#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1k28 s GLN 5 N 0.00 3.51 0.29 3.23 0.00 -1.26 -5.04 119.66 120.39 1k28 s GLN 5 Ca 0.00 -0.31 -0.26 0.00 -0.00 0.00 0.00 55.36 54.79 1k28 s GLN 5 Cb 0.00 -2.71 -0.16 0.00 0.00 0.00 0.00 33.01 30.15 1k28 s GLN 5 CO 0.00 0.23 0.54 2.89 0.00 0.00 0.00 175.29 178.94 1k28 n ARG 6 N -1.41 0.33 -2.07 9.60 1.85 -1.26 -4.77 116.66 118.93 1k28 n ARG 6 Ca -0.05 0.12 -0.36 0.00 -1.00 0.00 0.00 57.85 56.56 1k28 n ARG 6 Cb 0.55 -1.23 0.02 0.00 -1.05 0.00 0.00 32.46 30.76 1k28 n ARG 6 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 1k28 s PRO 7 N -1.19 3.16 0.00 2.89 0.04 -1.26 -2.46 135.00 136.18 1k28 s PRO 7 Ca 0.62 1.82 0.00 0.00 0.04 0.00 0.00 61.00 63.48 1k28 s PRO 7 Cb -0.79 -2.03 0.00 0.00 0.04 0.00 0.00 34.50 31.72 1k28 s PRO 7 CO 0.58 -1.05 0.00 0.41 0.04 0.00 0.00 177.00 176.98 1k28 n GLY 8 N 0.46 0.53 3.51 0.56 0.00 -1.26 -4.89 105.19 104.10 1k28 n GLY 8 Ca 0.12 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.71 1k28 n GLY 8 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1k28 s TYR 9 N -2.18 2.98 0.71 1.61 6.14 -1.03 0.11 117.35 125.69 1k28 s TYR 9 Ca 0.00 -0.10 -0.11 0.00 0.64 0.00 0.00 57.07 57.50 1k28 s TYR 9 Cb 0.00 -3.64 0.02 0.00 0.42 0.00 0.00 41.96 38.76 1k28 s TYR 9 CO 0.00 -1.05 1.10 -1.25 0.64 0.00 0.00 175.55 174.99 1k28 s PRO 10 N 3.16 2.81 -0.69 4.97 0.04 -1.26 -0.81 135.00 143.21 1k28 s PRO 10 Ca 0.25 0.48 0.03 0.00 0.04 0.00 0.00 61.00 61.79 1k28 s PRO 10 Cb -0.14 -2.01 0.35 0.00 0.04 0.00 0.00 34.50 32.73 1k28 s PRO 10 CO 0.18 -1.07 1.30 0.09 0.04 0.00 0.00 177.00 177.55 1k28 n ASN 11 N -3.04 5.55 -4.59 6.66 3.02 0.12 -4.88 115.26 118.10 1k28 n ASN 11 Ca 0.07 -3.71 -0.46 0.00 -0.03 0.00 0.00 54.58 50.44 1k28 n ASN 11 Cb 0.57 -0.74 -0.03 0.00 -0.61 0.00 0.00 39.78 38.97 1k28 n ASN 11 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1k28 n LEU 12 N -0.27 1.79 -3.16 3.41 7.94 -1.26 -4.16 117.00 121.29 1k28 n LEU 12 Ca 0.39 1.16 -0.17 0.00 -1.11 0.00 0.00 56.01 56.28 1k28 n LEU 12 Cb 0.39 -1.27 -0.06 0.00 0.53 0.00 0.00 43.42 43.02 1k28 n LEU 12 CO 0.40 -1.27 -0.13 -0.55 -1.11 0.00 0.00 177.39 174.73 1k28 s SER 13 N -0.22 0.32 -0.43 1.96 0.15 -0.16 -4.89 113.70 110.42 1k28 s SER 13 Ca 0.66 -2.31 -0.20 0.00 0.70 0.00 0.00 55.95 54.80 1k28 s SER 13 Cb -0.76 0.60 0.02 0.00 -1.71 0.00 0.00 66.02 64.16 1k28 s SER 13 CO 0.55 -0.14 0.61 -0.69 1.20 0.00 0.00 173.24 174.77 1k28 s VAL 14 N 0.61 4.87 -0.08 4.45 1.01 -1.26 -2.63 120.40 127.37 1k28 s VAL 14 Ca 0.29 0.06 0.00 0.00 0.00 0.00 0.00 61.98 62.33 1k28 s VAL 14 Cb -0.01 -4.17 0.02 0.00 0.00 0.00 0.00 36.38 32.22 1k28 s VAL 14 CO -0.11 -0.56 -0.06 -1.59 0.00 0.00 0.00 175.10 172.78 1k28 s LYS 15 N 2.71 1.15 -0.05 2.72 -2.85 -1.14 0.09 119.74 122.36 1k28 s LYS 15 Ca 0.21 -0.16 -0.02 0.00 -1.00 0.00 0.00 55.97 55.00 1k28 s LYS 15 Cb -0.15 -1.20 -0.04 0.00 -2.06 0.00 0.00 37.83 34.38 1k28 s LYS 15 CO 0.18 -0.17 0.08 -0.48 0.10 0.00 0.00 175.35 175.06 1k28 s LEU 16 N 1.36 3.96 -0.06 2.77 2.34 -1.04 -1.13 118.68 126.89 1k28 s LEU 16 Ca -0.03 0.23 0.02 0.00 0.06 0.00 0.00 54.13 54.42 1k28 s LEU 16 Cb -0.14 -2.14 -0.03 0.00 -0.56 0.00 0.00 46.19 43.33 1k28 s LEU 16 CO -0.03 0.33 -0.11 -0.36 -1.06 0.00 0.00 176.35 175.11 1k28 s PHE 17 N -1.09 2.79 0.49 3.48 0.08 0.15 -2.79 117.98 121.09 1k28 s PHE 17 Ca 0.19 -0.09 0.15 0.00 0.12 0.00 0.00 56.93 57.30 1k28 s PHE 17 Cb -0.12 -1.66 1.16 0.00 -0.57 0.00 0.00 43.02 41.83 1k28 s PHE 17 CO 0.09 0.24 2.09 -0.44 -0.10 0.00 0.00 175.22 177.11 1k28 h ASP 18 N 5.31 0.15 -1.27 1.36 3.45 -1.87 -1.01 116.42 122.53 1k28 h ASP 18 Ca -0.47 -0.00 -0.00 0.00 0.43 0.00 0.00 57.03 56.98 1k28 h ASP 18 Cb 1.16 -0.04 -0.00 0.00 -0.56 0.00 0.00 39.33 39.89 1k28 h ASP 18 CO 0.51 0.11 0.00 -1.54 -1.57 0.00 0.00 179.24 176.75 1k28 n SER 19 N -4.50 -0.01 -0.03 6.45 3.41 -1.26 -4.15 113.62 113.53 1k28 n SER 19 Ca 0.01 -1.01 -0.13 0.00 -0.26 0.00 0.00 58.87 57.48 1k28 n SER 19 Cb 0.16 0.01 -0.11 0.00 -0.26 0.00 0.00 64.21 64.02 1k28 n SER 19 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1k28 h TYR 20 N 1.00 0.02 -0.65 7.33 3.20 -1.90 -2.85 116.97 123.12 1k28 h TYR 20 Ca -0.00 -0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.84 1k28 h TYR 20 Cb 0.01 -0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.24 1k28 h TYR 20 CO 0.00 0.66 0.33 0.38 -1.64 0.00 0.00 178.16 177.90 1k28 h ASP 21 N -0.62 0.84 0.00 -2.11 2.03 -1.97 0.40 116.42 114.98 1k28 h ASP 21 Ca -0.00 -0.12 0.00 0.00 -0.73 0.00 0.00 57.03 56.18 1k28 h ASP 21 Cb 0.66 -0.21 0.00 0.00 -0.83 0.00 0.00 39.33 38.95 1k28 h ASP 21 CO 0.00 0.72 0.20 0.00 -1.03 0.00 0.00 179.24 179.12 1k28 h ALA 22 N 1.16 1.15 0.05 4.15 0.00 -1.87 0.70 119.26 124.59 1k28 h ALA 22 Ca 0.23 0.00 -0.37 0.00 0.00 0.00 0.00 54.91 54.77 1k28 h ALA 22 Cb 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1k28 h ALA 22 CO -0.03 -0.15 -2.13 1.87 0.00 0.00 0.00 179.25 178.81 1k28 n TRP 23 N -2.33 0.64 -0.32 0.00 -0.00 0.72 -0.20 117.44 115.97 1k28 n TRP 23 Ca -0.01 0.17 0.04 0.00 -0.00 0.00 0.00 57.50 57.69 1k28 n TRP 23 Cb 0.23 -1.08 0.19 0.00 -0.00 0.00 0.00 31.31 30.65 1k28 n TRP 23 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 1k28 h SER 24 N -0.25 0.76 -0.56 5.87 0.87 0.41 0.20 113.55 120.85 1k28 h SER 24 Ca -0.50 0.05 -0.13 0.00 -1.23 0.00 0.00 61.79 59.97 1k28 h SER 24 Cb 1.83 -0.10 -0.08 0.00 -0.44 0.00 0.00 62.40 63.61 1k28 h SER 24 CO -0.08 0.43 0.17 0.59 -0.53 0.00 0.00 176.83 177.41 1k28 n ASN 25 N -4.70 4.36 -1.79 6.23 3.02 0.11 -4.92 115.26 117.57 1k28 n ASN 25 Ca 0.15 -2.91 -0.05 0.00 -0.03 0.00 0.00 54.58 51.74 1k28 n ASN 25 Cb 0.29 -0.69 -0.01 0.00 -0.61 0.00 0.00 39.78 38.76 1k28 n ASN 25 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1k28 n ASN 26 N 0.07 -1.71 -4.52 6.41 5.15 0.68 -4.87 115.26 116.47 1k28 n ASN 26 Ca 0.30 0.25 -0.42 0.00 -0.60 0.00 0.00 54.58 54.11 1k28 n ASN 26 Cb 1.14 -1.71 -0.03 0.00 -0.53 0.00 0.00 39.78 38.64 1k28 n ASN 26 CO 0.00 0.00 0.00 -0.60 1.40 0.00 0.00 177.26 178.06 1k28 s ARG 27 N -3.68 3.26 0.00 1.20 3.52 0.72 -4.95 118.95 119.02 1k28 s ARG 27 Ca 0.00 -0.64 0.00 0.00 -0.13 0.00 0.00 55.73 54.96 1k28 s ARG 27 Cb 0.00 -4.43 0.00 0.00 -1.56 0.00 0.00 34.95 28.96 1k28 s ARG 27 CO 0.00 -2.05 0.00 1.97 -0.81 0.00 0.00 175.30 174.41 1k28 n PHE 28 N 8.68 0.00 -3.93 