 -0.79 0.29 0.00 0.21 0.00 0.00 52.86 52.69 3k1u s ASN 109 Cb -0.10 -0.60 1.31 0.00 -0.55 0.00 0.00 41.25 41.30 3k1u s ASN 109 CO 0.02 -0.30 1.95 -0.62 -2.79 0.00 0.00 177.10 175.36 3k1u n GLU 110 N 5.04 0.14 -2.46 0.43 1.02 -1.26 -0.72 120.64 122.83 3k1u n GLU 110 Ca -0.09 -0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.69 3k1u n GLU 110 Cb 0.47 -1.50 -0.03 0.00 -0.02 0.00 0.00 31.44 30.36 3k1u n GLU 110 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 3k1u s ASN 111 N -2.87 6.50 0.44 1.62 3.84 -1.26 -4.82 114.94 118.39 3k1u s ASN 111 Ca 0.18 2.09 0.17 0.00 0.21 0.00 0.00 52.86 55.52 3k1u s ASN 111 Cb 0.19 -2.59 1.10 0.00 -0.55 0.00 0.00 41.25 39.41 3k1u s ASN 111 CO 0.51 -0.67 1.91 1.05 -2.79 0.00 0.00 177.10 177.11 3k1u h GLU 112 N 2.18 0.36 -4.57 0.43 4.11 -1.90 -3.39 114.58 111.80 3k1u h GLU 112 Ca -0.49 -0.02 -0.71 0.00 0.07 0.00 0.00 59.36 58.21 3k1u h GLU 112 Cb 1.23 -0.08 -0.22 0.00 0.50 0.00 0.00 28.75 30.18 3k1u h GLU 112 CO 0.61 0.24 -0.47 1.21 0.07 0.00 0.00 179.01 180.67 3k1u s ASN 113 N -5.87 5.96 0.00 3.06 3.84 -1.26 -4.95 114.94 115.71 3k1u s ASN 113 Ca -0.08 -0.84 0.20 0.00 0.21 0.00 0.00 52.86 52.35 3k1u s ASN 113 Cb 0.21 -2.11 0.97 0.00 -0.55 0.00 0.00 41.25 39.77 3k1u s ASN 113 CO 0.77 -0.39 1.62 -0.81 -2.79 0.00 0.00 177.10 175.50 3k1u n PRO 114 N 5.10 0.23 0.00 0.43 -0.04 -1.26 -1.98 135.00 137.47 3k1u n PRO 114 Ca -0.12 0.11 0.13 0.00 -0.04 0.00 0.00 63.50 63.58 3k1u n PRO 114 Cb 0.47 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.84 3k1u n PRO 114 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 3k1u n PHE 115 N -1.32 0.00 -1.51 0.54 3.72 -1.26 -4.88 117.46 112.75 3k1u n PHE 115 Ca 0.09 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.16 3k1u n PHE 115 Cb 0.17 -0.35 0.07 0.00 -0.94 0.00 0.00 39.48 38.43 3k1u n PHE 115 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3k1u s THR 116 N -2.99 3.16 -1.47 4.37 -4.23 -0.84 -4.91 115.64 108.74 3k1u s THR 116 Ca 0.13 0.47 -0.08 0.00 -1.18 0.00 0.00 61.69 61.03 3k1u s THR 116 Cb 0.18 -2.96 0.02 0.00 1.34 0.00 0.00 72.50 71.08 3k1u s THR 116 CO 0.63 -0.40 2.60 0.61 -0.54 0.00 0.00 174.62 177.52 3k1u n GLY 117 N -0.68 4.69 1.00 3.99 0.00 -1.26 -4.40 105.19 108.53 3k1u n GLY 117 Ca 0.10 -1.77 0.05 0.00 0.00 0.00 0.00 46.02 44.40 3k1u n GLY 117 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3k1u n ASN 118 N 3.02 1.38 -4.66 1.61 3.02 -1.26 -5.04 115.26 113.33 3k1u n ASN 118 Ca 0.68 -3.02 -0.42 0.00 -0.03 0.00 0.00 54.58 51.78 3k1u n ASN 118 Cb 0.26 -0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 38.97 3k1u n ASN 118 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 3k1u s TRP 119 N -1.75 3.39 -0.12 3.10 0.52 -1.26 -4.34 118.94 118.49 3k1u s TRP 119 Ca 0.36 1.37 -0.01 0.00 0.02 0.00 0.00 56.10 57.84 3k1u s TRP 119 Cb 0.37 -3.15 -0.02 0.00 -1.15 0.00 0.00 33.47 29.53 3k1u s TRP 119 CO -0.11 -0.35 -0.09 0.14 0.02 0.00 0.00 176.95 176.55 3k1u s VAL 120 N 2.63 3.47 -0.26 4.03 -7.23 0.37 -4.90 120.40 118.51 3k1u s VAL 120 Ca 0.42 -0.53 -0.29 0.00 -1.81 0.00 0.00 61.98 59.77 3k1u s VAL 120 Cb -0.16 -2.46 0.01 0.00 0.56 0.00 0.00 36.38 34.33 3k1u s VAL 120 CO 0.10 0.54 1.11 -1.61 -0.31 0.00 0.00 175.10 174.93 3k1u s GLU 121 N 0.00 4.15 0.67 4.82 2.02 -1.26 -0.62 118.70 128.49 3k1u s GLU 121 Ca -0.02 1.29 -0.09 0.00 0.02 0.00 0.00 54.97 56.17 3k1u s GLU 121 Cb -0.14 -3.72 0.02 0.00 0.10 0.00 0.00 34.13 30.40 3k1u s GLU 121 CO 0.03 -0.79 1.03 0.15 0.02 0.00 0.00 175.26 175.70 3k1u s LYS 122 N 3.50 2.76 0.68 1.61 -0.14 -0.86 -4.99 119.74 122.29 3k1u s LYS 122 Ca 0.47 0.22 -0.16 0.00 -1.36 0.00 0.00 55.97 55.14 3k1u s LYS 122 Cb -0.15 -2.12 0.01 0.00 -1.68 0.00 0.00 37.83 33.89 3k1u s LYS 122 CO 0.12 -0.97 1.16 0.20 -0.76 0.00 0.00 175.35 175.10 3k1u s GLY 123 N -4.37 2.30 0.30 -3.33 0.00 -1.26 -4.63 107.32 96.33 3k1u s GLY 123 Ca 0.57 0.73 -0.25 0.00 0.00 0.00 0.00 44.72 45.76 3k1u s GLY 123 CO 0.49 1.10 0.49 -2.13 0.00 0.00 0.00 173.10 173.05 3k1u n ARG 124 N -2.41 0.28 -2.69 2.90 0.63 -1.26 -4.68 116.66 109.43 3k1u n ARG 124 Ca 0.12 0.10 -0.43 0.00 -0.92 0.00 0.00 57.85 56.72 3k1u n ARG 124 Cb 0.51 -1.21 -0.03 0.00 0.45 0.00 0.00 32.46 32.18 3k1u n ARG 124 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 3k1u s ILE 125 N -1.26 4.19 0.25 5.15 1.01 -1.26 -4.99 121.20 124.29 3k1u s ILE 125 Ca 0.62 0.68 -0.26 0.00 0.00 0.00 0.00 60.65 61.69 3k1u s ILE 125 Cb -0.77 -4.63 -0.09 0.00 0.01 0.00 0.00 42.46 36.98 3k1u s ILE 125 CO 0.59 -1.21 0.87 -0.54 0.00 0.00 0.00 174.94 174.65 3k1u s LYS 126 N 4.49 4.60 0.32 2.79 1.02 -1.26 -4.88 119.74 126.82 3k1u s LYS 126 Ca 0.38 1.26 0.01 0.00 0.02 0.00 0.00 55.97 57.64 3k1u s LYS 126 Cb -0.09 -3.03 0.01 0.00 -0.52 0.00 0.00 37.83 34.19 3k1u s LYS 126 CO 0.24 0.42 0.06 0.25 -0.92 0.00 0.00 175.35 175.40 3k1u n THR 127 N 1.04 0.00 0.45 2.17 -2.24 -1.26 -4.60 114.28 109.84 3k1u n THR 127 Ca -0.01 -1.45 0.07 0.00 -2.27 0.00 0.00 64.05 60.39 3k1u n THR 127 Cb 0.49 0.18 0.32 0.00 -2.10 0.00 0.00 70.33 69.22 3k1u n THR 127 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k1u n ALA 128 N -2.07 1.62 -3.11 6.98 0.00 -1.26 -4.77 120.51 117.89 3k1u n ALA 128 Ca -0.13 -0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.20 3k1u n ALA 128 Cb 0.40 -1.25 -0.05 0.00 0.00 0.00 0.00 19.45 18.55 3k1u n ALA 128 CO 0.00 0.00 0.00 1.67 0.00 0.00 0.00 177.50 179.17 3k1u s TRP 129 N -3.06 0.25 -0.24 0.00 -2.14 -1.26 -5.12 118.94 107.37 3k1u s TRP 129 Ca 0.06 -0.61 -0.06 0.00 2.66 0.00 0.00 56.10 58.15 3k1u s TRP 129 Cb 0.09 0.19 -0.02 0.00 -3.10 0.00 0.00 33.47 30.63 3k1u s TRP 129 CO 0.27 -0.92 0.03 -1.21 -2.66 0.00 0.00 176.95 172.46 3k1u s GLU 130 N -3.97 3.55 0.07 3.25 0.41 -1.26 -5.05 118.70 115.70 3k1u s GLU 130 Ca 0.18 -0.53 -0.27 0.00 -0.41 0.00 0.00 54.97 53.94 3k1u s GLU 130 Cb 0.00 -3.21 0.09 0.00 -1.78 0.00 0.00 34.13 29.23 3k1u s GLU 130 CO 0.04 -0.19 1.14 -1.54 -0.49 0.00 0.00 175.26 174.22 3k1u s SER 131 N 1.57 -0.09 -0.48 -0.19 1.04 -1.26 -5.11 113.70 109.18 3k1u s SER 131 Ca 0.06 -0.30 -0.44 0.00 0.48 0.00 0.00 55.95 55.75 3k1u s SER 131 Cb -0.15 0.32 -0.19 0.00 0.10 0.00 0.00 66.02 66.10 3k1u s SER 131 CO 0.01 -0.60 1.55 0.33 0.98 0.00 0.00 173.24 175.51 3k1u n PHE 132 N -0.53 1.64 -3.78 5.02 7.35 -1.25 -4.76 117.46 121.15 3k1u n PHE 132 Ca -0.06 1.07 -0.13 0.00 -0.76 0.00 0.00 57.45 57.57 3k1u n PHE 132 Cb 0.61 -2.12 -0.12 0.00 0.35 0.00 0.00 39.48 38.20 3k1u n PHE 132 CO 0.00 0.00 0.00 -1.12 -0.76 0.00 0.00 176.76 174.88 3k1u s SER 133 N 3.03 -0.23 0.14 -2.13 0.01 -0.67 -0.97 113.70 112.87 3k1u s SER 133 Ca 1.01 0.46 -0.25 0.00 1.31 0.00 0.00 55.95 58.48 3k1u s SER 133 Cb -1.43 0.43 0.07 0.00 0.21 0.00 0.00 66.02 65.30 3k1u s SER 133 CO 0.77 -0.10 1.01 -1.48 0.41 0.00 0.00 173.24 173.84 3k1u s LEU 134 N 0.46 -0.14 -1.21 2.44 2.34 -0.29 -3.53 118.68 118.75 3k1u s LEU 134 Ca -0.03 -0.42 -0.05 0.00 0.06 0.00 0.00 54.13 53.69 3k1u s LEU 134 Cb -0.04 2.07 0.01 0.00 -0.56 0.00 0.00 46.19 47.66 3k1u s LEU 134 CO -0.02 -0.86 0.68 0.47 -1.06 0.00 0.00 176.35 175.57 3k1u