5.12 1.16 -1.26 -4.51 117.46 122.72 1k28 n PHE 28 Ca 0.08 0.00 -0.10 0.00 -1.87 0.00 0.00 57.45 55.55 1k28 n PHE 28 Cb 0.48 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 38.24 1k28 n PHE 28 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1k28 s VAL 29 N -0.99 0.08 -0.05 1.97 1.01 -1.12 -5.01 120.40 116.28 1k28 s VAL 29 Ca 0.00 -0.64 -0.03 0.00 0.00 0.00 0.00 61.98 61.31 1k28 s VAL 29 Cb 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 36.38 36.12 1k28 s VAL 29 CO 0.00 -0.35 0.09 -0.70 0.00 0.00 0.00 175.10 174.14 1k28 s GLU 30 N -1.06 3.18 0.00 2.72 2.56 -1.26 -2.48 118.70 122.36 1k28 s GLU 30 Ca -0.12 -0.36 0.00 0.00 0.00 0.00 0.00 54.97 54.50 1k28 s GLU 30 Cb -0.07 -2.95 0.00 0.00 2.00 0.00 0.00 34.13 33.11 1k28 s GLU 30 CO -0.00 0.70 0.20 1.28 -0.56 0.00 0.00 175.26 176.88 1k28 n LEU 31 N 1.60 0.40 -0.18 2.70 7.99 0.11 -4.80 117.00 124.83 1k28 n LEU 31 Ca -0.16 -0.51 0.18 0.00 -0.01 0.00 0.00 56.01 55.51 1k28 n LEU 31 Cb 0.53 0.00 0.54 0.00 -0.11 0.00 0.00 43.42 44.39 1k28 n LEU 31 CO 0.34 0.10 1.22 0.00 -1.51 0.00 0.00 177.39 177.54 1k28 h ALA 32 N 0.00 2.24 0.05 -1.18 0.00 -1.90 -2.32 119.26 116.15 1k28 h ALA 32 Ca 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 1k28 h ALA 32 Cb 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1k28 h ALA 32 CO 0.00 -0.47 -1.06 0.00 0.00 0.00 0.00 179.25 177.72 1k28 h ALA 33 N 1.63 0.30 -0.62 0.00 0.00 -1.93 -3.32 119.26 115.32 1k28 h ALA 33 Ca 0.40 -0.84 -0.26 0.00 0.00 0.00 0.00 54.91 54.21 1k28 h ALA 33 Cb 1.04 -0.06 -0.15 0.00 0.00 0.00 0.00 17.79 18.61 1k28 h ALA 33 CO -0.12 1.02 0.23 0.25 0.00 0.00 0.00 179.25 180.63 1k28 n THR 34 N -3.53 2.81 -3.40 0.00 -2.24 -0.92 -4.98 114.28 102.02 1k28 n THR 34 Ca -0.05 -2.09 -0.37 0.00 -2.27 0.00 0.00 64.05 59.27 1k28 n THR 34 Cb 0.93 -0.36 -0.06 0.00 -2.10 0.00 0.00 70.33 68.73 1k28 n THR 34 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1k28 s ILE 35 N -3.13 5.24 0.00 2.28 2.07 -0.94 -1.30 121.20 125.41 1k28 s ILE 35 Ca 0.51 0.79 0.00 0.00 -1.41 0.00 0.00 60.65 60.53 1k28 s ILE 35 Cb 0.43 -3.74 0.00 0.00 0.13 0.00 0.00 42.46 39.28 1k28 s ILE 35 CO 0.08 0.35 0.34 0.41 -1.91 0.00 0.00 174.94 174.21 1k28 n THR 36 N 3.65 0.00 -4.08 4.00 -1.04 0.25 -4.26 114.28 112.80 1k28 n THR 36 Ca -0.09 0.66 -0.09 0.00 -2.04 0.00 0.00 64.05 62.50 1k28 n THR 36 Cb 0.52 -1.31 -0.10 0.00 -1.82 0.00 0.00 70.33 67.61 1k28 n THR 36 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1k28 s THR 37 N -0.89 0.32 -0.10 12.58 -4.23 -1.26 -4.25 115.64 117.83 1k28 s THR 37 Ca 0.00 -1.58 -0.02 0.00 -1.18 0.00 0.00 61.69 58.91 1k28 s THR 37 Cb 0.00 -1.20 0.04 0.00 1.34 0.00 0.00 72.50 72.67 1k28 s THR 37 CO 0.00 -0.81 0.02 -0.22 -0.54 0.00 0.00 174.62 173.07 1k28 s LEU 38 N -2.51 0.64 0.00 4.79 2.96 0.27 -3.23 118.68 121.60 1k28 s LEU 38 Ca 0.02 -0.26 0.01 0.00 -0.22 0.00 0.00 54.13 53.68 1k28 s LEU 38 Cb 0.02 -0.42 0.01 0.00 0.50 0.00 0.00 46.19 46.30 1k28 s LEU 38 CO -0.06 -0.23 0.11 0.41 -1.32 0.00 0.00 176.35 175.25 1k28 n THR 39 N 5.15 0.00 -3.41 3.68 -1.04 -1.26 -1.94 114.28 115.47 1k28 n THR 39 Ca -0.07 -0.50 0.02 0.00 -2.04 0.00 0.00 64.05 61.46 1k28 n THR 39 Cb 0.49 -0.46 -0.05 0.00 -1.82 0.00 0.00 70.33 68.50 1k28 n THR 39 CO 0.00 0.00 0.00 -0.13 -0.64 0.00 0.00 175.07 174.30 1k28 s ARG 41 N -2.54 0.11 -0.27 -2.82 0.52 -0.75 -4.36 118.95 108.84 1k28 s ARG 41 Ca 0.08 0.23 0.01 0.00 -0.52 0.00 0.00 55.73 55.54 1k28 s ARG 41 Cb -0.01 0.10 0.08 0.00 0.52 0.00 0.00 34.95 35.64 1k28 s ARG 41 CO 0.05 -0.03 0.00 -0.51 0.02 0.00 0.00 175.30 174.83 1k28 s ASP 42 N 1.72 4.06 0.31 0.23 1.01 -0.87 -1.99 116.67 121.15 1k28 s ASP 42 Ca -0.04 -1.47 -0.10 0.00 0.71 0.00 0.00 52.55 51.66 1k28 s ASP 42 Cb -0.02 -1.20 -0.07 0.00 1.01 0.00 0.00 42.92 42.64 1k28 s ASP 42 CO -0.14 -0.30 0.65 -0.55 0.21 0.00 0.00 175.17 175.04 1k28 s SER 43 N 1.34 6.59 0.00 0.27 0.15 0.33 -2.85 113.70 119.53 1k28 s SER 43 Ca 0.01 1.01 0.29 0.00 0.70 0.00 0.00 55.95 57.96 1k28 s SER 43 Cb -0.19 -2.27 1.25 0.00 -1.71 0.00 0.00 66.02 63.11 1k28 s SER 43 CO -0.10 -0.22 1.89 -0.11 1.20 0.00 0.00 173.24 175.89 1k28 n LEU 44 N -0.68 0.27 -1.15 3.45 0.00 0.71 -3.20 117.00 116.39 1k28 n LEU 44 Ca 0.01 0.16 0.08 0.00 0.00 0.00 0.00 56.01 56.26 1k28 n LEU 44 Cb 0.53 -0.27 0.28 0.00 0.00 0.00 0.00 43.42 43.96 1k28 n LEU 44 CO 0.46 0.05 0.74 -1.22 0.00 0.00 0.00 177.39 177.42 1k28 n TYR 45 N -1.18 1.05 0.00 1.96 0.53 -1.26 -4.55 117.16 113.71 1k28 n TYR 45 Ca 0.12 -0.63 0.00 0.00 -1.02 0.00 0.00 57.90 56.37 1k28 n TYR 45 Cb 0.28 -0.19 0.00 0.00 -1.03 0.00 0.00 39.34 38.41 1k28 n TYR 45 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 1k28 n GLY 46 N 0.62 1.38 3.65 2.72 0.00 -1.20 -5.03 105.19 107.33 1k28 n GLY 46 Ca 0.21 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.80 1k28 n GLY 46 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1k28 s ARG 47 N -0.82 4.15 -0.35 1.61 3.52 -1.26 -4.87 118.95 120.93 1k28 s ARG 47 Ca 0.00 1.64 -0.01 0.00 -0.13 0.00 0.00 55.73 57.23 1k28 s ARG 47 Cb 0.00 -3.82 0.13 0.00 -1.56 0.00 0.00 34.95 29.70 1k28 s ARG 47 CO 0.00 -0.83 0.19 -0.80 -0.81 0.00 0.00 175.30 173.05 1k28 s ASN 48 N 2.38 3.25 0.24 -2.12 0.02 -1.26 0.12 114.94 117.58 1k28 s ASN 48 Ca 0.58 -2.03 0.02 0.00 -1.02 0.00 0.00 52.86 50.41 1k28 s ASN 48 Cb -0.22 -0.51 -0.01 0.00 0.02 0.00 0.00 41.25 40.53 1k28 s ASN 48 CO 0.18 -0.34 0.08 -1.84 0.02 0.00 0.00 177.10 175.21 1k28 n GLU 49 N 4.27 0.77 0.00 -0.60 0.28 -0.84 -4.20 120.64 120.31 1k28 n GLU 49 Ca 0.07 -2.02 0.00 0.00 -0.16 0.00 0.00 57.16 55.05 1k28 n GLU 49 Cb 0.38 1.06 0.00 0.00 1.43 0.00 0.00 31.44 34.31 1k28 n GLU 49 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1k28 n GLY 50 N 0.58 1.02 0.00 -1.84 0.00 -0.44 -1.80 105.19 102.70 1k28 n GLY 50 Ca -0.04 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.66 1k28 n GLY 50 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1k28 n LEU 52 N 0.00 0.00 -3.99 0.99 0.00 -0.64 0.17 117.00 113.53 1k28 n LEU 52 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 56.01 55.86 1k28 n LEU 52 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 43.42 43.29 1k28 n LEU 52 CO 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 177.39 176.99 1k28 s GLN 53 N 0.00 0.45 0.14 1.96 -2.07 -1.20 0.18 119.66 119.12 1k28 s GLN 53 Ca 0.00 -0.36 -0.13 0.00 -1.82 0.00 0.00 55.36 53.05 1k28 s GLN 53 Cb 0.00 -0.37 0.02 0.00 -1.09 0.00 0.00 33.01 31.57 1k28 s GLN 53 CO 0.00 0.09 0.35 -0.59 -1.32 0.00 0.00 175.29 173.82 1k28 s PHE 54 N -0.51 0.02 -0.04 9.60 -0.12 0.24 -0.58 117.98 126.59 1k28 s PHE 54 Ca -0.02 -0.38 0.02 0.00 -0.05 0.00 0.00 56.93 56.51 1k28 s PHE 54 Cb -0.04 0.14 -0.03 0.00 -0.63 0.00 0.00 43.02 42.46 1k28 s PHE 54 CO -0.00 -0.71 -0.08 -0.47 -0.05 0.00 0.00 175.22 173.91 1k28 s TYR 55 N -3.86 2.87 -0.27 3.49 6.14 -0.42 -1.90 117.35 123.40 1k28 s TYR 55 Ca 0.07 -0.04 -0.22 0.00 0.64 0.00 0.00 57.07 57.53 1k28 s TYR 55 Cb 0.02 -1.65 0.08 0.00 0.42 0.00 0.00 41.96 40.83 1k28 s TYR 55 CO -0.08 0.32 0.73 0.16 0.64 0.00 0.00 175.55 177.33 1k28 s ASP 56 N -1.03 -0.80 0.16 4.32 -4.77 -1.21 -4.75 116.67 108.59 1k28 s ASP 56 Ca 0.14 1.43 0.15 0.00 -3.30 0.00 0.00 52.55 50.97 1k28 s ASP 56 Cb -0.11 1.41 -0.05 0.00 -1.09 0.00 0.00 42.92 43.08 1k28 s ASP 56 CO 0.04 -0.24 1.13 0.77 0.70 0.00 0.00 175.17 177.57 1k28 h SER 57 N 5.67 0.00 -0.42 2.11 4.64 -1.93 -3.29 113.55 120.33 1k28 h SER 57 Ca -0.29 0.00 0.12 0.00 -0.47 0.00 0.00 61.79 61.15 1k28 h SER 57 Cb 1.19 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 63.26 1k28 h SER 57 CO 0.09 0.56 0.78 0.50 -0.87 0.00 0.00 176.83 177.90 1k28 h LYS 58 N 0.00 0.00 -5.62 4.77 3.11 -1.97 -3.45 116.57 113.41 1k28 h LYS 58 Ca -0.08 0.00 -0.22 0.00 -2.81 0.00 0.00 60.65 57.53 1k28 h LYS 58 Cb 1.50 0.00 0.12 0.00 -1.00 0.00 0.00 32.23 32.85 1k28 h LYS 58 CO 0.06 0.00 -0.65 -1.71 -2.81 0.00 0.00 179.45 174.34 1k28 n ASN 59 N -3.13 -6.67 0.16 4.20 2.85 -1.24 -4.93 115.26 106.51 1k28 n ASN 59 Ca 0.09 -0.60 0.12 0.00 -0.11 0.00 0.00 54.58 54.07 1k28 n ASN 59 Cb 0.93 -4.77 0.08 0.00 1.24 0.00 0.00 39.78 37.27 1k28 n ASN 59 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1k28 h ILE 60 N -0.76 0.00 0.00 -1.44 2.04 -1.86 -3.35 117.51 112.14 1k28 h ILE 60 Ca -0.45 -1.00 -0.00 0.00 1.00 0.00 0.00 64.86 64.40 1k28 h ILE 60 Cb 1.24 1.74 -0.00 0.00 -0.74 0.00 0.00 36.82 39.06 1k28 h ILE 60 CO 0.41 0.00 -0.02 1.12 0.00 0.00 0.00 178.15 179.65 1k28 h HIS 61 N 0.00 0.00 -0.02 1.37 2.07 -1.96 0.16 115.15 116.77 1k28 h HIS 61 Ca 0.00 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.52 1k28 h HIS 61 Cb 1.00 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.98 1k28 h HIS 61 CO 0.00 0.02 0.00 -2.37 -3.07 0.00 0.00 177.93 172.51 1k28 n THR 62 N -3.25 0.01 -1.80 6.12 5.66 -1.26 -4.81 114.28 114.96 1k28 n THR 62 Ca -0.02 -0.30 -0.21 0.00 -3.05 0.00 0.00 64.05 60.47 1k28 n THR 62 Cb 0.16 0.66 0.07 0.00 -1.55 0.00 0.00 70.33 69.67 1k28 n THR 62 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1k28 n LYS 63 N 0.38 3.08 0.00 1.09 5.02 0.56 -5.21 118.16 123.08 1k28 n LYS 63 Ca 0.18 -3.83 0.00 0.00 -2.02 0.00 0.00 58.31 52.64 1k28 n LYS 63 Cb 0.40 -2.17 0.00 0.00 -0.02 0.00 0.00 35.03 33.23 1k28 n LYS 63 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1k28 n ASP 65 N -0.83 0.00 0.00 4.39 3.85 -1.26 -5.10 116.55 117.60 1k28 n ASP 65 Ca 0.44 0.00 0.00 0.00 -0.71 0.00 0.00 54.79 54.52 1k28 n ASP 65 Cb 0.90 0.00 0.00 0.00 -1.35 0.00 0.00 41.12 40.67 1k28 n ASP 65 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1k28 n GLY 66 N 0.00 2.80 0.14 6.12 0.00 -1.26 -4.87 105.19 108.11 1k28 n GLY 66 Ca 0.00 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.15 1k28 n GLY 66 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1k28 h ASN 67 N 0.00 0.00 -3.89 1.61 -0.26 -1.89 -3.32 115.58 107.83 1k28 h ASN 67 Ca 0.00 0.00 -0.52 0.00 -0.56 0.00 0.00 56.30 55.22 1k28 h ASN 67 Cb 0.00 0.00 0.21 0.00 -1.06 0.00 0.00 38.32 37.47 1k28 h ASN 67 CO 0.00 0.00 -0.07 -1.84 -1.06 0.00 0.00 177.43 174.46 1k28 n GLU 68 N -2.36 -0.57 -5.00 0.81 0.00 -1.26 -4.73 120.64 107.53 1k28 n GLU 68 Ca 0.04 -0.11 -0.32 0.00 0.00 0.00 0.00 57.16 56.76 1k28 n GLU 68 Cb 0.34 -2.19 -0.15 0.00 0.00 0.00 0.00 31.44 29.43 1k28 n GLU 68 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 1k28 s ILE 69 N -2.54 2.58 -0.47 3.84 1.01 -0.38 -3.96 121.20 121.28 1k28 s ILE 69 Ca 0.64 -0.84 -0.12 0.00 0.00 0.00 0.00 60.65 60.32 1k28 s ILE 69 Cb -0.22 -2.03 0.09 0.00 0.01 0.00 0.00 42.46 40.31 1k28 s ILE 69 CO 0.62 0.55 0.36 -0.63 0.00 0.00 0.00 174.94 175.83 1k28 s ILE 70 N 0.24 4.73 -0.55 2.92 -1.09 0.50 -0.68 121.20 127.27 1k28 s ILE 70 Ca -0.12 -1.37 -0.19 0.00 -2.23 0.00 0.00 60.65 56.74 1k28 s ILE 70 Cb -0.16 -3.93 0.09 0.00 -1.58 0.00 0.00 42.46 36.87 1k28 s ILE 70 CO 0.07 -0.64 0.66 -1.58 -1.23 0.00 0.00 174.94 172.21 1k28 s GLN 71 N 1.52 3.07 -0.14 2.79 0.74 -0.28 -1.02 119.66 126.33 1k28 s GLN 71 Ca 0.04 -1.18 -0.15 0.00 0.05 0.00 0.00 55.36 54.12 1k28 s GLN 71 Cb -0.25 -4.20 -0.05 0.00 1.10 0.00 0.00 33.01 29.61 1k28 s GLN 71 CO 0.03 -1.40 0.35 0.42 -0.55 0.00 0.00 175.29 174.14 1k28 s ILE 72 N 2.59 5.26 -0.02 -2.34 1.01 -0.71 -2.89 121.20 124.11 1k28 s ILE 72 Ca 0.12 0.67 0.01 0.00 0.00 0.00 0.00 60.65 61.45 1k28 s ILE 72 Cb -0.23 -3.68 0.01 0.00 0.01 0.00 0.00 42.46 38.58 1k28 s ILE 72 CO 0.08 0.39 -0.02 -0.55 0.00 0.00 0.00 174.94 174.85 1k28 s SER 73 N 0.37 0.43 -0.30 3.58 0.15 -1.08 -0.55 113.70 116.30 1k28 s SER 73 Ca 0.19 -0.05 -0.15 0.00 0.70 0.00 0.00 55.95 56.65 1k28 s SER 73 Cb -0.14 -0.16 0.15 0.00 -1.71 0.00 0.00 66.02 64.17 1k28 s SER 73 CO 0.06 -0.04 0.94 0.54 1.20 0.00 0.00 173.24 175.94 1k28 s VAL 74 N 0.56 -0.42 0.47 4.45 0.11 0.32 -0.99 120.40 124.89 1k28 s VAL 74 Ca -0.06 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.01 1k28 s VAL 74 Cb -0.09 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.77 1k28 s VAL 74 CO -0.01 0.00 0.68 0.00 -3.33 0.00 0.00 175.10 172.44 1k28 s ALA 75 N 2.22 3.89 0.04 1.54 0.00 -1.26 -3.27 121.76 124.91 1k28 s ALA 75 Ca -0.05 -1.22 0.00 0.00 0.00 0.00 0.00 51.96 50.69 1k28 s ALA 75 Cb -0.06 -2.05 -0.04 0.00 0.00 0.00 0.00 23.12 20.97 1k28 s ALA 75 CO -0.17 -0.47 0.14 0.54 0.00 0.00 0.00 175.76 175.80 1k28 s ASN 76 N -4.29 5.98 0.00 0.00 2.20 -1.23 -0.70 114.94 116.90 1k28 s ASN 76 Ca 0.51 0.18 0.00 0.00 -0.94 0.00 0.00 52.86 52.62 1k28 s ASN 76 Cb -0.10 -1.77 0.00 0.00 -2.00 0.00 0.00 41.25 37.38 1k28 s ASN 76 CO 0.37 0.21 0.00 0.00 -2.94 0.00 0.00 177.10 174.75 1k28 n ALA 77 N 0.68 0.00 0.17 3.54 0.00 0.01 -2.16 120.51 122.75 1k28 n ALA 77 Ca -0.09 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.21 