n ASP 135 N -0.58 -5.43 -4.77 1.48 8.00 -1.26 -1.20 116.55 112.79 3k1u n ASP 135 Ca -0.06 -0.32 -0.39 0.00 0.71 0.00 0.00 54.79 54.73 3k1u n ASP 135 Cb 0.61 -4.18 -0.02 0.00 -0.02 0.00 0.00 41.12 37.51 3k1u n ASP 135 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3k1u s ALA 136 N -3.14 3.27 0.28 2.24 0.00 -1.26 -4.25 121.76 118.90 3k1u s ALA 136 Ca 0.34 1.06 0.02 0.00 0.00 0.00 0.00 51.96 53.38 3k1u s ALA 136 Cb -0.15 -3.41 -0.05 0.00 0.00 0.00 0.00 23.12 19.51 3k1u s ALA 136 CO 0.42 -0.56 0.11 -0.08 0.00 0.00 0.00 175.76 175.65 3k1u s THR 137 N -1.30 0.56 0.05 0.00 -1.32 0.76 -4.80 115.64 109.58 3k1u s THR 137 Ca 0.54 -2.00 0.01 0.00 -1.21 0.00 0.00 61.69 59.03 3k1u s THR 137 Cb -0.34 -2.61 -0.03 0.00 -1.51 0.00 0.00 72.50 68.01 3k1u s THR 137 CO 0.43 0.00 -0.06 0.27 -2.21 0.00 0.00 174.62 173.06 3k1u s ILE 138 N -3.66 0.41 0.14 5.08 -4.36 -1.26 -1.12 121.20 116.43 3k1u s ILE 138 Ca 0.37 -1.25 -0.13 0.00 -0.26 0.00 0.00 60.65 59.37 3k1u s ILE 138 Cb 0.07 -0.79 0.02 0.00 1.25 0.00 0.00 42.46 43.01 3k1u s ILE 138 CO 0.15 -0.56 0.35 0.72 0.24 0.00 0.00 174.94 175.84 3k1u s PHE 139 N -2.05 0.01 0.02 1.37 -0.12 -0.73 -4.90 117.98 111.58 3k1u s PHE 139 Ca -0.06 -0.36 0.09 0.00 -0.05 0.00 0.00 56.93 56.54 3k1u s PHE 139 Cb -0.06 0.15 -0.03 0.00 -0.63 0.00 0.00 43.02 42.46 3k1u s PHE 139 CO -0.02 -0.71 -0.25 -1.21 -0.05 0.00 0.00 175.22 172.98 3k1u s GLU 140 N -3.86 1.84 -0.18 1.99 2.02 -1.26 -0.28 118.70 118.96 3k1u s GLU 140 Ca 0.07 -1.02 -0.09 0.00 0.02 0.00 0.00 54.97 53.95 3k1u s GLU 140 Cb 0.02 -1.92 0.07 0.00 0.10 0.00 0.00 34.13 32.39 3k1u s GLU 140 CO -0.08 0.51 0.44 -1.58 0.02 0.00 0.00 175.26 174.57 3k1u s HIS 141 N -0.73 -0.68 -1.41 1.61 2.46 -0.53 -4.94 115.29 111.07 3k1u s HIS 141 Ca 0.11 1.40 -0.02 0.00 0.47 0.00 0.00 55.06 57.01 3k1u s HIS 141 Cb -0.10 0.31 0.00 0.00 -0.13 0.00 0.00 32.58 32.66 3k1u s HIS 141 CO 0.01 -0.38 0.36 0.09 -2.47 0.00 0.00 174.74 172.34 3k1u n ASN 142 N 4.46 -0.44 -0.02 9.88 5.03 -1.26 -1.40 115.26 131.50 3k1u n ASN 142 Ca -0.21 -1.08 -0.00 0.00 0.87 0.00 0.00 54.58 54.17 3k1u n ASN 142 Cb 0.55 -2.72 -0.00 0.00 -1.02 0.00 0.00 39.78 36.59 3k1u n ASN 142 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3k1u n GLU 143 N -4.45 -1.41 -4.08 3.52 1.02 -1.26 -4.99 120.64 108.98 3k1u n GLU 143 Ca -0.30 0.36 -0.32 0.00 -0.02 0.00 0.00 57.16 56.89 3k1u n GLU 143 Cb 0.68 -4.43 -0.07 0.00 -0.02 0.00 0.00 31.44 27.60 3k1u n GLU 143 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 3k1u s LYS 144 N -1.45 2.96 -0.16 3.49 1.02 -0.50 -5.11 119.74 120.00 3k1u s LYS 144 Ca 0.00 -0.60 -0.02 0.00 0.02 0.00 0.00 55.97 55.37 3k1u s LYS 144 Cb 0.00 -2.78 -0.02 0.00 -0.52 0.00 0.00 37.83 34.51 3k1u s LYS 144 CO 0.00 0.60 -0.07 -1.17 -0.92 0.00 0.00 175.35 173.79 3k1u s LEU 145 N -2.09 2.94 0.01 3.17 2.96 -1.26 -1.45 118.68 122.95 3k1u s LEU 145 Ca 0.26 -0.28 0.06 0.00 -0.22 0.00 0.00 54.13 53.96 3k1u s LEU 145 Cb -0.12 -1.70 -0.03 0.00 0.50 0.00 0.00 46.19 44.84 3k1u s LEU 145 CO 0.18 0.12 -0.19 -0.31 -1.32 0.00 0.00 176.35 174.83 3k1u s TYR 146 N 0.66 2.55 -0.16 5.38 2.02 0.62 -4.53 117.35 123.90 3k1u s TYR 146 Ca -0.04 -0.26 -0.02 0.00 -0.37 0.00 0.00 57.07 56.38 3k1u s TYR 146 Cb -0.15 -1.51 -0.02 0.00 -0.40 0.00 0.00 41.96 39.89 3k1u s TYR 146 CO 0.02 0.19 -0.09 -0.47 -1.57 0.00 0.00 175.55 173.64 3k1u s TYR 147 N -0.82 2.90 -0.07 2.71 6.14 0.02 -1.78 117.35 126.46 3k1u s TYR 147 Ca 0.13 -0.61 0.02 0.00 0.64 0.00 0.00 57.07 57.26 3k1u s TYR 147 Cb -0.10 -1.93 0.01 0.00 0.42 0.00 0.00 41.96 40.36 3k1u s TYR 147 CO 0.03 -0.23 -0.14 0.08 0.64 0.00 0.00 175.55 175.93 3k1u s VAL 148 N 0.59 1.27 0.26 3.14 1.01 -0.27 -1.28 120.40 125.11 3k1u s VAL 148 Ca -0.05 -0.55 -0.17 0.00 0.00 0.00 0.00 61.98 61.21 3k1u s VAL 148 Cb -0.15 -1.15 0.01 0.00 0.00 0.00 0.00 36.38 35.09 3k1u s VAL 148 CO 0.03 0.39 0.58 -1.66 0.00 0.00 0.00 175.10 174.44 3k1u s TRP 149 N 0.65 0.09 -0.15 5.22 -2.14 -0.49 -0.17 118.94 121.95 3k1u s TRP 149 Ca -0.15 -0.49 -0.05 0.00 2.66 0.00 0.00 56.10 58.07 3k1u s TRP 149 Cb -0.16 0.42 -0.04 0.00 -3.10 0.00 0.00 33.47 30.60 3k1u s TRP 149 CO 0.04 -1.09 0.03 0.00 -2.66 0.00 0.00 176.95 173.27 3k1u s ALA 150 N -3.96 3.30 -0.04 2.67 0.00 -0.34 -0.82 121.76 122.56 3k1u s ALA 150 Ca 0.17 -0.77 -0.14 0.00 0.00 0.00 0.00 51.96 51.22 3k1u s ALA 150 Cb -0.03 -1.74 0.02 0.00 0.00 0.00 0.00 23.12 21.38 3k1u s ALA 150 CO 0.07 0.29 0.31 -1.14 0.00 0.00 0.00 175.76 175.30 3k1u s GLN 151 N 0.05 0.60 0.32 0.00 0.74 -0.14 -1.14 119.66 120.09 3k1u s GLN 151 Ca 0.04 -0.05 -0.24 0.00 0.05 0.00 0.00 55.36 55.15 3k1u s GLN 151 Cb -0.13 0.27 -0.10 0.00 1.10 0.00 0.00 33.01 34.16 3k1u s GLN 151 CO 0.01 -0.15 0.90 -1.14 -0.55 0.00 0.00 175.29 174.37 3k1u s GLN 152 N -1.00 4.48 -0.12 1.67 0.74 -0.15 -0.93 119.66 124.36 3k1u s GLN 152 Ca -0.11 1.22 0.01 0.00 0.05 0.00 0.00 55.36 56.53 3k1u s GLN 152 Cb -0.05 -2.74 0.02 0.00 1.10 0.00 0.00 33.01 31.34 3k1u s GLN 152 CO 0.03 0.26 -0.13 0.34 -0.55 0.00 0.00 175.29 175.24 3k1u s ASP 153 N -1.69 2.45 0.60 6.67 -1.08 -1.26 -4.77 116.67 117.59 3k1u s ASP 153 Ca 0.50 -0.42 0.31 0.00 -0.52 0.00 0.00 52.55 52.43 3k1u s ASP 153 Cb -0.17 -1.06 1.85 0.00 -1.46 0.00 0.00 42.92 42.07 3k1u s ASP 153 CO 0.22 -0.03 2.21 -0.29 0.52 0.00 0.00 175.17 177.80 3k1u h ILE 154 N 6.03 0.42 -0.44 4.11 2.10 -1.97 -0.91 117.51 126.84 3k1u h ILE 154 Ca -0.34 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.60 3k1u h ILE 154 Cb 1.15 0.93 0.00 0.00 -1.09 0.00 0.00 36.82 37.82 3k1u h ILE 154 CO 0.49 0.00 0.00 0.59 -1.08 0.00 0.00 178.15 178.15 3k1u n ASN 155 N -3.70 2.75 -4.09 2.19 3.02 -1.26 -4.78 115.26 109.40 3k1u n ASN 155 Ca -0.01 -1.95 -0.29 0.00 -0.03 0.00 0.00 54.58 52.30 3k1u n ASN 155 Cb 0.17 -0.29 -0.17 0.00 -0.61 0.00 0.00 39.78 38.88 3k1u n ASN 155 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3k1u s ILE 156 N -1.41 1.57 0.27 2.41 -1.09 -0.35 -5.11 121.20 117.49 3k1u s ILE 156 Ca 0.36 -0.70 -0.31 0.00 -2.23 0.00 0.00 60.65 57.77 3k1u s ILE 156 Cb 0.19 -1.41 -0.13 0.00 -1.58 0.00 0.00 42.46 39.54 3k1u s ILE 156 CO 0.26 0.45 1.50 1.17 -1.23 0.00 0.00 174.94 177.09 3k1u n LYS 157 N 3.96 2.37 0.00 2.79 4.81 -1.26 -4.60 118.16 126.23 3k1u n LYS 157 Ca -0.20 0.84 0.00 0.00 -0.87 0.00 0.00 58.31 58.08 3k1u n LYS 157 Cb 0.52 -2.56 0.00 0.00 0.02 0.00 0.00 35.03 33.00 3k1u n LYS 157 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3k1u n GLY 158 N 2.19 -1.02 0.09 3.14 0.00 -1.26 -4.68 105.19 103.64 3k1u n GLY 158 Ca 0.10 -2.19 -0.01 0.00 0.00 0.00 0.00 46.02 43.92 3k1u n GLY 158 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3k1u n HIS 159 N -0.10 0.84 -3.64 1.61 8.25 0.13 -4.77 115.22 117.54 3k1u n HIS 159 Ca 0.00 0.28 -0.06 0.00 -0.26 0.00 0.00 57.72 57.68 3k1u n HIS 159 Cb 0.00 -1.06 -0.06 0.00 1.12 0.00 0.00 29.99 29.98 3k1u n HIS 159 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3k1u s SER 160 N -5.72 -0.24 0.32 0.41 1.04 -1.26 -3.79 113.70 104.47 3k1u s SER 160 Ca -0.04 0.42 0.10 0.00 0.48 0.00 0.00 55.95 56.91 3k1u s SER 160 Cb 0.09 0.41 -0.06 0.00 0.10 0.00 0.00 66.02 66.56 3k1u s SER 160 CO 0.82 -0.11 -0.07 0.20 0.98 0.00 0.00 173.24 175.07 3k1u s ASN 161 N -0.13 3.95 -0.14 7.02 0.01 -0.11 -1.56 114.94 123.98 3k1u s ASN 161 Ca 0.05 -1.03 -0.15 0.00 -0.71 0.00 0.00 52.86 51.02 3k1u s ASN 161 Cb -0.04 -0.46 -0.04 0.00 0.41 0.00 0.00 41.25 41.12 3k1u s ASN 161 CO -0.09 -0.14 0.35 -0.63 -1.51 0.00 0.00 177.10 175.08 3k1u s ILE 162 N -2.52 5.27 0.19 0.60 -1.09 -0.36 -0.97 121.20 122.30 3k1u s ILE 162 Ca 0.33 0.68 0.10 0.00 -2.23 0.00 0.00 60.65 59.53 3k1u s ILE 162 Cb -0.01 -3.69 -0.04 0.00 -1.58 0.00 0.00 42.46 37.13 3k1u s ILE 162 CO 0.18 0.37 -0.22 -0.31 -1.23 0.00 0.00 174.94 173.73 3k1u s TYR 163 N 0.50 2.12 0.10 3.97 2.02 -0.00 -0.49 117.35 125.56 3k1u s TYR 163 Ca 0.20 -0.40 0.09 0.00 -0.37 0.00 0.00 57.07 56.59 3k1u s TYR 163 Cb -0.14 -1.05 -0.03 0.00 -0.40 0.00 0.00 41.96 40.34 3k1u s TYR 163 CO 0.06 0.44 -0.23 -1.50 -1.57 0.00 0.00 175.55 172.75 3k1u s ILE 164 N -1.83 1.92 0.06 2.71 2.07 -0.50 -1.39 121.20 124.24 3k1u s ILE 164 Ca 0.19 -1.54 -0.14 0.00 -1.41 0.00 0.00 60.65 57.75 3k1u s ILE 164 Cb -0.07 -1.70 0.02 0.00 0.13 0.00 0.00 42.46 40.84 3k1u s ILE 164 CO 0.09 0.07 0.33 0.00 -1.91 0.00 0.00 174.94 173.52 3k1u s ALA 165 N -1.04 -0.73 0.45 1.50 0.00 -0.40 -0.79 121.76 120.75 3k1u s ALA 165 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.04 3k1u s ALA 165 Cb -0.10 0.40 0.00 0.00 0.00 0.00 0.00 23.12 23.42 3k1u s ALA 165 CO 0.04 -0.47 0.00 -1.91 0.00 0.00 0.00 175.76 173.43 3k1u n GLU 166 N 0.38 2.09 0.00 0.00 2.13 -1.26 -0.79 120.64 123.18 3k1u n GLU 166 Ca -0.18 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.64 3k1u n GLU 166 Cb 0.60 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.31 3k1u n GLU 166 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 3k1u n GLU 168 N -0.01 0.00 -3.90 5.31 4.07 0.32 -0.98 120.64 125.44 3k1u n GLU 168 Ca 0.00 0.00 -0.09 0.00 -0.06 0.00 0.00 57.16 57.01 3k1u n GLU 168 Cb 0.00 -0.93 -0.01 0.00 -0.06 0.00 0.00 31.44 30.43 3k1u n GLU 168 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 3k1u s ASN 169 N -3.88 0.07 0.00 4.31 6.03 -1.16 -5.01 114.94 115.30 3k1u s ASN 169 Ca 0.00 -1.03 0.07 0.00 -1.03 0.00 0.00 52.86 50.88 3k1u s ASN 169 Cb 0.00 0.74 0.39 0.00 -3.03 0.00 0.00 41.25 39.35 3k1u s ASN 169 CO 0.00 -1.44 1.03 -2.65 -2.03 0.00 0.00 177.10 172.02 3k1u n PRO 170 N -0.49 0.14 0.00 3.55 -0.02 -1.26 -2.12 135.00 134.80 3k1u n PRO 170 Ca -0.04 0.15 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 3k1u n PRO 170 Cb 0.60 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 3k1u n PRO 170 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 3k1u n TRP 171 N -1.20 0.00 -3.70 6.00 2.14 -1.26 -5.03 117.44 114.40 3k1u n TRP 171 Ca 0.04 -0.37 -0.15 0.00 2.07 0.00 0.00 57.50 59.09 3k1u n TRP 171 Cb 0.05 -0.04 -0.15 0.00 -0.81 0.00 0.00 31.31 30.36 3k1u n TRP 171 CO 0.00 0.00 0.00 0.99 2.07 0.00 0.00 177.69 180.75 3k1u s THR 172 N -0.74 -0.19 0.41 -1.67 2.01 -0.90 -4.63 115.64 109.93 3k1u s THR 172 Ca 0.00 0.28 -0.18 0.00 0.31 0.00 0.00 61.69 62.11 3k1u s THR 172 Cb 0.00 -0.29 -0.10 0.00 0.01 0.00 0.00 72.50 72.12 3k1u s THR 172 CO 0.00 0.12 0.88 -0.76 -0.69 0.00 0.00 174.62 174.17 3k1u s LEU 173 N 1.88 3.92 0.00 4.42 1.02 -1.26 -0.52 118.68 128.13 3k1u s LEU 173 Ca -0.02 1.52 0.00 0.00 0.02 0.00 0.00 54.13 55.65 3k1u s LEU 173 Cb -0.12 -4.37 0.00 0.00 0.02 0.00 0.00 46.19 41.72 3k1u s LEU 173 CO -0.06 -0.36 0.59 2.29 0.02 0.00 0.00 176.35 178.83 3k1u n LYS 174 N -0.76 0.44 -4.32 1.70 2.85 -0.15 -4.52 118.16 113.40 3k1u n LYS 174 Ca 0.06 -0.74 -0.17 0.00 -1.05 0.00 0.00 58.31 56.41 3k1u n LYS 174 Cb 0.54 -0.89 -0.10 0.00 -0.65 0.00 0.00 35.03 33.92 3k1u n LYS 174 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 3k1u s THR 175 N -0.31 1.06 0.90 0.58 -4.23 -1.22 -4.97 115.64 107.46 3k1u s THR 175 Ca 0.00 -2.04 -0.10 0.00 -1.18 0.00 0.00 61.69 58.36 3k1u s THR 175 Cb 0.00 -2.27 0.14 0.00 1.34 0.00 0.00 72.50 71.70 3k1u s THR 175 CO 0.00 -0.39 1.12 -1.59 -0.54 0.00 0.00 174.62 173.22 3k1u s LYS 176 N -3.84 1.16 0.27 3.99 -2.85 -1.26 -4.77 119.74 112.44 3k1u s LYS 176 Ca 0.27 1.34 -0.29 0.00 -1.00 0.00 0.00 55.97 56.28 3k1u s LYS 176 Cb 0.05 -1.76 -0.10 0.00 -2.06 0.00 0.00 37.83 33.97 3k1u s LYS 176 CO 0.08 -2.46 1.26 -2.14 0.10 0.00 0.00 175.35 172.18 3k1u s PRO 177 N -4.72 4.43 0.00 1.78 0.02 -1.26 -4.63 135.00 130.63 3k1u s PRO 177 Ca 0.65 2.07 0.00 0.00 0.02 0.00 0.00 61.00 63.74 3k1u s PRO 177 Cb -0.21 -3.14 0.00 0.00 0.02 0.00 0.00 34.50 31.17 3k1u s PRO 177 CO 0.58 -0.12 0.00 0.28 -0.33 0.00 0.00 177.00 177.41 3k1u n VAL 178 N 1.53 0.00 0.00 3.83 0.31 0.03 -4.95 118.33 119.08 3k1u n VAL 178 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.35 3k1u n VAL 178 Cb 0.43 -0.14 0.00 0.00 -0.91 0.00 0.00 33.84 33.22 3k1u n VAL 178 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3k1u n LEU 180 N 0.00 0.00 -3.71 7.52 4.77 0.36 -1.40 117.00 124.53 3k1u n LEU 180 Ca 0.00 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.84 3k1u n LEU 180 Cb 0.00 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 3k1u n LEU 180 CO 0.00 0.00 0.11 0.28 -1.33 0.00 0.00 177.39 176.45 3k1u s THR 181 N -0.79 0.04 0.13 -5.08 -1.32 -1.21 -4.99 115.64 102.40 3k1u s THR 181 Ca 0.00 -0.30 0.07 0.00 -1.21 0.00 0.00 61.69 60.25 3k1u s THR 181 Cb 0.00 -0.67 -0.04 0.00 -1.51 0.00 0.00 72.50 70.28 3k1u s THR 181 CO 0.00 -0.16 -0.16 -1.59 -2.21 0.00 0.00 174.62 170.50 3k1u s LYS 182 N -1.00 1.08 0.15 7.08 -2.85 -1.26 -1.23 119.74 121.72 3k1u s LYS 182 Ca -0.10 -1.25 -0.31 0.00 -1.00 0.00 0.00 55.97 53.31 3k1u s LYS 182 Cb -0.04 -1.06 -0.08 0.00 -2.06 0.00 0.00 37.83 34.59 3k1u s LYS 182 CO 0.04 0.22 1.31 -1.25 0.10 0.00 0.00 175.35 175.77 3k1u s PRO 183 N -2.54 4.38 0.00 1.78 0.04 -1.26 -4.75 135.00 132.65 3k1u s PRO 183 Ca 0.09 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.13 3k1u s PRO 183 Cb -0.06 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.24 3k1u s PRO 183 CO 0.04 -0.30 0.00 -0.85 0.04 0.00 0.00 177.00 175.93 3k1u n GLU 184 N 3.26 0.00 -1.89 4.56 0.28 -1.26 -4.92 120.64 120.66 3k1u n GLU 184 Ca 0.08 0.00 -0.33 0.00 -0.16 0.00 0.00 57.16 56.75 3k1u n GLU 184 Cb 0.43 0.00 0.03 0.00 1.43 0.00 0.00 31.44 33.33 3k1u n GLU 184 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 3k1u s LEU 185 N -1.93 3.42 0.47 -1.84 1.43 -1.26 -4.92 118.68 114.05 3k1u s LEU 185 Ca 0.00 1.86 0.18 0.00 -1.03 0.00 0.00 54.13 55.14 3k1u s LEU 185 Cb 0.00 -4.54 1.15 0.00 0.03 0.00 0.00 46.19 42.84 3k1u s LEU 185 CO 0.00 -1.36 1.99 -0.33 0.23 0.00 0.00 176.35 176.87 3k1u h GLU 186 N 0.18 0.26 -0.00 1.70 4.39 -1.99 0.45 114.58 119.56 3k1u h GLU 186 Ca -0.46 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.22 3k1u h GLU 186 Cb 1.23 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 3k1u h GLU 186 CO 0.56 0.17 -0.02 -2.67 -1.16 0.00 0.00 179.01 175.90 3k1u n TRP 187 N -4.45 0.00 0.94 4.33 4.27 -1.26 -3.44 117.44 117.83 3k1u n TRP 187 Ca 0.10 0.00 0.10 0.00 -3.89 0.00 0.00 57.50 53.81 3k1u