1k28 n ALA 77 Cb 0.52 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.89 1k28 n ALA 77 CO 0.00 0.00 0.00 -2.95 0.00 0.00 0.00 177.50 174.55 1k28 h ASN 78 N 0.00 -0.34 -2.07 0.00 7.08 -1.87 -3.39 115.58 114.98 1k28 h ASN 78 Ca 0.00 -0.09 -0.66 0.00 -3.08 0.00 0.00 56.30 52.47 1k28 h ASN 78 Cb 0.00 0.09 -0.15 0.00 -2.08 0.00 0.00 38.32 36.18 1k28 h ASN 78 CO 0.00 -0.12 1.00 -0.62 -2.08 0.00 0.00 177.43 175.61 1k28 s ASP 79 N -4.96 6.56 0.01 6.14 -1.08 -0.92 -4.74 116.67 117.68 1k28 s ASP 79 Ca -0.15 -1.80 0.22 0.00 -0.52 0.00 0.00 52.55 50.30 1k28 s ASP 79 Cb 0.04 -2.45 -0.27 0.00 -1.46 0.00 0.00 42.92 38.78 1k28 s ASP 79 CO 0.61 -1.22 0.61 2.30 0.52 0.00 0.00 175.17 177.99 1k28 n ILE 80 N 5.90 0.09 0.29 4.11 -0.00 -1.26 -3.49 119.36 125.01 1k28 n ILE 80 Ca 0.24 -0.46 0.18 0.00 -0.00 0.00 0.00 62.75 62.71 1k28 n ILE 80 Cb 0.49 0.04 0.84 0.00 -0.00 0.00 0.00 39.64 41.01 1k28 n ILE 80 CO 0.00 0.00 0.00 -1.13 -0.00 0.00 0.00 176.55 175.42 1k28 h ASN 81 N 0.00 0.00 -3.54 7.28 -1.24 -1.94 -3.35 115.58 112.79 1k28 h ASN 81 Ca 0.00 0.00 -0.69 0.00 0.71 0.00 0.00 56.30 56.32 1k28 h ASN 81 Cb 0.95 0.00 -0.35 0.00 0.73 0.00 0.00 38.32 39.65 1k28 h ASN 81 CO 0.00 0.04 -0.55 0.21 -1.29 0.00 0.00 177.43 175.84 1k28 s ASN 82 N -5.65 5.22 0.49 1.15 2.47 -1.26 -5.09 114.94 112.26 1k28 s ASN 82 Ca -0.01 -2.09 0.09 0.00 0.42 0.00 0.00 52.86 51.26 1k28 s ASN 82 Cb 0.11 -1.82 0.04 0.00 -1.45 0.00 0.00 41.25 38.14 1k28 s ASN 82 CO 0.52 -0.52 0.64 0.68 -3.72 0.00 0.00 177.10 174.70 1k28 s VAL 83 N 1.05 2.55 -0.08 -5.21 -7.23 -1.26 -4.51 120.40 105.71 1k28 s VAL 83 Ca 0.09 -1.05 0.02 0.00 -1.81 0.00 0.00 61.98 59.23 1k28 s VAL 83 Cb -0.22 -2.60 0.02 0.00 0.56 0.00 0.00 36.38 34.13 1k28 s VAL 83 CO -0.04 0.00 -0.11 -0.54 -0.31 0.00 0.00 175.10 174.09 1k28 s LYS 84 N -4.46 1.66 0.00 4.82 -0.14 -1.20 -4.90 119.74 115.50 1k28 s LYS 84 Ca 0.56 -0.38 0.07 0.00 -1.36 0.00 0.00 55.97 54.86 1k28 s LYS 84 Cb -0.07 -1.44 -0.02 0.00 -1.68 0.00 0.00 37.83 34.62 1k28 s LYS 84 CO 0.35 -0.04 -0.21 0.99 -0.76 0.00 0.00 175.35 175.68 1k28 s THR 85 N 0.90 1.63 -0.00 2.17 2.01 -1.26 -0.52 115.64 120.56 1k28 s THR 85 Ca -0.10 -0.96 -0.08 0.00 0.31 0.00 0.00 61.69 60.85 1k28 s THR 85 Cb -0.15 -1.37 0.00 0.00 0.01 0.00 0.00 72.50 70.99 1k28 s THR 85 CO 0.01 0.39 0.16 0.00 -0.69 0.00 0.00 174.62 174.49 1k28 s ARG 86 N -0.67 0.48 -0.09 4.92 1.70 0.28 -4.99 118.95 120.58 1k28 s ARG 86 Ca 0.08 -0.33 -0.05 0.00 -0.47 0.00 0.00 55.73 54.96 1k28 s ARG 86 Cb -0.08 0.20 -0.04 0.00 -0.57 0.00 0.00 34.95 34.46 1k28 s ARG 86 CO -0.00 -0.11 0.13 0.42 -1.08 0.00 0.00 175.30 174.65 1k28 s ILE 87 N -1.26 5.29 0.10 4.99 1.09 -1.26 -1.74 121.20 128.41 1k28 s ILE 87 Ca -0.13 0.05 0.03 0.00 -1.10 0.00 0.00 60.65 59.49 1k28 s ILE 87 Cb -0.07 -3.33 -0.04 0.00 -1.06 0.00 0.00 42.46 37.96 1k28 s ILE 87 CO 0.02 0.55 -0.08 -0.31 -0.10 0.00 0.00 174.94 175.02 1k28 s TYR 88 N -1.07 0.95 0.25 3.97 2.02 -0.19 -4.61 117.35 118.67 1k28 s TYR 88 Ca 0.17 -0.77 0.08 0.00 -0.37 0.00 0.00 57.07 56.18 1k28 s TYR 88 Cb -0.12 -0.53 -0.05 0.00 -0.40 0.00 0.00 41.96 40.86 1k28 s TYR 88 CO 0.07 -0.07 -0.12 0.20 -1.57 0.00 0.00 175.55 174.05 1k28 s GLY 89 N -2.70 1.67 -0.67 0.71 0.00 -0.38 -0.37 107.32 105.57 1k28 s GLY 89 Ca 0.08 -1.79 -0.27 0.00 0.00 0.00 0.00 44.72 42.73 1k28 s GLY 89 CO -0.02 -1.83 1.27 0.00 0.00 0.00 0.00 173.10 172.52 1k28 h LYS 91 N 10.03 0.52 0.00 0.00 3.11 -1.17 -3.46 116.57 125.59 1k28 h LYS 91 Ca -0.27 -0.20 0.00 0.00 -2.81 0.00 0.00 60.65 57.37 1k28 h LYS 91 Cb 1.06 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 32.26 1k28 h LYS 91 CO 1.24 0.74 0.00 1.58 -2.81 0.00 0.00 179.45 180.20 1k28 n HIS 92 N -4.11 0.00 -4.35 1.91 -0.00 -1.23 -4.99 115.22 102.46 1k28 n HIS 92 Ca -0.00 0.00 -0.19 0.00 -0.00 0.00 0.00 57.72 57.52 1k28 n HIS 92 Cb 0.42 0.00 -0.14 0.00 -0.00 0.00 0.00 29.99 30.27 1k28 n HIS 92 CO 0.00 0.00 0.00 -0.59 -0.00 0.00 0.00 176.34 175.75 1k28 s PHE 93 N -1.19 1.08 0.38 1.57 -0.71 -1.26 0.57 117.98 118.41 1k28 s PHE 93 Ca 0.00 -0.31 0.08 0.00 -1.04 0.00 0.00 56.93 55.65 1k28 s PHE 93 Cb 0.00 -0.65 -0.03 0.00 -1.21 0.00 0.00 43.02 41.12 1k28 s PHE 93 CO 0.00 0.01 0.27 -1.54 -1.34 0.00 0.00 175.22 172.62 1k28 s SER 94 N -0.92 4.90 -0.34 1.98 1.04 -0.15 -4.99 113.70 115.22 1k28 s SER 94 Ca 0.01 -0.75 -0.00 0.00 0.48 0.00 0.00 55.95 55.69 1k28 s SER 94 Cb -0.07 -0.68 0.14 0.00 0.10 0.00 0.00 66.02 65.50 1k28 s SER 94 CO 0.01 -0.48 0.24 -0.69 0.98 0.00 0.00 173.24 173.29 1k28 s VAL 95 N -2.45 -0.05 -1.12 5.02 1.01 -1.26 -2.93 120.40 118.62 1k28 s VAL 95 Ca 0.43 -1.27 -0.17 0.00 0.00 0.00 0.00 61.98 60.97 1k28 s VAL 95 Cb -0.02 -0.98 0.13 0.00 0.00 0.00 0.00 36.38 35.50 1k28 s VAL 95 CO 0.25 -0.81 1.40 -0.94 0.00 0.00 0.00 175.10 175.00 1k28 s SER 96 N 1.46 6.82 0.45 3.32 1.04 -0.63 -5.00 113.70 121.17 1k28 s SER 96 Ca 0.15 -2.42 -0.15 0.00 0.48 0.00 0.00 55.95 54.01 1k28 s SER 96 Cb -0.19 -2.45 -0.08 0.00 0.10 0.00 0.00 66.02 63.39 1k28 s SER 96 CO -0.10 -1.01 0.89 0.54 0.98 0.00 0.00 173.24 174.54 1k28 s VAL 97 N 2.81 4.60 0.00 5.02 0.11 -1.26 -3.24 120.40 128.43 1k28 s VAL 97 Ca 0.42 1.07 0.00 0.00 -2.93 0.00 0.00 61.98 60.54 1k28 s VAL 97 Cb -0.02 -3.69 0.00 0.00 -1.53 0.00 0.00 36.38 31.14 1k28 s VAL 97 CO -0.03 -0.52 0.00 -0.67 -3.33 0.00 0.00 175.10 170.55 1k28 n ASP 98 N -1.20 0.00 -1.11 3.54 4.64 -1.26 -5.00 116.55 116.15 1k28 n ASP 98 Ca 0.05 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.46 1k28 n ASP 98 Cb 0.54 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.62 1k28 n ASP 98 CO 0.00 0.00 0.00 -1.54 -0.82 0.00 0.00 177.20 174.84 1k28 n SER 99 N 0.00 -1.49 -3.26 1.67 3.41 -1.26 -4.37 113.62 108.32 1k28 n SER 99 Ca 0.00 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.40 1k28 n SER 99 Cb 0.00 -0.67 0.02 0.00 -0.26 0.00 0.00 64.21 63.30 1k28 n SER 99 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1k28 n LYS 100 N -0.81 -1.69 0.00 4.33 5.02 -1.26 -3.42 118.16 120.33 1k28 n LYS 100 Ca 0.00 1.47 0.00 0.00 -2.02 0.00 0.00 58.31 57.76 1k28 n LYS 100 Cb 0.37 -2.57 0.00 0.00 -0.02 0.00 0.00 35.03 32.81 1k28 n LYS 100 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k28 n GLY 101 N 0.26 0.43 3.61 0.72 0.00 -1.26 -4.86 105.19 104.09 1k28 n GLY 101 Ca -0.03 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.56 1k28 n GLY 101 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1k28 s ASP 102 N 0.00 6.19 0.00 1.61 1.11 -1.22 -4.88 116.67 119.48 1k28 s ASP 102 Ca 0.00 1.17 0.00 0.00 0.18 0.00 0.00 52.55 53.90 1k28 s ASP 102 Cb 0.00 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.46 1k28 s ASP 102 CO 0.00 -1.49 0.00 -0.46 1.18 0.00 0.00 175.17 174.40 1k28 n ASN 103 N 9.26 0.64 -4.17 0.27 0.23 -1.26 -4.41 115.26 115.83 1k28 n ASN 103 Ca 0.19 -0.55 -0.26 0.00 -0.53 0.00 0.00 54.58 53.44 1k28 n ASN 103 Cb 0.47 0.00 -0.16 0.00 -2.08 0.00 0.00 39.78 38.01 1k28 n ASN 103 CO 0.00 0.00 0.00 -0.51 -0.93 0.00 0.00 177.26 175.82 1k28 s ILE 104 N -1.09 1.45 0.04 1.53 1.10 -1.20 -3.35 121.20 119.68 1k28 s ILE 104 Ca 0.00 -0.77 0.00 0.00 -0.51 0.00 0.00 60.65 59.38 1k28 s ILE 104 Cb 0.00 -1.21 -0.03 0.00 0.15 0.00 0.00 42.46 41.37 1k28 s ILE 104 CO 0.00 0.41 -0.04 0.27 -2.11 0.00 0.00 174.94 173.47 1k28 s ILE 105 N -0.30 0.26 -0.03 2.00 -4.36 -0.80 -1.60 121.20 116.38 1k28 s ILE 105 Ca 0.04 -1.29 0.02 0.00 -0.26 0.00 0.00 60.65 59.15 1k28 s ILE 105 Cb -0.08 -0.81 0.01 0.00 1.25 0.00 0.00 42.46 42.82 1k28 s ILE 105 CO 0.00 -0.66 -0.06 0.00 0.24 0.00 0.00 174.94 174.46 1k28 s ALA 106 N -2.37 0.65 -0.17 2.27 0.00 -1.15 -0.59 121.76 120.40 1k28 s ALA 106 Ca -0.06 -0.14 -0.04 0.00 0.00 0.00 0.00 51.96 51.72 1k28 s ALA 106 Cb -0.03 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.74 1k28 s ALA 106 CO -0.04 0.05 -0.03 -1.50 0.00 0.00 0.00 175.76 174.24 1k28 s ILE 107 N 0.51 3.82 -0.26 0.00 2.07 0.47 -0.98 121.20 126.83 1k28 s ILE 107 Ca -0.07 -0.37 -0.29 0.00 -1.41 0.00 0.00 60.65 58.51 1k28 s ILE 107 Cb -0.10 -2.69 0.01 0.00 0.13 0.00 0.00 42.46 39.81 1k28 s ILE 107 CO 0.00 0.47 1.05 -0.70 -1.91 0.00 0.00 174.94 173.86 1k28 s GLU 108 N 0.62 4.20 0.09 3.50 2.12 0.19 -1.61 118.70 127.81 1k28 s GLU 108 Ca -0.02 1.27 -0.19 0.00 0.36 0.00 0.00 54.97 56.39 1k28 s GLU 108 Cb -0.14 -3.67 -0.07 0.00 0.26 0.00 0.00 34.13 30.51 1k28 s GLU 108 CO 0.02 -0.71 0.58 -0.51 -0.54 0.00 0.00 175.26 174.10 1k28 s LEU 109 N 3.34 4.50 0.28 2.70 1.02 0.13 -0.59 118.68 130.06 1k28 s LEU 109 Ca 0.45 1.26 -0.15 0.00 0.02 0.00 0.00 54.13 55.70 1k28 s LEU 109 Cb -0.14 -2.97 0.01 0.00 0.02 0.00 0.00 46.19 43.10 1k28 s LEU 109 CO 0.09 0.25 0.60 -0.83 0.02 0.00 0.00 176.35 176.47 1k28 s GLY 110 N -1.20 0.36 0.43 -3.19 0.00 -1.17 -1.33 107.32 101.22 1k28 s GLY 110 Ca 0.31 -0.70 -0.20 0.00 0.00 0.00 0.00 44.72 44.12 1k28 s GLY 110 CO 0.19 -0.43 0.94 -0.51 0.00 0.00 0.00 173.10 173.29 1k28 s THR 111 N -3.75 4.43 0.10 0.90 -4.23 -1.26 -1.25 115.64 110.58 1k28 s THR 111 Ca 0.18 1.42 -0.32 0.00 -1.18 0.00 0.00 61.69 61.79 1k28 s THR 111 Cb -0.03 -3.61 -0.13 0.00 1.34 0.00 0.00 72.50 70.06 1k28 s THR 111 CO 0.09 -0.35 1.51 0.40 -0.54 0.00 0.00 174.62 175.73 1k28 h ILE 112 N 1.80 0.00 -0.26 2.99 1.08 -1.88 -1.62 117.51 119.62 1k28 h ILE 112 Ca -0.49 0.00 0.05 0.00 -0.39 0.00 0.00 64.86 64.04 1k28 h ILE 112 Cb 1.18 0.00 -0.05 0.00 -3.07 0.00 0.00 36.82 34.88 1k28 h ILE 112 CO 0.61 0.00 -0.08 1.12 -0.69 0.00 0.00 178.15 179.12 1k28 h HIS 113 N -0.68 -0.17 -0.92 1.37 2.07 -1.94 -2.67 115.15 112.21 1k28 h HIS 113 Ca -0.00 0.02 0.09 0.00 -2.85 0.00 0.00 60.37 57.63 1k28 h HIS 113 Cb 0.69 0.11 -0.07 0.00 2.57 0.00 0.00 27.41 30.72 1k28 h HIS 113 CO -0.45 -0.13 0.59 1.03 -3.07 0.00 0.00 177.93 175.90 1k28 h SER 114 N -0.02 0.87 0.24 3.10 0.87 -1.91 -2.02 113.55 114.69 1k28 h SER 114 Ca 0.13 0.02 -0.13 0.00 -1.23 0.00 0.00 61.79 60.58 1k28 h SER 114 Cb 0.21 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 1k28 h SER 114 CO -0.28 0.52 -0.50 0.40 -0.53 0.00 0.00 176.83 176.44 1k28 h ILE 115 N 0.96 1.34 -3.53 2.23 2.04 -0.97 -3.39 117.51 116.19 1k28 h ILE 115 Ca 0.42 -1.73 -0.61 0.00 1.00 0.00 0.00 64.86 63.94 1k28 h ILE 115 Cb 0.35 1.81 -0.11 0.00 -0.74 0.00 0.00 36.82 38.12 1k28 h ILE 115 CO -0.18 0.52 0.43 -1.61 0.00 0.00 0.00 178.15 177.30 1k28 s GLU 116 N -3.99 3.74 0.00 2.37 2.02 -0.76 -4.92 118.70 117.17 1k28 s GLU 116 Ca -0.05 0.33 -0.01 0.00 0.02 0.00 0.00 54.97 55.27 1k28 s GLU 116 Cb 0.13 -3.82 -0.03 0.00 0.10 0.00 0.00 34.13 30.50 1k28 s GLU 116 CO 0.79 -0.90 1.72 0.09 0.02 0.00 0.00 175.26 176.98 1k28 n ASN 117 N 6.53 4.05 -4.68 -0.19 3.02 -1.26 -4.85 115.26 117.88 1k28 n ASN 117 Ca 0.04 -2.10 -0.50 0.00 -0.03 0.00 0.00 54.58 52.00 1k28 n ASN 117 Cb 0.48 -0.89 -0.05 0.00 -0.61 0.00 0.00 39.78 38.71 1k28 n ASN 117 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 1k28 n LEU 118 N 1.77 3.12 -4.52 3.41 7.94 -1.26 -4.92 117.00 122.53 1k28 n LEU 118 Ca 0.05 1.02 -0.35 0.00 -1.11 0.00 0.00 56.01 55.61 1k28 n LEU 118 Cb 0.43 -1.33 -0.11 0.00 0.53 0.00 0.00 43.42 42.93 1k28 n LEU 118 CO 0.02 -0.21 -0.28 -0.54 -1.11 0.00 0.00 177.39 175.27 1k28 s LYS 119 N 3.28 3.77 0.80 1.96 1.02 -1.26 -4.26 119.74 125.05 1k28 s LYS 119 Ca 0.91 -0.44 -0.08 0.00 0.02 0.00 0.00 55.97 56.39 1k28 s LYS 119 Cb -0.77 -3.22 0.14 0.00 -0.52 0.00 0.00 37.83 33.46 1k28 s LYS 119 CO 0.51 0.05 1.12 -0.06 -0.92 0.00 0.00 175.35 176.05 1k28 s PHE 120 N 0.97 1.92 -0.34 3.18 0.40 0.02 -4.96 117.98 119.18 1k28 s PHE 120 Ca 0.03 0.11 0.04 0.00 -0.60 0.00 0.00 56.93 56.51 1k28 s PHE 120 Cb -0.14 -3.44 0.20 0.00 0.51 0.00 0.00 43.02 40.14 1k28 s PHE 120 CO 0.03 -1.97 1.20 0.41 0.70 0.00 0.00 175.22 175.59 1k28 n GLY 121 N -3.19 -0.57 3.50 4.36 0.00 -0.86 -3.93 105.19 104.50 1k28 n GLY 121 Ca 0.13 0.22 -0.09 0.00 0.00 0.00 0.00 46.02 46.28 1k28 n GLY 121 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1k28 s ARG 122 N 0.07 1.37 1.10 1.61 1.70 -1.20 -4.95 118.95 118.66 1k28 s ARG 122 Ca 0.12 -1.02 -0.16 0.00 -0.47 0.00 0.00 55.73 54.20 1k28 s ARG 122 Cb 0.19 0.48 0.24 0.00 -0.57 0.00 0.00 34.95 35.29 1k28 s ARG 122 CO -0.08 -0.56 1.11 -2.14 -1.08 0.00 0.00 175.30 172.55 1k28 s PRO 123 N -3.93 -0.40 0.00 3.89 0.02 -1.26 -1.85 135.00 131.47 1k28 s PRO 123 Ca 0.14 0.18 0.00 0.00 0.02 0.00 0.00 61.00 61.34 1k28 s PRO 123 Cb 0.00 -1.67 0.00 0.00 0.02 0.00 0.00 34.50 32.85 1k28 s PRO 123 CO 0.01 -3.22 0.00 1.19 -0.33 0.00 0.00 177.00 174.65 1k28 n PHE 124 N -4.46 0.00 -4.11 6.54 3.72 -1.26 -4.82 117.46 113.07 1k28 n PHE 124 Ca 0.09 0.00 -0.08 0.00 -0.05 0.00 0.00 57.45 57.41 1k28 n PHE 124 Cb 0.59 0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 39.03 1k28 n PHE 124 CO 0.00 