n TRP 187 Cb 0.45 -0.04 -0.12 0.00 -1.36 0.00 0.00 31.31 30.24 3k1u n TRP 187 CO 0.00 0.00 0.00 0.39 -2.29 0.00 0.00 177.69 175.79 3k1u n GLU 188 N -0.70 0.04 -0.06 -2.67 1.02 0.14 -4.26 120.64 114.15 3k1u n GLU 188 Ca 0.21 -0.01 0.04 0.00 -0.02 0.00 0.00 57.16 57.38 3k1u n GLU 188 Cb 0.21 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.18 3k1u n GLU 188 CO 0.00 0.00 0.00 0.44 1.18 0.00 0.00 177.13 178.75 3k1u n ILE 189 N -1.55 1.23 -2.53 -3.67 -5.35 -1.20 -1.98 119.36 104.31 3k1u n ILE 189 Ca 0.04 -1.38 -0.43 0.00 -0.27 0.00 0.00 62.75 60.71 3k1u n ILE 189 Cb 0.34 0.24 -0.02 0.00 -1.74 0.00 0.00 39.64 38.46 3k1u n ILE 189 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 3k1u s LYS 190 N -1.62 4.07 0.00 6.28 1.02 -1.26 -4.04 119.74 124.19 3k1u s LYS 190 Ca 0.13 1.26 0.00 0.00 0.02 0.00 0.00 55.97 57.38 3k1u s LYS 190 Cb 0.11 -3.78 0.00 0.00 -0.52 0.00 0.00 37.83 33.64 3k1u s LYS 190 CO 0.01 -0.91 0.00 0.41 -0.92 0.00 0.00 175.35 173.94 3k1u n GLY 191 N 3.91 2.06 3.16 -3.33 0.00 -1.26 -1.08 105.19 108.64 3k1u n GLY 191 Ca 0.13 -0.37 -0.14 0.00 0.00 0.00 0.00 46.02 45.64 3k1u n GLY 191 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k1u s PHE 192 N 0.00 1.00 -0.59 1.61 0.08 -1.26 -4.93 117.98 113.90 3k1u s PHE 192 Ca 0.00 -0.62 -0.26 0.00 0.12 0.00 0.00 56.93 56.17 3k1u s PHE 192 Cb 0.00 -0.56 0.04 0.00 -0.57 0.00 0.00 43.02 41.93 3k1u s PHE 192 CO 0.00 -0.02 1.08 -1.58 -0.10 0.00 0.00 175.22 174.60 3k1u s TRP 193 N -2.19 2.66 -0.02 0.36 0.52 -1.26 -3.85 118.94 115.16 3k1u s TRP 193 Ca 0.02 0.11 0.01 0.00 0.02 0.00 0.00 56.10 56.26 3k1u s TRP 193 Cb -0.04 -4.32 0.02 0.00 -1.15 0.00 0.00 33.47 27.97 3k1u s TRP 193 CO 0.00 -1.54 -0.01 0.08 0.02 0.00 0.00 176.95 175.50 3k1u s VAL 194 N 4.54 0.17 -0.13 4.03 1.01 -1.05 -0.69 120.40 128.27 3k1u s VAL 194 Ca 0.35 0.02 0.01 0.00 0.00 0.00 0.00 61.98 62.36 3k1u s VAL 194 Cb -0.10 -0.22 0.02 0.00 0.00 0.00 0.00 36.38 36.08 3k1u s VAL 194 CO 0.20 0.10 -0.13 0.20 0.00 0.00 0.00 175.10 175.48 3k1u s ASN 195 N 0.59 2.52 0.01 3.32 0.02 -0.60 -2.83 114.94 117.97 3k1u s ASN 195 Ca -0.06 -0.43 -0.00 0.00 -1.02 0.00 0.00 52.86 51.35 3k1u s ASN 195 Cb -0.09 -1.09 0.00 0.00 0.02 0.00 0.00 41.25 40.10 3k1u s ASN 195 CO -0.01 -0.05 0.02 -1.84 0.02 0.00 0.00 177.10 175.24 3k1u n GLU 196 N 4.67 0.03 -3.86 -0.60 0.28 0.51 -3.89 120.64 117.78 3k1u n GLU 196 Ca -0.17 -0.10 -0.24 0.00 -0.16 0.00 0.00 57.16 56.49 3k1u n GLU 196 Cb 0.50 0.10 0.00 0.00 1.43 0.00 0.00 31.44 33.48 3k1u n GLU 196 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 3k1u n GLY 197 N -0.02 -0.27 3.76 -1.84 0.00 -1.26 -0.47 105.19 105.09 3k1u n GLY 197 Ca -0.00 0.14 -0.35 0.00 0.00 0.00 0.00 46.02 45.81 3k1u n GLY 197 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k1u s PRO 198 N -6.34 3.01 -0.08 1.61 0.04 -1.26 -3.99 135.00 127.99 3k1u s PRO 198 Ca 0.06 1.61 -0.13 0.00 0.04 0.00 0.00 61.00 62.58 3k1u s PRO 198 Cb -0.03 -1.96 0.03 0.00 0.04 0.00 0.00 34.50 32.58 3k1u s PRO 198 CO 0.86 -1.13 0.32 0.00 0.04 0.00 0.00 177.00 177.09 3k1u s ALA 199 N -1.91 -0.79 -0.11 8.56 0.00 -0.13 -4.73 121.76 122.64 3k1u s ALA 199 Ca 0.72 0.68 0.02 0.00 0.00 0.00 0.00 51.96 53.38 3k1u s ALA 199 Cb -0.25 -0.29 -0.01 0.00 0.00 0.00 0.00 23.12 22.57 3k1u s ALA 199 CO 0.34 -0.20 -0.18 0.08 0.00 0.00 0.00 175.76 175.80 3k1u s VAL 200 N -0.43 2.61 -0.06 0.00 1.01 -1.26 -0.88 120.40 121.38 3k1u s VAL 200 Ca -0.06 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.12 3k1u s VAL 200 Cb -0.04 -2.05 0.01 0.00 0.00 0.00 0.00 36.38 34.31 3k1u s VAL 200 CO 0.02 0.54 -0.12 -0.22 0.00 0.00 0.00 175.10 175.33 3k1u s LEU 201 N 0.26 1.62 -0.18 3.92 2.96 0.13 -4.85 118.68 122.53 3k1u s LEU 201 Ca -0.13 -0.29 -0.04 0.00 -0.22 0.00 0.00 54.13 53.46 3k1u s LEU 201 Cb -0.16 -0.80 -0.02 0.00 0.50 0.00 0.00 46.19 45.70 3k1u s LEU 201 CO 0.07 0.02 -0.02 -0.54 -1.32 0.00 0.00 176.35 174.56 3k1u s LYS 202 N 0.70 3.61 -0.05 1.98 1.02 -1.26 -0.29 119.74 125.44 3k1u s LYS 202 Ca -0.14 -0.54 -0.29 0.00 0.02 0.00 0.00 55.97 55.02 3k1u s LYS 202 Cb -0.16 -3.00 0.10 0.00 -0.52 0.00 0.00 37.83 34.25 3k1u s LYS 202 CO 0.03 0.08 0.82 0.21 -0.92 0.00 0.00 175.35 175.57 3k1u s LYS 203 N 0.81 0.88 -1.38 1.68 2.47 -0.76 -5.00 119.74 118.44 3k1u s LYS 203 Ca -0.00 0.00 -0.07 0.00 -1.56 0.00 0.00 55.97 54.34 3k1u s LYS 203 Cb -0.14 0.41 0.04 0.00 -1.46 0.00 0.00 37.83 36.68 3k1u s LYS 203 CO 0.02 -0.32 0.51 0.09 0.16 0.00 0.00 175.35 175.81 3k1u n ASN 204 N 0.42 -4.63 -0.08 1.43 3.02 -1.26 -1.09 115.26 113.07 3k1u n ASN 204 Ca -0.14 -0.32 -0.01 0.00 -0.03 0.00 0.00 54.58 54.08 3k1u n ASN 204 Cb 0.59 -3.80 -0.00 0.00 -0.61 0.00 0.00 39.78 35.96 3k1u n ASN 204 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k1u n GLY 205 N -1.29 0.46 3.40 7.41 0.00 -1.26 -5.00 105.19 108.91 3k1u n GLY 205 Ca -0.06 -0.17 -0.21 0.00 0.00 0.00 0.00 46.02 45.58 3k1u n GLY 205 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3k1u s LYS 206 N -0.86 1.47 -0.13 1.61 1.02 -0.25 -0.78 119.74 121.82 3k1u s LYS 206 Ca 0.00 -1.64 0.02 0.00 0.02 0.00 0.00 55.97 54.37 3k1u s LYS 206 Cb 0.00 -1.42 0.01 0.00 -0.52 0.00 0.00 37.83 35.89 3k1u s LYS 206 CO 0.00 0.26 -0.21 0.42 -0.92 0.00 0.00 175.35 174.90 3k1u s ILE 207 N -2.67 2.17 -0.16 2.17 1.01 0.16 -1.83 121.20 122.06 3k1u s ILE 207 Ca 0.25 -0.95 -0.03 0.00 0.00 0.00 0.00 60.65 59.92 3k1u s ILE 207 Cb -0.03 -1.87 -0.02 0.00 0.01 0.00 0.00 42.46 40.55 3k1u s ILE 207 CO 0.10 0.55 -0.07 -0.36 0.00 0.00 0.00 174.94 175.16 3k1u s PHE 208 N 0.72 2.93 -0.39 3.97 0.08 0.60 -1.21 117.98 124.67 3k1u s PHE 208 Ca -0.09 -0.58 -0.04 0.00 0.12 0.00 0.00 56.93 56.34 3k1u s PHE 208 Cb -0.16 -1.96 0.10 0.00 -0.57 0.00 0.00 43.02 40.43 3k1u s PHE 208 CO 0.00 -0.23 0.18 0.42 -0.10 0.00 0.00 175.22 175.49 3k1u s ILE 209 N 0.67 3.36 0.62 0.64 1.01 0.18 -0.70 121.20 126.99 3k1u s ILE 209 Ca -0.04 -1.88 -0.12 0.00 0.00 0.00 0.00 60.65 58.62 3k1u s ILE 209 Cb -0.15 -3.22 -0.03 0.00 0.01 0.00 0.00 42.46 39.06 3k1u s ILE 209 CO 0.02 -0.59 1.03 0.42 0.00 0.00 0.00 174.94 175.83 3k1u s THR 210 N 1.19 4.53 0.14 2.92 -4.23 -0.06 -0.42 115.64 119.71 3k1u s THR 210 Ca 0.06 0.87 -0.20 0.00 -1.18 0.00 0.00 61.69 61.24 3k1u s THR 210 Cb -0.22 -3.75 0.05 0.00 1.34 0.00 0.00 72.50 69.92 3k1u s THR 210 CO -0.03 -1.03 0.51 -0.72 -0.54 0.00 0.00 174.62 172.81 3k1u s TYR 211 N -3.08 -0.39 0.13 3.99 -0.85 -0.82 -0.95 117.35 115.39 3k1u s TYR 211 Ca 0.56 0.15 0.04 0.00 -0.52 0.00 0.00 57.07 57.30 3k1u s TYR 211 Cb -0.12 0.42 -0.04 0.00 0.38 0.00 0.00 41.96 42.60 3k1u s TYR 211 CO 0.51 -0.77 0.11 -1.12 -1.52 0.00 0.00 175.55 172.76 3k1u s SER 212 N -2.73 5.52 0.14 -0.18 0.01 0.37 -0.02 113.70 116.82 3k1u s SER 212 Ca 0.01 -0.09 -0.04 0.00 1.31 0.00 0.00 55.95 57.15 3k1u s SER 212 Cb 0.00 -1.45 -0.03 0.00 0.21 0.00 0.00 66.02 64.75 3k1u s SER 212 CO -0.12 0.11 0.13 0.00 0.41 0.00 0.00 173.24 173.77 3k1u s ALA 213 N -1.61 0.60 0.32 1.44 0.00 0.12 -0.36 121.76 122.27 3k1u s ALA 213 Ca 0.30 -1.30 0.00 0.00 0.00 0.00 0.00 51.96 50.97 3k1u s ALA 213 Cb -0.11 0.89 0.00 