0.00 0.00 -0.06 -0.05 0.00 0.00 176.76 176.65 1k28 s PHE 125 N 2.40 0.63 -1.94 1.38 0.08 -1.26 -5.01 117.98 114.25 1k28 s PHE 125 Ca 0.00 -1.06 0.23 0.00 0.12 0.00 0.00 56.93 56.21 1k28 s PHE 125 Cb 0.00 -0.42 1.33 0.00 -0.57 0.00 0.00 43.02 43.36 1k28 s PHE 125 CO 0.00 -0.36 1.73 -0.35 -0.10 0.00 0.00 175.22 176.14 1k28 n PRO 126 N 0.06 0.67 -3.74 0.24 -0.04 -1.26 -4.46 135.00 126.46 1k28 n PRO 126 Ca -0.13 0.01 -0.38 0.00 -0.04 0.00 0.00 63.50 62.96 1k28 n PRO 126 Cb 0.61 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.45 1k28 n PRO 126 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1k28 s ASP 127 N -2.06 5.34 0.26 3.54 3.68 -1.26 -1.78 116.67 124.39 1k28 s ASP 127 Ca 0.33 -1.12 -0.02 0.00 2.13 0.00 0.00 52.55 53.88 1k28 s ASP 127 Cb 0.16 -1.88 0.51 0.00 -1.45 0.00 0.00 42.92 40.25 1k28 s ASP 127 CO 0.27 -0.33 1.78 0.00 0.13 0.00 0.00 175.17 177.02 1k28 h ALA 128 N 8.24 1.27 -0.91 3.66 0.00 -1.63 -1.61 119.26 128.28 1k28 h ALA 128 Ca -0.24 0.07 0.01 0.00 0.00 0.00 0.00 54.91 54.75 1k28 h ALA 128 Cb 1.08 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.78 1k28 h ALA 128 CO 0.61 -0.03 0.60 0.78 0.00 0.00 0.00 179.25 181.20 1k28 h GLY 129 N 0.68 1.28 2.00 0.00 0.00 -1.82 0.35 103.07 105.56 1k28 h GLY 129 Ca 0.45 -0.48 -0.08 0.00 0.00 0.00 0.00 47.33 47.23 1k28 h GLY 129 CO -0.33 0.46 -0.38 -2.09 0.00 0.00 0.00 176.54 174.20 1k28 h GLU 130 N 1.23 0.00 0.05 4.80 4.81 -1.64 -1.65 114.58 122.18 1k28 h GLU 130 Ca 0.33 0.00 -0.19 0.00 -0.13 0.00 0.00 59.36 59.38 1k28 h GLU 130 Cb -0.14 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.26 1k28 h GLU 130 CO -0.07 0.38 -0.77 0.77 -0.73 0.00 0.00 179.01 178.59 1k28 h SER 131 N 0.00 0.58 -0.48 1.04 0.02 -0.54 -1.75 113.55 112.42 1k28 h SER 131 Ca -0.00 -0.82 0.03 0.00 -0.84 0.00 0.00 61.79 60.15 1k28 h SER 131 Cb 0.91 -0.18 -0.03 0.00 0.14 0.00 0.00 62.40 63.23 1k28 h SER 131 CO 0.05 1.34 0.27 0.40 -1.14 0.00 0.00 176.83 177.75 1k28 h ILE 132 N -0.10 1.02 -0.30 3.27 2.04 -0.19 -2.60 117.51 120.65 1k28 h ILE 132 Ca -0.11 -0.19 -0.03 0.00 1.00 0.00 0.00 64.86 65.54 1k28 h ILE 132 Cb 1.50 0.43 -0.01 0.00 -0.74 0.00 0.00 36.82 38.00 1k28 h ILE 132 CO 0.15 0.10 0.09 0.11 0.00 0.00 0.00 178.15 178.60 1k28 h LYS 133 N 0.54 0.47 -0.19 2.37 1.57 -1.35 -2.52 116.57 117.46 1k28 h LYS 133 Ca 0.20 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.87 1k28 h LYS 133 Cb 0.05 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.29 1k28 h LYS 133 CO -0.10 0.53 0.00 0.39 -0.57 0.00 0.00 179.45 179.69 1k28 n GLU 134 N -4.69 0.03 0.00 3.15 -0.58 -0.66 -0.70 120.64 117.19 1k28 n GLU 134 Ca -0.02 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.72 1k28 n GLU 134 Cb 0.17 -1.05 0.00 0.00 -0.57 0.00 0.00 31.44 29.99 1k28 n GLU 134 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 1k28 n LEU 136 N 0.53 0.00 -0.17 -4.62 4.77 -0.95 -1.31 117.00 115.25 1k28 n LEU 136 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1k28 n LEU 136 Cb 0.01 0.00 0.26 0.00 -2.33 0.00 0.00 43.42 41.36 1k28 n LEU 136 CO 0.00 0.00 1.17 1.23 -1.33 0.00 0.00 177.39 178.46 1k28 h GLY 137 N 0.00 0.95 1.57 -0.72 0.00 -1.16 0.17 103.07 103.89 1k28 h GLY 137 Ca 0.00 -0.40 -0.22 0.00 0.00 0.00 0.00 47.33 46.71 1k28 h GLY 137 CO 0.00 0.38 -0.93 -2.08 0.00 0.00 0.00 176.54 173.91 1k28 h VAL 138 N 0.90 1.41 -0.59 4.60 2.07 -1.46 -1.87 116.25 121.32 1k28 h VAL 138 Ca 0.23 -2.46 -0.10 0.00 0.82 0.00 0.00 66.70 65.19 1k28 h VAL 138 Cb -0.02 2.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.15 1k28 h VAL 138 CO -0.04 0.73 -0.03 0.40 0.02 0.00 0.00 177.57 178.65 1k28 h ILE 139 N 0.22 1.27 -0.54 4.57 1.08 -1.55 -3.21 117.51 119.34 1k28 h ILE 139 Ca -0.07 -1.19 -0.35 0.00 -0.39 0.00 0.00 64.86 62.85 1k28 h ILE 139 Cb 1.57 0.85 -0.23 0.00 -3.07 0.00 0.00 36.82 35.94 1k28 h ILE 139 CO 0.16 0.43 -0.22 -1.22 -0.69 0.00 0.00 178.15 176.61 1k28 n TYR 140 N -4.17 1.82 0.31 1.37 4.01 0.49 -4.74 117.16 116.25 1k28 n TYR 140 Ca 0.02 -2.00 0.20 0.00 -0.16 0.00 0.00 57.90 55.97 1k28 n TYR 140 Cb 0.37 -0.56 0.96 0.00 -0.31 0.00 0.00 39.34 39.80 1k28 n TYR 140 CO 0.00 0.00 0.00 -0.56 -0.46 0.00 0.00 176.86 175.84 1k28 h GLN 141 N 1.51 0.00 0.00 -0.72 3.07 -1.34 0.28 115.11 117.90 1k28 h GLN 141 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.05 1k28 h GLN 141 Cb 1.46 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.02 1k28 h GLN 141 CO 0.64 0.00 0.00 -0.25 0.09 0.00 0.00 178.83 179.32 1k28 n ASP 142 N -3.10 1.58 -1.98 0.06 8.00 -1.26 -4.54 116.55 115.31 1k28 n ASP 142 Ca -0.01 -1.73 0.02 0.00 0.71 0.00 0.00 54.79 53.77 1k28 n ASP 142 Cb 0.18 0.00 0.04 0.00 -0.02 0.00 0.00 41.12 41.32 1k28 n ASP 142 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1k28 n ARG 143 N -0.37 0.78 -0.27 -1.24 1.74 -0.87 -4.96 116.66 111.48 1k28 n ARG 143 Ca 0.00 -2.66 -0.00 0.00 -0.77 0.00 0.00 57.85 54.42 1k28 n ARG 143 Cb 0.25 -0.71 0.03 0.00 -1.02 0.00 0.00 32.46 31.02 1k28 n ARG 143 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1k28 n THR 144 N 0.01 -0.36 0.24 0.55 -1.04 0.92 0.42 114.28 115.01 1k28 n THR 144 Ca 0.08 1.62 0.18 0.00 -2.04 0.00 0.00 64.05 63.89 1k28 n THR 144 Cb 1.00 -2.15 0.85 0.00 -1.82 0.00 0.00 70.33 68.21 1k28 n THR 144 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1k28 h LEU 145 N 0.00 0.00 0.00 -4.42 3.38 -1.93 -0.46 115.31 111.88 1k28 h LEU 145 Ca 0.25 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 1k28 h LEU 145 Cb 0.42 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1k28 h LEU 145 CO -0.69 0.00 -0.37 -0.07 0.09 0.00 0.00 178.44 177.40 1k28 h LEU 146 N 0.00 0.00 -9.58 1.67 3.38 -0.40 -3.46 115.31 106.92 1k28 h LEU 146 Ca 0.07 0.00 -0.57 0.00 0.09 0.00 0.00 57.88 57.47 1k28 h LEU 146 Cb 0.66 0.00 0.07 0.00 0.09 0.00 0.00 40.66 41.47 1k28 h LEU 146 CO -0.00 0.12 0.80 1.07 0.09 0.00 0.00 178.44 180.51 1k28 n THR 147 N -3.02 0.32 -1.52 0.22 5.66 -0.19 -4.90 114.28 110.85 1k28 n THR 147 Ca 0.02 -0.08 -0.29 0.00 -3.05 0.00 0.00 64.05 60.65 1k28 n THR 147 Cb 0.59 -1.64 0.13 0.00 -1.55 0.00 0.00 70.33 67.86 1k28 n THR 147 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 175.07 169.86 1k28 s PRO 148 N 0.51 1.32 0.29 1.09 0.04 -1.26 -5.01 135.00 131.97 1k28 s PRO 148 Ca 0.74 0.38 -0.29 0.00 0.04 0.00 0.00 61.00 61.87 1k28 s PRO 148 Cb -0.63 -1.85 -0.10 0.00 0.04 0.00 0.00 34.50 31.97 1k28 s PRO 148 CO 0.41 -2.09 1.18 0.00 0.04 0.00 0.00 177.00 176.53 1k28 s ALA 149 N -3.23 3.44 -0.43 8.56 0.00 -1.26 -4.86 121.76 123.98 1k28 s ALA 149 Ca 0.63 1.03 -0.03 0.00 0.00 0.00 0.00 51.96 53.59 1k28 s ALA 149 Cb -0.15 -3.39 0.11 0.00 0.00 0.00 0.00 23.12 19.70 1k28 s ALA 149 CO 0.54 -0.34 0.23 0.42 0.00 0.00 0.00 175.76 176.60 1k28 s ILE 150 N -1.07 3.39 -0.93 0.00 -1.09 -1.26 -0.63 121.20 119.60 1k28 s ILE 150 Ca 0.47 -2.08 -0.15 0.00 -2.23 0.00 0.00 60.65 56.65 1k28 s ILE 150 Cb -0.35 -3.31 0.18 0.00 -1.58 0.00 0.00 42.46 37.41 1k28 s ILE 150 CO 0.45 -0.71 1.01 0.20 -1.23 0.00 0.00 174.94 174.66 1k28 s ASN 151 N 1.84 6.79 0.05 3.58 -0.87 0.24 -5.01 114.94 121.55 1k28 s ASN 151 Ca 0.08 -2.55 0.02 0.00 -1.57 0.00 0.00 52.86 48.85 1k28 s ASN 151 Cb -0.23 -2.30 -0.04 0.00 -0.02 0.00 0.00 41.25 38.66 1k28 s ASN 151 CO -0.04 -0.76 0.07 0.00 -2.57 0.00 0.00 177.10 173.80 1k28 s ALA 152 N 1.17 3.54 0.42 0.60 0.00 -1.26 -4.18 121.76 122.05 1k28 s ALA 152 Ca 0.27 -0.97 0.07 0.00 0.00 0.00 0.00 51.96 51.33 1k28 s ALA 152 Cb -0.07 -1.46 -0.07 0.00 0.00 0.00 0.00 23.12 21.52 1k28 s ALA 152 CO -0.08 0.72 0.05 0.96 0.00 0.00 0.00 175.76 177.40 1k28 s ILE 153 N -1.30 1.99 -0.48 0.00 -4.36 -1.26 -5.07 121.20 110.73 1k28 s ILE 153 Ca 0.26 -1.94 -0.21 0.00 -0.26 0.00 0.00 60.65 58.51 1k28 s ILE 153 Cb -0.12 -2.93 0.04 0.00 1.25 0.00 0.00 42.46 40.70 1k28 s ILE 153 CO 0.18 0.00 0.70 0.21 0.24 0.00 0.00 174.94 176.27 1k28 s ASN 154 N -3.76 6.30 -0.02 4.36 3.04 -1.26 -4.07 114.94 119.52 1k28 s ASN 154 Ca 0.34 -0.52 0.07 0.00 0.04 0.00 0.00 52.86 52.79 1k28 s ASN 154 Cb 0.08 -2.33 -0.02 0.00 -1.54 0.00 0.00 41.25 37.44 1k28 s ASN 154 CO 0.18 -0.90 -0.23 0.00 -3.04 0.00 0.00 177.10 173.11 1k28 s ALA 155 N 2.97 1.92 -0.02 1.71 0.00 -1.26 -0.94 121.76 126.14 1k28 s ALA 155 Ca 0.22 -0.98 -0.23 0.00 0.00 0.00 0.00 51.96 50.97 1k28 s ALA 155 Cb -0.15 -0.51 -0.05 0.00 0.00 0.00 0.00 23.12 22.41 1k28 s ALA 155 CO 0.17 0.45 0.68 -0.47 0.00 0.00 0.00 175.76 176.59 1k28 s TYR 156 N -0.45 3.65 -0.00 0.00 6.14 0.11 -2.04 117.35 124.75 1k28 s TYR 156 Ca 0.06 1.29 0.01 0.00 0.64 0.00 0.00 57.07 59.07 1k28 s TYR 156 Cb -0.10 -2.75 -0.00 0.00 0.42 0.00 0.00 41.96 39.53 1k28 s TYR 156 CO -0.00 0.21 -0.02 0.08 0.64 0.00 0.00 175.55 176.46 1k28 s VAL 157 N 0.31 0.13 0.19 3.14 1.01 -0.73 -0.08 120.40 124.37 1k28 s VAL 157 Ca 0.36 -0.07 -0.33 0.00 0.00 0.00 0.00 61.98 61.93 1k28 s VAL 157 Cb -0.19 -0.12 -0.14 0.00 0.00 0.00 0.00 36.38 35.93 1k28 s VAL 157 CO 0.19 0.04 1.49 -2.65 0.00 0.00 0.00 175.10 174.17 1k28 n PRO 158 N 3.04 2.03 -1.42 2.72 -0.02 -1.26 -4.49 135.00 135.59 1k28 n PRO 158 Ca -0.12 0.73 -0.39 0.00 -2.02 0.00 0.00 63.50 61.69 1k28 n PRO 158 Cb 0.59 -2.45 -0.06 0.00 -0.02 0.00 0.00 33.50 31.57 1k28 n PRO 158 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1k28 n ASP 159 N 2.87 2.70 -4.32 2.55 4.64 -1.26 -4.88 116.55 118.85 1k28 n ASP 159 Ca 0.15 -2.69 -0.23 0.00 -1.38 0.00 0.00 54.79 50.64 1k28 n ASP 159 Cb 0.29 -1.29 -0.12 0.00 -1.04 0.00 0.00 41.12 38.96 1k28 n ASP 159 CO 0.00 0.00 0.00 0.27 -0.82 0.00 0.00 177.20 176.65 1k28 s ILE 160 N 6.71 1.81 0.59 5.18 -5.25 -1.26 -5.00 121.20 123.98 1k28 s ILE 160 Ca 0.61 -1.75 -0.20 0.00 -0.99 0.00 0.00 60.65 58.32 1k28 s ILE 160 Cb 0.10 -1.73 -0.04 0.00 2.95 0.00 0.00 42.46 43.74 1k28 s ILE 160 CO 0.13 -0.18 1.26 -2.65 -1.79 0.00 0.00 174.94 171.71 1k28 n PRO 161 N 0.67 1.35 -3.77 0.37 -0.02 -1.26 -4.60 135.00 127.74 1k28 n PRO 161 Ca -0.16 0.51 -0.37 0.00 -2.02 0.00 0.00 63.50 61.46 1k28 n PRO 161 Cb 0.55 -2.48 -0.13 0.00 -0.02 0.00 0.00 33.50 31.43 1k28 n PRO 161 CO 0.00 0.00 0.00 -0.46 1.98 0.00 0.00 175.50 177.02 1k28 s TRP 162 N -1.36 3.09 -2.42 6.00 -0.11 -0.77 -4.93 118.94 118.43 1k28 s TRP 162 Ca 0.76 -0.64 0.23 0.00 1.22 0.00 0.00 56.10 57.66 1k28 s TRP 162 Cb -0.41 -2.23 0.41 0.00 -1.50 0.00 0.00 33.47 29.74 1k28 s TRP 162 CO 0.46 -0.45 1.38 0.25 -4.62 0.00 0.00 176.95 173.97 1k28 n THR 163 N 4.90 0.49 -2.51 5.86 -2.24 -1.26 -2.04 114.28 117.48 1k28 n THR 163 Ca -0.16 -0.75 0.00 0.00 -2.27 0.00 0.00 64.05 60.88 1k28 n THR 163 Cb 0.50 1.00 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 1k28 n THR 163 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 1k28 n SER 164 N 1.46 1.14 -4.67 3.42 2.88 -1.25 -4.33 113.62 112.27 1k28 n SER 164 Ca 0.19 0.00 -0.27 0.00 -1.33 0.00 0.00 58.87 57.46 1k28 n SER 164 Cb 0.60 0.00 0.11 0.00 -0.75 0.00 0.00 64.21 64.17 1k28 n SER 164 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1k28 s THR 165 N 1.49 2.16 -0.01 2.46 -4.23 -1.26 -0.80 115.64 115.45 1k28 s THR 165 Ca 0.00 -0.25 -0.25 0.00 -1.18 0.00 0.00 61.69 60.01 1k28 s THR 165 Cb 0.00 -2.91 -0.19 0.00 1.34 0.00 0.00 72.50 70.75 1k28 s THR 165 CO 0.00 0.00 1.26 0.15 -0.54 0.00 0.00 174.62 175.49 1k28 h PHE 166 N -0.88 -0.11 -0.90 3.99 3.57 -1.94 -2.44 116.94 118.23 1k28 h PHE 166 Ca -0.43 -0.00 0.13 0.00 3.53 0.00 0.00 57.97 61.20 1k28 h PHE 166 Cb 1.29 0.03 -0.09 0.00 2.79 0.00 0.00 35.95 39.97 1k28 h PHE 166 CO -0.16 0.30 0.51 0.93 -2.23 0.00 0.00 178.31 177.66 1k28 h GLU 167 N -0.54 0.74 0.00 1.11 3.07 -1.94 0.11 114.58 117.12 1k28 h GLU 167 Ca -0.01 -0.04 -0.01 0.00 -0.50 0.00 0.00 59.36 58.79 1k28 h GLU 167 Cb 0.45 -0.17 -0.00 0.00 -0.84 0.00 0.00 28.75 28.19 1k28 h GLU 167 CO 0.02 0.49 -0.07 -0.91 -1.40 0.00 0.00 179.01 177.14 1k28 h ASN 168 N 0.76 0.00 0.07 1.42 2.35 -1.94 -2.00 115.58 116.25 1k28 h ASN 168 Ca 0.47 0.00 -0.22 0.00 -0.55 0.00 0.00 56.30 56.00 1k28 h ASN 168 Cb 0.58 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.96 1k28 h ASN 168 CO -0.32 0.07 -0.82 0.22 -1.65 0.00 0.00 177.43 174.93 1k28 h TYR 169 N 0.00 0.84 -0.73 1.19 3.20 -0.30 -0.80 116.97 120.37 1k28 h TYR 169 Ca -0.00 -0.39 -0.04 0.00 3.14 0.00 0.00 58.73 61.43 1k28 h TYR 169 Cb 0.59 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 1k28 h TYR 169 CO 0.00 1.20 0.29 -0.07 -1.64 0.00 0.00 178.16 177.94 1k28 h LEU 170 N 0.39 1.00 0.19 2.82 3.38 -0.88 0.13 115.31 122.35 1k28 h LEU 170 Ca -0.06 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.75 1k28 h LEU 170 Cb 1.44 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1k28 h LEU 170 CO 0.16 0.89 -0.09 0.28 0.09 0.00 0.00 178.44 179.77 1k28 h SER 171 N 1.07 -0.22 -0.95 -0.43 0.02 -1.17 0.19 113.55 