0.00 0.00 0.00 0.00 23.12 23.90 3k1u s ALA 213 CO 0.23 -0.54 0.00 0.43 0.00 0.00 0.00 175.76 175.87 3k1u n SER 214 N -0.14 -7.52 -4.65 0.00 7.64 -0.84 -2.38 113.62 105.73 3k1u n SER 214 Ca -0.06 0.58 -0.31 0.00 1.01 0.00 0.00 58.87 60.10 3k1u n SER 214 Cb 0.64 -3.87 0.17 0.00 -1.01 0.00 0.00 64.21 60.14 3k1u n SER 214 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3k1u s ALA 215 N -2.28 1.24 -0.24 -0.43 0.00 -0.24 -4.72 121.76 115.08 3k1u s ALA 215 Ca 0.00 0.48 -0.01 0.00 0.00 0.00 0.00 51.96 52.42 3k1u s ALA 215 Cb 0.00 -3.41 0.13 0.00 0.00 0.00 0.00 23.12 19.83 3k1u s ALA 215 CO 0.00 -2.87 2.17 0.25 0.00 0.00 0.00 175.76 175.31 3k1u n THR 216 N -4.30 2.67 -1.87 0.00 -2.24 -1.26 -2.55 114.28 104.72 3k1u n THR 216 Ca 0.10 -1.52 0.00 0.00 -2.27 0.00 0.00 64.05 60.37 3k1u n THR 216 Cb 0.52 -1.43 0.00 0.00 -2.10 0.00 0.00 70.33 67.32 3k1u n THR 216 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3k1u n ASP 217 N 0.77 0.00 0.18 3.42 5.68 -1.26 -4.94 116.55 120.39 3k1u n ASP 217 Ca 0.26 0.00 0.18 0.00 -0.50 0.00 0.00 54.79 54.72 3k1u n ASP 217 Cb 0.57 0.00 0.81 0.00 -1.14 0.00 0.00 41.12 41.36 3k1u n ASP 217 CO 0.00 0.00 0.00 1.62 -1.33 0.00 0.00 177.20 177.49 3k1u h VAL 218 N 0.00 0.47 -0.00 2.12 3.04 -1.86 -2.12 116.25 117.91 3k1u h VAL 218 Ca 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.69 3k1u h VAL 218 Cb 0.00 0.80 0.00 0.00 -2.01 0.00 0.00 31.29 30.08 3k1u h VAL 218 CO 0.00 0.00 -0.08 0.59 -1.01 0.00 0.00 177.57 177.07 3k1u n ASN 219 N -3.82 0.12 -4.77 3.17 3.02 -1.26 -3.39 115.26 108.32 3k1u n ASN 219 Ca 0.03 0.14 -0.41 0.00 -0.03 0.00 0.00 54.58 54.31 3k1u n ASN 219 Cb 0.38 -0.31 0.00 0.00 -0.61 0.00 0.00 39.78 39.25 3k1u n ASN 219 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k1u n TYR 220 N -1.39 2.94 -3.82 3.10 9.36 -0.79 -4.71 117.16 121.83 3k1u n TYR 220 Ca 0.09 0.45 -0.09 0.00 3.32 0.00 0.00 57.90 61.67 3k1u n TYR 220 Cb 0.31 -2.52 0.01 0.00 -0.63 0.00 0.00 39.34 36.52 3k1u n TYR 220 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3k1u s ILE 222 N -2.60 2.39 0.00 0.00 1.01 0.05 -0.71 121.20 121.34 3k1u s ILE 222 Ca 0.15 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 59.92 3k1u s ILE 222 Cb -0.05 -1.97 0.00 0.00 0.01 0.00 0.00 42.46 40.45 3k1u s ILE 222 CO 0.11 0.54 0.00 0.61 0.00 0.00 0.00 174.94 176.20 3k1u n GLY 223 N 3.83 2.81 2.95 6.18 0.00 0.98 -0.50 105.19 121.44 3k1u n GLY 223 Ca -0.19 -1.87 -0.12 0.00 0.00 0.00 0.00 46.02 43.84 3k1u n GLY 223 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3k1u s LEU 225 N 0.00 1.81 -0.06 0.99 1.43 0.44 -1.94 118.68 121.35 3k1u s LEU 225 Ca 0.00 0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.16 3k1u s LEU 225 Cb 0.00 0.22 0.01 0.00 0.03 0.00 0.00 46.19 46.45 3k1u s LEU 225 CO 0.00 -0.08 -0.15 -0.89 0.23 0.00 0.00 176.35 175.47 3k1u s THR 226 N -0.23 1.30 0.05 5.49 2.01 -0.26 -0.64 115.64 123.35 3k1u s THR 226 Ca -0.03 -0.60 0.05 0.00 0.31 0.00 0.00 61.69 61.42 3k1u s THR 226 Cb -0.02 -1.15 -0.02 0.00 0.01 0.00 0.00 72.50 71.32 3k1u s THR 226 CO 0.00 0.39 -0.13 0.00 -0.69 0.00 0.00 174.62 174.18 3k1u s ALA 227 N 0.43 1.11 0.25 7.40 0.00 -0.35 -0.72 121.76 129.87 3k1u s ALA 227 Ca -0.12 -0.86 -0.30 0.00 0.00 0.00 0.00 51.96 50.69 3k1u s ALA 227 Cb -0.14 -0.14 -0.10 0.00 0.00 0.00 0.00 23.12 22.74 3k1u s ALA 227 CO 0.04 0.18 1.41 -1.21 0.00 0.00 0.00 175.76 176.18 3k1u s GLU 228 N -1.33 4.29 0.51 0.00 0.41 -1.26 -0.66 118.70 120.65 3k1u s GLU 228 Ca -0.00 2.27 0.18 0.00 -0.41 0.00 0.00 54.97 57.00 3k1u s GLU 228 Cb -0.09 -3.12 1.27 0.00 -1.78 0.00 0.00 34.13 30.42 3k1u s GLU 228 CO 0.01 -0.38 2.11 1.05 -0.49 0.00 0.00 175.26 177.56 3k1u h GLU 229 N 4.96 0.00 -0.59 1.61 4.11 -1.25 -1.42 114.58 122.00 3k1u h GLU 229 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 3k1u h GLU 229 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 3k1u h GLU 229 CO 0.77 0.07 0.00 0.27 0.07 0.00 0.00 179.01 180.19 3k1u n ASN 230 N -4.30 5.37 -4.63 3.06 0.23 -1.26 -4.93 115.26 108.79 3k1u n ASN 230 Ca -0.03 -2.78 -0.28 0.00 -0.53 0.00 0.00 54.58 50.95 3k1u n ASN 230 Cb 0.15 -0.65 0.12 0.00 -2.08 0.00 0.00 39.78 37.33 3k1u n ASN 230 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 3k1u s SER 231 N -0.88 4.06 -0.70 0.53 1.04 -0.54 -4.97 113.70 112.25 3k1u s SER 231 Ca 0.53 0.49 -0.27 0.00 0.48 0.00 0.00 55.95 57.19 3k1u s SER 231 Cb 0.39 -0.85 0.01 0.00 0.10 0.00 0.00 66.02 65.67 3k1u s SER 231 CO 0.18 -2.14 1.52 0.20 0.98 0.00 0.00 173.24 173.98 3k1u s ASN 232 N -4.69 5.81 0.54 7.02 0.01 -1.26 -4.87 114.94 117.50 3k1u s ASN 232 Ca 0.66 -0.17 0.31 0.00 -0.71 0.00 0.00 52.86 52.96 3k1u s ASN 232 Cb -0.08 -2.55 1.47 0.00 0.41 0.00 0.00 41.25 40.50 3k1u s ASN 232 CO 0.49 -2.06 2.04 -0.07 -1.51 0.00 0.00 177.10 176.00 3k1u h LEU 233 N 14.42 0.00 -3.40 0.60 3.38 -1.92 -2.26 115.31 126.13 3k1u h LEU 233 Ca -0.26 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 57.57 3k1u h LEU 233 Cb 1.09 0.00 -0.09 0.00 0.09 0.00 0.00 40.66 41.76 3k1u h LEU 233 CO 1.26 0.09 0.19 0.18 0.09 0.00 0.00 178.44 180.24 3k1u n LEU 234 N -3.33 5.51 -4.17 1.67 4.77 -1.26 -4.76 117.00 115.43 3k1u n LEU 234 Ca -0.01 -2.85 -0.34 0.00 -0.03 0.00 0.00 56.01 52.79 3k1u n LEU 234 Cb 0.27 -0.71 -0.15 0.00 -2.33 0.00 0.00 43.42 40.51 3k1u n LEU 234 CO 0.28 0.71 -0.46 -0.62 -1.33 0.00 0.00 177.39 175.97 3k1u s ASP 235 N -0.78 3.87 0.59 -1.43 -1.08 -0.85 -4.96 116.67 112.04 3k1u s ASP 235 Ca 0.48 -0.79 0.30 0.00 -0.52 0.00 0.00 52.55 52.02 3k1u s ASP 235 Cb 0.38 -1.59 1.74 0.00 -1.46 0.00 0.00 42.92 41.99 3k1u s ASP 235 CO 0.12 -0.07 2.16 0.07 0.52 0.00 0.00 175.17 177.97 3k1u h LYS 236 N 7.97 0.00 0.00 4.34 2.10 -1.85 -0.44 116.57 128.68 3k1u h LYS 236 Ca -0.37 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.28 3k1u h LYS 236 Cb 1.12 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.45 3k1u h LYS 236 CO 0.59 0.00 0.00 0.09 -2.00 0.00 0.00 179.45 178.13 3k1u n ASN 237 N -3.76 0.00 0.16 7.07 3.02 -1.26 -1.64 115.26 118.84 3k1u n ASN 237 Ca -0.00 0.45 0.13 0.00 -0.03 0.00 0.00 54.58 55.13 3k1u n ASN 237 Cb 0.24 -0.47 0.41 0.00 -0.61 0.00 0.00 39.78 39.34 3k1u n ASN 237 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 3k1u h SER 238 N 0.00 0.00 -3.50 6.41 0.02 -1.31 -3.44 113.55 111.73 3k1u h SER 238 Ca 0.00 0.00 -0.65 0.00 -0.84 0.00 0.00 61.79 60.30 3k1u h SER 238 Cb 0.26 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 62.57 3k1u h SER 238 CO 0.00 0.00 -0.65 0.26 -1.14 0.00 0.00 176.83 175.30 3k1u s TRP 239 N -3.25 3.05 -0.13 3.45 0.52 -0.65 -4.24 118.94 117.69 3k1u s TRP 239 Ca 0.07 -0.49 -0.18 0.00 0.02 0.00 0.00 56.10 55.52 3k1u s TRP 239 Cb 0.10 -2.14 -0.04 0.00 -1.15 0.00 0.00 33.47 30.23 3k1u s TRP 239 CO 0.56 -0.31 0.49 0.99 0.02 0.00 0.00 176.95 178.70 3k1u s THR 240 N 1.26 5.17 -0.25 2.01 2.01 0.10 -4.84 115.64 121.10 3k1u s THR 240 Ca 0.04 0.95 -0.16 0.00 0.31 0.00 0.00 61.69 62.84 3k1u s THR 240 Cb -0.15 -3.82 -0.04 0.00 0.01 0.00 0.00 72.50 68.51 3k1u s THR 240 CO 0.02 0.30 0.41 -0.75 -0.69 0.00 0.00 174.62 173.90 3k1u s LYS 241 N 0.82 4.07 0.28 4.92 2.20 -1.26 -1.10 119.74 129.67 3k1u s LYS 241 Ca 0.26 0.14 -0.30 0.00 -0.36 0.00 0.00 55.97 55.71 3k1u s LYS 241 Cb -0.15 -3.62 -0.13 0.00 -1.51 0.00 0.00 37.83 32.42 3k1u s LYS 241 CO 0.10 -0.22 1.41 0.45 -0.36 0.00 0.00 175.35 176.74 3k1u n SER 242 N 5.10 2.97 0.22 1.43 2.88 -1.26 -4.90 113.62 120.07 3k1u n SER 242 Ca -0.08 1.16 0.11 0.00 -1.33 0.00 0.00 58.87 58.74 3k1u n SER 242 Cb 0.51 -1.47 0.27 0.00 -0.75 0.00 0.00 64.21 62.76 3k1u n SER 242 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 3k1u h GLN 243 N 3.89 0.00 -4.48 -1.46 4.20 -2.03 -3.46 115.11 111.77 3k1u h GLN 243 Ca -0.46 0.00 -0.19 0.00 0.06 0.00 0.00 58.65 58.07 3k1u h GLN 243 Cb 1.27 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.89 3k1u h GLN 243 CO 0.73 0.10 -0.69 0.95 -0.67 0.00 0.00 178.83 179.25 3k1u s THR 244 N -3.30 0.50 0.43 -0.54 -4.23 -1.26 -5.03 115.64 102.21 3k1u s THR 244 Ca 0.05 -1.82 -0.26 0.00 -1.18 0.00 0.00 61.69 58.48 3k1u s THR 244 Cb 0.07 -1.54 -0.09 0.00 1.34 0.00 0.00 72.50 72.28 3k1u s THR 244 CO 0.65 -0.89 1.32 -2.65 -0.54 0.00 0.00 174.62 172.52 3k1u n PRO 245 N 0.13 2.04 0.05 3.99 -0.02 -1.26 -4.88 135.00 135.05 3k1u n PRO 245 Ca -0.14 0.73 0.13 0.00 -2.02 0.00 0.00 63.50 62.20 3k1u n PRO 245 Cb 0.60 -2.46 0.33 0.00 -0.02 0.00 0.00 33.50 31.96 3k1u n PRO 245 CO 0.00 0.00 0.00 1.33 1.98 0.00 0.00 175.50 178.81 3k1u n VAL 246 N -0.18 0.31 -3.64 -1.45 0.24 0.35 -4.87 118.33 109.10 3k1u n VAL 246 Ca 0.06 -0.19 -0.09 0.00 -2.04 0.00 0.00 64.34 62.08 3k1u n VAL 246 Cb 0.40 -0.28 -0.07 0.00 -1.47 0.00 0.00 33.84 32.42 3k1u n VAL 246 CO 0.00 0.00 0.00 0.12 -2.14 0.00 0.00 176.83 174.81 3k1u s PHE 247 N -3.09 -0.97 0.30 6.34 5.36 -1.15 -4.51 117.98 120.26 3k1u s PHE 247 Ca 0.10 2.06 -0.15 0.00 -0.96 0.00 0.00 56.93 57.97 3k1u s PHE 247 Cb 0.15 0.52 0.02 0.00 -0.34 0.00 0.00 43.02 43.36 3k1u s PHE 247 CO 0.65 -0.48 0.63 -1.59 -1.46 0.00 0.00 175.22 172.97 3k1u s LYS 248 N 1.23 1.84 0.11 10.12 -2.85 -1.26 -0.77 119.74 128.17 3k1u s LYS 248 Ca -0.07 -1.28 -0.34 0.00 -1.00 0.00 0.00 55.97 53.29 3k1u s LYS 248 Cb -0.05 0.55 -0.18 0.00 -2.06 0.00 0.00 37.83 36.09 3k1u s LYS 248 CO -0.13 -0.82 0.82 2.41 0.10 0.00 0.00 175.35 177.72 3k1u n THR 249 N -0.47 1.04 -3.86 3.79 -1.04 -1.26 -4.44 114.28 108.04 3k1u n THR 249 Ca -0.04 -0.26 -0.24 0.00 -2.04 0.00 0.00 64.05 61.47 3k1u n THR 249 Cb 0.60 -0.08 -0.04 0.00 -1.82 0.00 0.00 70.33 69.00 3k1u n THR 249 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 3k1u s SER 250 N -0.48 4.70 0.00 8.00 0.15 -0.40 -4.98 113.70 120.70 3k1u s SER 250 Ca 0.76 -1.02 0.00 0.00 0.70 0.00 0.00 55.95 56.39 3k1u s SER 250 Cb -1.07 -0.23 0.00 0.00 -1.71 0.00 0.00 66.02 63.01 3k1u s SER 250 CO 0.56 -0.76 0.00 -1.84 1.20 0.00 0.00 173.24 172.41 3k1u n GLU 252 N -1.51 0.00 -0.05 5.44 0.00 -1.26 -1.58 120.64 121.68 3k1u n GLU 252 Ca 0.00 0.00 0.12 0.00 0.00 0.00 0.00 57.16 57.28 3k1u n GLU 252 Cb 0.64 0.00 0.39 0.00 0.00 0.00 0.00 31.44 32.47 3k1u n GLU 252 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 3k1u n ASN 253 N 0.00 1.91 -3.70 -1.84 5.03 -1.26 -4.97 115.26 110.42 3k1u n ASN 253 Ca 0.00 -1.68 -0.23 0.00 0.87 0.00 0.00 54.58 53.54 3k1u n ASN 253 Cb 0.00 -0.06 0.04 0.00 -1.02 0.00 0.00 39.78 38.74 3k1u n ASN 253 CO 0.00 0.00 0.00 1.41 -1.83 0.00 0.00 177.26 176.84 3k1u n HIS 254 N 0.48 -2.10 -3.92 3.10 8.25 -0.62 -4.44 115.22 115.97 3k1u n HIS 254 Ca 0.17 0.88 -0.28 0.00 -0.26 0.00 0.00 57.72 58.24 3k1u n HIS 254 Cb 0.40 -4.45 -0.17 0.00 1.12 0.00 0.00 29.99 26.89 3k1u n HIS 254 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 3k1u s GLN 255 N -6.05 1.64 -0.12 -0.41 -1.52 -0.88 -4.34 119.66 107.98 3k1u s GLN 255 Ca 0.18 -0.37 0.03 0.00 -1.95 0.00 0.00 55.36 53.25 3k1u s GLN 255 Cb -0.09 -1.77 0.01 0.00 -0.22 0.00 0.00 33.01 30.94 3k1u s GLN 255 CO 0.80 -0.30 -0.21 0.71 -0.25 0.00 0.00 175.29 176.04 3k1u s TYR 256 N 1.65 2.46 -0.75 0.91 2.02 0.38 -1.27 117.35 122.75 3k1u s TYR 256 Ca 0.04 -1.13 -0.01 0.00 -0.37 0.00 0.00 57.07 55.60 3k1u s TYR 256 Cb -0.13 -1.68 -0.01 0.00 -0.40 0.00 0.00 41.96 39.74 3k1u s TYR 256 CO -0.09 -0.50 0.64 0.41 -1.57 0.00 0.00 175.55 174.44 3k1u n GLY 257 N 3.85 -0.17 3.75 0.71 0.00 -1.22 -1.31 105.19 110.81 3k1u n GLY 257 Ca -0.20 -0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 3k1u n GLY 257 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3k1u s PRO 258 N -4.63 4.47 0.00 1.61 0.04 -1.23 -4.51 135.00 130.75 3k1u s PRO 258 Ca 0.08 2.00 0.00 0.00 0.04 0.00 0.00 61.00 63.12 3k1u s PRO 258 Cb -0.01 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.37 3k1u s PRO 258 CO 0.48 -0.06 0.00 0.41 0.04 0.00 0.00 177.00 177.87 3k1u n GLY 259 N 1.45 -0.87 2.95 0.56 0.00 -0.40 -3.46 105.19 105.42 3k1u n GLY 259 Ca 0.02 -0.70 -0.16 0.00 0.00 0.00 0.00 46.02 45.18 3k1u n GLY 259 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 3k1u n HIS 260 N 0.37 -1.17 -2.61 1.61 -0.00 -1.26 -1.80 115.22 110.35 3k1u n HIS 260 Ca 0.00 0.48 -0.25 0.00 0.46 0.00 0.00 57.72 58.41 3k1u n HIS 260 Cb 0.00 -1.30 0.02 0.00 -0.12 0.00 0.00 29.99 28.59 3k1u n HIS 260 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 3k1u s ASN 261 N -2.02 5.73 0.31 0.26 4.22 -1.26 -4.07 114.94 118.11 3k1u s ASN 261 Ca 0.06 0.59 0.04 0.00 -2.14 0.00 0.00 52.86 51.41 3k1u s ASN 261 Cb -0.01 -1.70 -0.02 0.00 1.28 0.00 0.00 41.25 40.81 3k1u s ASN 261 CO 0.47 -0.90 0.15 -0.24 -2.04 0.00 0.00 177.10 174.55 3k1u n SER 262 N -2.38 0.64 -4.00 3.54 2.88 0.31 -4.54 113.62 110.07 3k1u n SER 262 Ca 0.03 -2.76 -0.18 0.00 -1.33 0.00 0.00 58.87 54.63 3k1u n SER 262 Cb 0.57 0.99 -0.15 0.00 -0.75 0.00 0.00 64.21 64.88 3k1u n SER 262 CO 0.00 0.00 0.00 -0.36 -1.23 0.00 0.00 175.04 173.45 3k1u s PHE 263 N -2.88 0.75 0.00 0.66 0.08 -1.26 -1.55 117.98 113.78 3k1u s PHE 263 Ca 0.21 -0.15 0.00 0.00 0.12 0.00 0.00 56.93 57.12 3k1u s PHE 263 Cb 0.01 -0.50 0.00 0.00 -0.57 0.00 0.00 43.02 41.96 3k1u s PHE 263 CO 0.15 -0.03 0.00 -2.37 -0.10 0.00 0.00 175.22 172.88 3k1u n THR 264 N 2.95 0.00 -4.26 0.64 5.66 -0.53 -4.84 114.28 113.91 3k1u n THR 264 Ca -0.14 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.65 3k1u n THR 264 Cb 0.57 0.00 -0.12 0.00 -1.55 0.00 0.00 70.33 69.23 3k1u n THR 264 CO 0.00 0.00 0.00 0.54 -3.05 0.00 0.00 175.07 172.56 3k1u s VAL 265 N -1.90 1.51 1.08 1.08 0.11 -1.26 -0.57 120.40 120.46 3k1u s VAL 265 Ca 0.00 -1.58 -0.12 0.00 -2.93 0.00 0.00 61.98 57.34 3k1u s VAL 265 Cb 0.00 -1.49 0.24 0.00 -1.53 0.00 0.00 36.38 33.60 3k1u s VAL 265 CO 0.00 -0.21 1.06 -0.94 -3.33 0.00 0.00 175.10 171.68 3k1u s SER 266 N -2.10 1.76 0.41 3.54 1.04 -0.16 -4.86 113.70 113.33 3k1u s SER 266 Ca 0.06 1.47 0.07 0.00 0.48 0.00 0.00 55.95 58.04 3k1u s SER 266 Cb -0.08 -2.19 0.86 0.00 0.10 0.00 0.00 66.02 64.71 3k1u s SER 266 CO 0.04 -3.71 2.05 -0.33 0.98 0.00 0.00 173.24 172.26 3k1u h GLU 267 N -2.29 0.49 -0.07 4.02 3.07 -1.94 -0.67 114.58 117.21 3k1u h GLU 267 Ca -0.57 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.25 3k1u h GLU 267 Cb 1.32 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 29.13 3k1u h GLU 267 CO 0.52 0.35 0.00 -0.40 -1.40 0.00 0.00 179.01 178.08 3k1u n ASP 268 N -4.46 1.59 0.00 1.42 5.68 -1.26 -4.94 116.55 114.59 3k1u n ASP 268 Ca 0.02 -1.58 0.00 0.00 -0.50 0.00 0.00 54.79 52.74 3k1u n ASP 268 Cb 0.08 -0.04 0.00 0.00 -1.14 0.00 0.00 41.12 40.03 3k1u n ASP 268 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3k1u n GLY 269 N 1.17 0.50 0.07 6.12 0.00 -0.26 -4.90 105.19 107.89 3k1u n GLY 269 Ca 0.18 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.11 3k1u n GLY 269 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3k1u h LYS 270 N 1.31 0.03 -6.23 1.61 1.57 -1.92 -3.46 116.57 109.48 3k1u h LYS 270 Ca 0.00 -0.04 -0.61 0.00 -1.87 0.00 0.00 60.65 58.12 3k1u h LYS 270 Cb 0.17 0.02 -0.27 0.00 0.08 0.00 0.00 32.23 32.23 3k1u h LYS 270 CO 0.00 0.80 -0.85 -1.01 -0.57 0.00 0.00 179.45 177.82 3k1u s HIS 271 N -2.65 1.95 0.38 -1.35 3.76 -1.26 -5.00 115.29 111.11 3k1u s HIS 271 Ca -0.02 -0.38 -0.24 0.00 -0.15 0.00 0.00 55.06 54.26 3k1u s HIS 271 Cb 0.09 -1.19 -0.10 0.00 1.11 0.00 0.00 32.58 32.50 3k1u s HIS 271 CO 0.83 0.07 1.00 -0.51 -0.85 0.00 0.00 174.74 175.27 3k1u s ASP 272 N -1.01 6.97 -0.07 1.40 1.01 -1.26 -0.98 116.67 122.72 3k1u s ASP 272 Ca 0.09 1.92 0.02 0.00 0.71 0.00 0.00 52.55 55.28 3k1u s ASP 272 Cb -0.09 -2.58 0.01 0.00 1.01 0.00 0.00 42.92 41.28 3k1u s ASP 272 CO 0.01 -0.34 -0.11 -0.69 0.21 0.00 0.00 175.17 174.25 3k1u s VAL 273 N -1.73 1.08 -0.13 -1.27 1.01 0.27 -0.90 120.40 118.74 3k1u s VAL 273 Ca 0.56 -0.43 -0.18 0.00 0.00 0.00 0.00 61.98 61.93 3k1u s VAL 273 Cb -0.19 -1.00 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 3k1u s VAL 273 CO 0.24 0.35 0.45 -0.51 0.00 0.00 0.00 175.10 175.63 3k1u s ILE 274 N 0.78 5.20 -0.15 2.22 2.07 0.31 -1.45 121.20 130.19 3k1u s ILE 274 Ca -0.13 0.90 0.01 0.00 -1.41 0.00 0.00 60.65 60.02 3k1u s ILE 274 Cb -0.15 -3.79 0.01 0.00 0.13 0.00 0.00 42.46 38.65 3k1u s ILE 274 CO 0.02 0.33 -0.19 -0.69 -1.91 0.00 0.00 174.94 172.50 3k1u s VAL 275 N 0.63 2.31 0.24 4.00 1.01 -0.59 -1.28 120.40 126.72 3k1u s VAL 275 Ca 0.25 -0.89 -0.15 0.00 0.00 0.00 0.00 61.98 61.18 3k1u s VAL 275 Cb -0.15 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.29 3k1u s VAL 275 CO 0.09 0.53 0.53 -0.72 0.00 0.00 0.00 175.10 175.54 3k1u s TYR 276 N 0.86 0.17 0.19 5.22 -0.85 -0.27 -0.53 117.35 122.13 3k1u s TYR 276 Ca -0.05 -0.55 0.08 0.00 -0.52 0.00 0.00 57.07 56.03 3k1u s TYR 276 Cb -0.15 0.33 -0.04 0.00 0.38 0.00 0.00 41.96 42.48 3k1u s TYR 276 CO -0.02 -1.03 -0.01 -3.38 -1.52 0.00 0.00 175.55 169.59 3k1u s HIS 277 N -3.97 2.81 0.17 -3.49 -3.43 -0.75 -0.22 115.29 106.41 3k1u s HIS 277 Ca 0.18 -0.16 -0.23 0.00 -0.80 0.00 0.00 55.06 54.05 3k1u s HIS 277 Cb -0.02 -1.35 0.06 0.00 -1.43 0.00 0.00 32.58 29.85 3k1u s HIS 277 CO 0.07 0.53 0.64 0.00 -2.00 0.00 0.00 174.74 173.98 3k1u s ALA 278 N -1.81 -1.55 0.27 -1.38 0.00 -0.73 -1.28 121.76 115.28 3k1u s ALA 278 Ca 0.28 0.38 0.06 0.00 0.00 0.00 0.00 51.96 52.67 3k1u s ALA 278 Cb -0.09 0.85 -0.03 0.00 0.00 0.00 0.00 23.12 23.86 3k1u s ALA 278 CO 0.18 -0.81 0.36 1.03 0.00 0.00 0.00 175.76 176.52 3k1u s ARG 279 N -3.74 3.24 -0.11 0.00 0.52 -0.43 -1.13 118.95 117.31 3k1u s ARG 279 Ca 0.03 -0.90 0.14 0.00 -0.52 0.00 0.00 55.73 54.48 3k1u s ARG 279 Cb -0.02 -2.80 0.37 0.00 0.52 0.00 0.00 34.95 33.02 3k1u s ARG 279 CO -0.09 0.32 1.27 0.27 0.02 0.00 0.00 175.30 177.09 3k1u n ASN 280 N -1.43 3.10 -4.00 0.23 0.23 -1.26 -0.47 115.26 111.67 3k1u n ASN 280 Ca -0.06 -2.71 -0.08 0.00 -0.53 0.00 0.00 54.58 51.19 3k1u n ASN 280 Cb 0.58 -0.39 -0.09 0.00 -2.08 0.00 0.00 39.78 37.79 3k1u n ASN 280 CO 0.00 0.00 0.00 -0.72 -0.93 0.00 0.00 177.26 175.61 3k1u s TYR 281 N -2.26 0.35 -0.07 -2.53 -0.85 -1.26 -4.86 117.35 105.86 3k1u s TYR 281 Ca 0.31 -0.78 0.14 0.00 -0.52 0.00 0.00 57.07 56.21 3k1u s TYR 281 Cb 0.24 -0.25 -0.20 0.00 0.38 0.00 0.00 41.96 42.13 3k1u s TYR 281 CO 0.08 -0.38 0.20 -2.37 -1.52 0.00 0.00 175.55 171.56 3k1u n THR 282 N 0.42 0.43 -3.26 -3.49 5.66 -1.26 -4.85 114.28 107.93 3k1u n THR 282 Ca -0.17 -0.45 -0.46 0.00 -3.05 0.00 0.00 64.05 59.92 3k1u n THR 282 Cb 0.60 -0.20 -0.05 0.00 -1.55 0.00 0.00 70.33 69.13 3k1u n THR 282 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 3k1u s GLU 283 N -2.72 3.00 0.10 1.09 2.02 -1.26 -4.83 118.70 116.11 3k1u s GLU 283 Ca -0.06 -1.62 -0.12 0.00 0.02 0.00 0.00 54.97 53.19 3k1u s GLU 283 Cb 0.07 -4.29 -0.16 0.00 0.10 0.00 0.00 34.13 29.85 3k1u s GLU 283 CO 0.60 -1.38 1.29 0.82 0.02 0.00 0.00 175.26 176.61 3k1u h ILE 284 N 5.90 1.28 -0.25 -1.63 2.04 -2.02 -3.47 117.51 119.35 3k1u h ILE 284 Ca -0.30 -2.04 -0.11 0.00 1.00 0.00 0.00 64.86 63.42 3k1u h ILE 284 Cb 1.10 2.07 -0.04 0.00 -0.74 0.00 0.00 36.82 39.20 3k1u h ILE 284 CO 1.05 0.64 -0.10 0.29 0.00 0.00 0.00 178.15 180.04 3k1u n LYS 285 N -3.91 -0.98 -3.84 2.37 5.02 -1.26 -4.90 118.16 110.66 3k1u n LYS 285 Ca -0.08 0.57 -0.06 0.00 -2.02 0.00 0.00 58.31 56.71 3k1u n LYS 285 Cb 0.77 -4.48 0.02 0.00 -0.02 0.00 0.00 35.03 31.32 3k1u n LYS 285 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 3k1u s GLY 286 N -2.40 0.25 -0.08 0.72 0.00 -1.26 -5.11 107.32 99.45 3k1u s GLY 286 Ca 0.00 -0.57 -0.30 0.00 0.00 0.00 0.00 44.72 43.85 3k1u s GLY 286 CO 0.00 0.76 2.08 1.34 0.00 0.00 0.00 173.10 177.28 3k1u n ASP 287 N -1.31 3.70 -0.00 1.64 -0.08 -1.26 -4.84 116.55 114.40 3k1u n ASP 287 Ca -0.06 0.62 0.20 0.00 -1.51 0.00 0.00 54.79 54.03 3k1u n ASP 287 Cb 0.60 -1.52 0.68 0.00 2.34 0.00 0.00 41.12 43.22 3k1u n ASP 287 CO 0.00 0.00 0.00 -0.65 0.12 0.00 0.00 177.20 176.67 3k1u h PRO 288 N 12.34 0.02 -0.05 -0.67 0.11 -1.93 -1.58 132.00 140.23 3k1u h PRO 288 Ca -0.46 -0.00 0.02 0.00 0.11 0.00 0.00 66.00 65.67 3k1u h PRO 288 Cb 1.25 -0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.35 3k1u h PRO 288 CO 0.95 0.01 0.04 1.25 -0.21 0.00 0.00 178.00 180.05 3k1u h LEU 289 N 0.02 0.00 -2.35 2.35 5.85 -1.92 -2.50 115.31 116.76 3k1u h LEU 289 Ca 0.25 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.97 3k1u h LEU 289 Cb 0.99 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.02 3k1u h LEU 289 CO -0.01 0.00 0.00 -1.22 -0.34 0.00 0.00 178.44 176.87 3k1u n TYR 290 N -4.42 0.34 -2.95 1.25 4.01 -0.61 -4.85 117.16 109.92 3k1u n TYR 290 Ca -0.02 -0.31 -0.41 0.00 -0.16 0.00 0.00 57.90 57.00 3k1u n TYR 290 Cb 0.14 -0.01 -0.05 0.00 -0.31 0.00 0.00 39.34 39.11 3k1u n TYR 290 CO 0.00 0.00 0.00 0.34 -0.46 0.00 0.00 176.86 176.74 3k1u s ASP 291 N -1.04 6.75 0.00 7.72 -1.08 -0.94 -4.95 116.67 123.12 3k1u s ASP 291 Ca 0.23 0.91 0.18 0.00 -0.52 0.00 0.00 52.55 53.35 3k1u s ASP 291 Cb 0.13 -2.41 0.72 0.00 -1.46 0.00 0.00 42.92 39.91 3k1u s ASP 291 CO 0.18 -0.49 1.51 -0.81 0.52 0.00 0.00 175.17 176.09 3k1u n PRO 292 N 5.95 1.57 -1.04 4.34 -0.04 -1.26 -4.50 135.00 140.03 3k1u n PRO 292 Ca 0.04 -0.87 -0.16 0.00 -0.04 0.00 0.00 63.50 62.47 3k1u n PRO 292 Cb 0.48 -1.34 0.20 0.00 -0.04 0.00 0.00 33.50 32.80 3k1u n PRO 292 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3k1u n ASN 293 N 0.11 3.96 -4.68 3.54 3.02 -1.26 -4.30 115.26 115.64 3k1u n ASN 293 Ca 0.14 -3.32 -0.42 0.00 -0.03 0.00 0.00 54.58 50.95 3k1u n ASN 293 Cb 0.26 -0.78 -0.03 0.00 -0.61 0.00 0.00 39.78 38.63 3k1u n ASN 293 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 3k1u s ARG 294 N -2.86 4.30 0.09 3.52 0.52 -1.26 -4.48 118.95 118.78 3k1u s ARG 294 Ca 0.50 1.69 0.05 0.00 -0.52 0.00 0.00 55.73 57.45 3k1u s ARG 294 Cb 0.42 -3.63 -0.04 0.00 0.52 0.00 0.00 34.95 32.21 3k1u s ARG 294 CO 0.11 -0.55 -0.01 -1.01 0.02 0.00 0.00 175.30 173.86 3k1u s HIS 295 N 2.68 2.97 -0.09 -0.53 3.76 -0.28 -1.93 115.29 121.87 3k1u s HIS 295 Ca 0.56 -0.04 -0.25 0.00 -0.15 0.00 0.00 55.06 55.18 3k1u s HIS 295 Cb -0.24 -1.53 -0.03 0.00 1.11 0.00 0.00 32.58 31.89 3k1u s HIS 295 CO 0.20 0.47 0.80 0.99 -0.85 0.00 0.00 174.74 176.35 3k1u s THR 296 N -1.29 4.96 0.09 1.30 2.01 0.46 -1.78 115.64 121.38 3k1u s THR 296 Ca 0.25 1.62 0.03 0.00 0.31 0.00 0.00 61.69 63.90 3k1u s THR 296 Cb -0.12 -4.13 -0.04 0.00 0.01 0.00 0.00 72.50 68.23 3k1u s THR 296 CO 0.17 0.16 -0.08 -0.13 -0.69 0.00 0.00 174.62 174.05 3k1u s ARG 297 N 1.30 0.77 -0.05 4.92 0.52 0.69 -0.99 118.95 126.11 3k1u s ARG 297 Ca 0.40 -1.14 -0.05 0.00 -0.52 0.00 0.00 55.73 54.43 3k1u s ARG 297 Cb -0.18 -0.36 0.01 0.00 0.52 0.00 0.00 34.95 34.94 3k1u s ARG 297 CO 0.18 0.04 0.14 0.00 0.02 0.00 0.00 175.30 175.68 3k1u s ALA 298 N -2.64 -0.35 0.03 2.13 0.00 -1.26 -1.12 121.76 118.55 3k1u s ALA 298 Ca 0.04 0.38 -0.07 0.00 0.00 0.00 0.00 51.96 52.32 3k1u s ALA 298 Cb -0.01 -0.22 -0.00 0.00 0.00 0.00 0.00 23.12 22.88 3k1u s ALA 298 CO -0.02 -0.07 0.14 -0.65 0.00 0.00 0.00 175.76 175.16 3k1u s GLN 299 N 0.02 0.62 0.29 0.00 -0.21 -0.40 -4.83 119.66 115.16 3k1u s GLN 299 Ca -0.01 -0.66 -0.29 0.00 0.02 0.00 0.00 55.36 54.42 3k1u s GLN 299 Cb -0.01 0.25 -0.10 0.00 1.00 0.00 0.00 33.01 34.15 3k1u s GLN 299 CO 0.00 -0.16 1.15 0.42 -2.12 0.00 0.00 175.29 174.58 3k1u s ILE 300 N -2.45 3.29 -0.10 1.08 -1.09 -1.26 -0.53 121.20 120.14 3k1u s ILE 300 Ca -0.06 1.30 -0.15 0.00 -2.23 0.00 0.00 60.65 59.51 3k1u s ILE 300 Cb -0.02 -3.83 -0.05 0.00 -1.58 0.00 0.00 42.46 36.99 3k1u s ILE 300 CO -0.04 0.31 0.38 -0.63 -1.23 0.00 0.00 174.94 173.73 3k1u s ILE 301 N -1.16 5.19 0.12 2.92 1.01 -0.07 -4.84 121.20 124.37 3k1u s ILE 301 Ca 0.46 0.76 0.01 0.00 0.00 0.00 0.00 60.65 61.87 3k1u s ILE 301 Cb -0.34 -3.71 -0.04 0.00 0.01 0.00 0.00 42.46 38.39 3k1u s ILE 301 CO 0.44 0.43 0.28 0.20 0.00 0.00 0.00 174.94 176.29 3k1u s ASN 302 N -0.00 6.36 -0.09 3.58 0.01 -0.76 -4.61 114.94 119.42 3k1u s ASN 302 Ca 0.22 0.26 0.04 0.00 -0.71 0.00 0.00 52.86 52.66 3k1u s ASN 302 Cb -0.15 -1.95 -0.01 0.00 0.41 0.00 0.00 41.25 39.55 3k1u s ASN 302 CO 0.09 0.08 -0.21 0.26 -1.51 0.00 0.00 177.10 175.81 3k1u s TRP 303 N -1.67 2.59 0.62 2.20 0.52 -1.26 0.07 118.94 122.01 3k1u s TRP 303 Ca 0.36 -0.77 -0.06 0.00 0.02 0.00 0.00 56.10 55.64 3k1u s TRP 303 Cb -0.12 -1.70 0.02 0.00 -1.15 0.00 0.00 33.47 30.52 3k1u s TRP 303 CO 0.28 -0.25 0.94 1.03 0.02 0.00 0.00 176.95 178.97 3k1u s ARG 304 N 0.08 2.79 0.47 4.98 0.52 -0.07 -4.92 118.95 122.80 3k1u s ARG 304 Ca -0.09 -0.01 0.15 0.00 -0.52 0.00 0.00 55.73 55.25 3k1u s ARG 304 Cb -0.15 -2.23 1.13 0.00 0.52 0.00 0.00 34.95 34.21 3k1u s ARG 304 CO 0.06 -0.82 2.07 1.49 0.02 0.00 0.00 175.30 178.11 3k1u h GLU 305 N -0.29 0.23 -0.00 3.54 4.57 -2.00 -0.43 114.58 120.19 3k1u h GLU 305 Ca -0.45 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.71 3k1u h GLU 305 Cb 1.27 -0.05 0.00 0.00 -0.16 0.00 0.00 28.75 29.81 3k1u h GLU 305 CO 0.61 0.15 0.00 -0.40 -1.18 0.00 0.00 179.01 178.19 3k1u n ASP 306 N -4.48 0.03 0.00 1.04 5.68 -1.26 -4.88 116.55 112.68 3k1u n ASP 306 Ca 0.03 -1.34 0.00 0.00 -0.50 0.00 0.00 54.79 52.98 3k1u n ASP 306 Cb 0.22 -0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.20 3k1u n ASP 306 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3k1u n GLY 307 N 0.84 0.77 3.88 6.12 0.00 -0.17 -5.06 105.19 111.57 3k1u n GLY 307 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 3k1u n GLY 307 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3k1u s THR 308 N -3.02 4.90 0.19 2.61 -4.23 -1.26 -4.77 115.64 110.06 3k1u s THR 308 Ca 0.00 0.39 -0.25 0.00 -1.18 0.00 0.00 61.69 60.64 3k1u s THR 308 Cb 0.00 -3.70 -0.08 0.00 1.34 0.00 0.00 72.50 70.06 3k1u s THR 308 CO 0.00 -0.32 0.80 -2.16 -0.54 0.00 0.00 174.62 172.41 3k1u s PRO 309 N -3.43 4.58 -0.36 3.99 0.04 -1.26 -0.89 135.00 137.66 3k1u s PRO 309 Ca 0.48 1.19 -0.02 0.00 0.04 0.00 0.00 61.00 62.68 3k1u s PRO 309 Cb -0.11 -3.20 0.08 0.00 0.04 0.00 0.00 34.50 31.32 3k1u s PRO 309 CO 0.27 0.53 0.11 0.34 0.04 0.00 0.00 177.00 178.30 3k1u s ASP 310 N -1.23 5.10 0.11 6.66 -1.08 0.11 -4.90 116.67 121.44 3k1u s ASP 310 Ca 0.38 -1.70 0.27 0.00 -0.52 0.00 0.00 52.55 50.98 3k1u s ASP 310 Cb -0.23 -1.78 0.98 0.00 -1.46 0.00 0.00 42.92 40.44 3k1u s ASP 310 CO 0.26 -0.42 1.82 0.49 0.52 0.00 0.00 175.17 177.85 3k1u n PHE 311 N 4.60 0.49 -4.50 -5.34 3.72 -1.26 -1.83 117.46 113.33 3k1u n PHE 311 Ca -0.06 0.14 0.00 0.00 -0.05 0.00 0.00 57.45 57.48 3k1u n PHE 311 Cb 0.42 -0.72 0.00 0.00 -0.94 0.00 0.00 39.48 38.24 3k1u n PHE 311 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3k1u n GLY 312 N 1.40 1.61 3.29 1.37 0.00 -1.26 -4.79 105.19 106.81 3k1u n GLY 312 Ca 0.06 -0.66 -0.18 0.00 0.00 0.00 0.00 46.02 45.24 3k1u n GLY 312 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3k1u s VAL 313 N 0.00 1.54 0.17 1.61 -7.23 -1.26 -4.78 120.40 110.45 3k1u s VAL 313 Ca 0.00 -1.96 -0.32 0.00 -1.81 0.00 0.00 61.98 57.89 3k1u s VAL 313 Cb 0.00 -1.80 -0.11 0.00 0.56 0.00 0.00 36.38 35.03 3k1u s VAL 313 CO 0.00 -0.50 1.66 -2.16 -0.31 0.00 0.00 175.10 173.80 3k1u s PRO 314 N -3.16 4.17 0.54 4.82 0.04 -1.26 -4.94 135.00 135.21 3k1u s PRO 314 Ca 0.16 2.48 -0.15 0.00 0.04 0.00 0.00 61.00 63.53 3k1u s PRO 314 Cb -0.03 -3.21 -0.07 0.00 0.04 0.00 0.00 34.50 31.23 3k1u s PRO 314 CO 0.05 -0.70 0.99 -1.21 0.04 0.00 0.00 177.00 176.16 3k1u s GLU 315 N 1.46 3.85 0.57 4.56 2.02 -1.26 -4.78 118.70 125.12 3k1u s GLU 315 Ca 0.73 0.87 -0.20 0.00 0.02 0.00 0.00 54.97 56.39 3k1u s GLU 315 Cb -0.46 -2.13 -0.04 0.00 0.10 0.00 0.00 34.13 31.60 3k1u s GLU 315 CO 0.32 -0.34 1.29 0.08 0.02 0.00 0.00 175.26 176.63 3k1u s VAL 316 N -2.76 2.29 0.27 2.63 1.01 -1.26 -4.91 120.40 117.67 3k1u s VAL 316 Ca 0.57 0.21 -0.30 0.00 0.00 0.00 0.00 61.98 62.46 3k1u s VAL 316 Cb -0.10 -3.10 -0.13 0.00 0.00 0.00 0.00 36.38 33.05 3k1u s VAL 316 CO 0.37 -0.02 1.28 0.47 0.00 0.00 0.00 175.10 177.21 3k1u n ASP 317 N -1.26 2.39 -0.70 3.32 8.00 -1.26 -4.79 116.55 122.24 3k1u n ASP 317 Ca 0.12 1.17 0.13 0.00 0.71 0.00 0.00 54.79 56.91 3k1u n ASP 317 Cb 0.47 -1.40 0.35 0.00 -0.02 0.00 0.00 41.12 40.51 3k1u n ASP 317 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 3k1u n SER 318 N 1.55 2.15 0.00 -2.24 7.64 -0.11 -4.99 113.62 117.63 3k1u n SER 318 Ca 0.09 -1.73 0.00 0.00 1.01 0.00 0.00 58.87 58.25 3k1u n SER 318 Cb 0.32 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.48 3k1u n SER 318 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03