112.06 1k28 h SER 171 Ca 0.25 -0.08 0.15 0.00 -0.84 0.00 0.00 61.79 61.27 1k28 h SER 171 Cb 0.20 0.06 -0.09 0.00 0.14 0.00 0.00 62.40 62.71 1k28 h SER 171 CO -0.02 -0.06 0.56 0.22 -1.14 0.00 0.00 176.83 176.39 1k28 h TYR 172 N -0.37 0.99 0.41 3.45 3.20 -0.79 -1.84 116.97 122.02 1k28 h TYR 172 Ca -0.03 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 1k28 h TYR 172 Cb 0.29 -0.30 0.00 0.00 1.54 0.00 0.00 36.73 38.26 1k28 h TYR 172 CO -0.03 0.29 -0.20 0.28 -1.64 0.00 0.00 178.16 176.87 1k28 h VAL 173 N 0.80 0.59 -0.65 1.81 2.07 -0.16 0.25 116.25 120.95 1k28 h VAL 173 Ca 0.51 -0.30 0.19 0.00 0.82 0.00 0.00 66.70 67.92 1k28 h VAL 173 Cb 0.67 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 1k28 h VAL 173 CO -0.33 0.06 0.68 0.03 0.02 0.00 0.00 177.57 178.02 1k28 h ARG 174 N -0.72 0.00 0.00 1.57 3.08 0.16 0.21 114.38 118.67 1k28 h ARG 174 Ca -0.06 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1k28 h ARG 174 Cb 0.51 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.56 1k28 h ARG 174 CO 0.09 0.00 -1.52 0.39 -1.07 0.00 0.00 179.97 177.86 1k28 n GLU 175 N -3.64 0.77 0.00 0.04 1.02 -0.89 -4.65 120.64 113.29 1k28 n GLU 175 Ca 0.13 -0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1k28 n GLU 175 Cb 0.91 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.98 1k28 n GLU 175 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 1k28 n VAL 176 N -1.91 0.00 -1.72 2.62 0.31 0.84 -4.98 118.33 113.49 1k28 n VAL 176 Ca -0.02 0.00 -0.42 0.00 -0.01 0.00 0.00 64.34 63.89 1k28 n VAL 176 Cb 0.38 -0.38 -0.03 0.00 -0.91 0.00 0.00 33.84 32.90 1k28 n VAL 176 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1k28 n ALA 177 N -1.40 2.73 -3.83 3.52 0.00 -0.04 -4.77 120.51 116.71 1k28 n ALA 177 Ca 0.00 0.40 -0.34 0.00 0.00 0.00 0.00 53.44 53.50 1k28 n ALA 177 Cb 0.24 -2.51 -0.14 0.00 0.00 0.00 0.00 19.45 17.04 1k28 n ALA 177 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1k28 s LEU 178 N 0.87 3.37 -0.23 0.00 1.98 0.89 -4.02 118.68 121.54 1k28 s LEU 178 Ca 0.73 -1.12 -0.41 0.00 -2.89 0.00 0.00 54.13 50.45 1k28 s LEU 178 Cb -0.51 -1.63 -0.17 0.00 0.66 0.00 0.00 46.19 44.54 1k28 s LEU 178 CO 0.35 -0.17 1.62 0.00 -1.89 0.00 0.00 176.35 176.26 1k28 n ALA 179 N 4.58 -0.66 -2.10 5.97 0.00 -0.82 0.06 120.51 127.54 1k28 n ALA 179 Ca -0.15 0.44 -0.42 0.00 0.00 0.00 0.00 53.44 53.30 1k28 n ALA 179 Cb 0.45 -2.13 -0.03 0.00 0.00 0.00 0.00 19.45 17.73 1k28 n ALA 179 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1k28 s VAL 180 N 2.77 3.18 0.00 0.00 1.01 -0.12 0.17 120.40 127.41 1k28 s VAL 180 Ca 0.97 0.80 0.00 0.00 0.00 0.00 0.00 61.98 63.74 1k28 s VAL 180 Cb -1.12 -3.51 0.00 0.00 0.00 0.00 0.00 36.38 31.75 1k28 s VAL 180 CO 0.64 0.05 0.00 0.61 0.00 0.00 0.00 175.10 176.40 1k28 n GLY 181 N 3.63 1.90 0.22 4.51 0.00 -1.26 -4.50 105.19 109.68 1k28 n GLY 181 Ca 0.13 -0.08 -0.04 0.00 0.00 0.00 0.00 46.02 46.02 1k28 n GLY 181 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1k28 h SER 182 N 0.00 -0.55 -4.18 1.61 0.87 -1.94 -3.46 113.55 105.90 1k28 h SER 182 Ca 0.00 0.15 -0.21 0.00 -1.23 0.00 0.00 61.79 60.50 1k28 h SER 182 Cb 0.00 0.32 0.10 0.00 -0.44 0.00 0.00 62.40 62.38 1k28 h SER 182 CO 0.00 -0.19 -0.46 -0.67 -0.53 0.00 0.00 176.83 174.98 1k28 n ASP 183 N -5.36 -2.51 -3.96 6.23 2.03 0.13 -5.01 116.55 108.09 1k28 n ASP 183 Ca 0.03 -0.37 -0.08 0.00 0.52 0.00 0.00 54.79 54.89 1k28 n ASP 183 Cb 0.27 -3.32 -0.08 0.00 -0.72 0.00 0.00 41.12 37.27 1k28 n ASP 183 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 1k28 s LYS 184 N -5.01 0.81 0.96 -0.67 1.02 -1.26 -4.90 119.74 110.69 1k28 s LYS 184 Ca 0.07 -1.10 -0.12 0.00 0.02 0.00 0.00 55.97 54.84 1k28 s LYS 184 Cb -0.03 0.30 0.10 0.00 -0.52 0.00 0.00 37.83 37.68 1k28 s LYS 184 CO 0.45 -0.23 0.72 1.97 -0.92 0.00 0.00 175.35 177.33 1k28 n PHE 185 N -0.02 -0.51 -4.36 3.18 1.16 -1.26 -1.95 117.46 113.69 1k28 n PHE 185 Ca -0.13 0.27 -0.29 0.00 -1.87 0.00 0.00 57.45 55.42 1k28 n PHE 185 Cb 0.62 -1.85 -0.12 0.00 -1.61 0.00 0.00 39.48 36.52 1k28 n PHE 185 CO 0.00 0.00 0.00 0.08 -1.87 0.00 0.00 176.76 174.97 1k28 s VAL 186 N -2.48 2.44 -0.14 1.97 1.01 -1.26 -2.22 120.40 119.72 1k28 s VAL 186 Ca 0.62 -1.69 -0.00 0.00 0.00 0.00 0.00 61.98 60.90 1k28 s VAL 186 Cb -0.22 -2.09 -0.01 0.00 0.00 0.00 0.00 36.38 34.06 1k28 s VAL 186 CO 0.63 0.09 -0.13 -0.36 0.00 0.00 0.00 175.10 175.33 1k28 s PHE 187 N -1.10 2.80 -0.04 5.22 0.08 -1.26 -4.58 117.98 119.10 1k28 s PHE 187 Ca 0.15 -0.76 0.01 0.00 0.12 0.00 0.00 56.93 56.46 1k28 s PHE 187 Cb -0.10 -1.86 0.02 0.00 -0.57 0.00 0.00 43.02 40.50 1k28 s PHE 187 CO 0.07 -0.29 -0.06 0.14 -0.10 0.00 0.00 175.22 174.98 1k28 s VAL 188 N 0.51 0.63 0.35 -0.44 -7.23 -1.26 -4.72 120.40 108.24 1k28 s VAL 188 Ca -0.09 -0.19 -0.14 0.00 -1.81 0.00 0.00 61.98 59.75 1k28 s VAL 188 Cb -0.16 -0.62 0.06 0.00 0.56 0.00 0.00 36.38 36.21 1k28 s VAL 188 CO 0.04 0.24 0.74 -2.67 -0.31 0.00 0.00 175.10 173.13 1k28 n TRP 189 N 3.90 -2.22 -4.30 2.82 2.14 -0.92 -4.45 117.44 114.42 1k28 n TRP 189 Ca -0.24 -1.68 -0.18 0.00 2.07 0.00 0.00 57.50 57.46 1k28 n TRP 189 Cb 0.51 0.84 -0.13 0.00 -0.81 0.00 0.00 31.31 31.72 1k28 n TRP 189 CO 0.00 0.00 0.00 -0.65 2.07 0.00 0.00 177.69 179.11 1k28 s GLN 190 N -2.08 0.78 0.00 -2.67 -0.21 -1.26 -1.43 119.66 112.79 1k28 s GLN 190 Ca 0.15 -0.60 0.00 0.00 0.02 0.00 0.00 55.36 54.93 1k28 s GLN 190 Cb -0.04 -0.73 0.00 0.00 1.00 0.00 0.00 33.01 33.23 1k28 s GLN 190 CO 0.11 0.18 0.00 -0.40 -2.12 0.00 0.00 175.29 173.06 1k28 n ASP 191 N 2.16 0.00 -0.88 5.90 5.68 -1.26 -4.51 116.55 123.64 1k28 n ASP 191 Ca -0.17 -0.50 0.00 0.00 -0.50 0.00 0.00 54.79 53.62 1k28 n ASP 191 Cb 0.55 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.53 1k28 n ASP 191 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1k28 n ILE 192 N 0.00 0.00 -2.18 2.12 0.13 -1.26 -4.79 119.36 113.38 1k28 n ILE 192 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 1k28 n ILE 192 Cb 0.00 -0.25 0.00 0.00 -0.84 0.00 0.00 39.64 38.55 1k28 n ILE 192 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1k28 n GLY 194 N 0.72 5.45 3.65 4.50 0.00 -1.26 -4.63 105.19 113.61 1k28 n GLY 194 Ca 0.00 -1.43 -0.42 0.00 0.00 0.00 0.00 46.02 44.17 1k28 n GLY 194 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1k28 s VAL 195 N 1.05 4.74 0.04 1.61 1.01 0.20 -4.22 120.40 124.84 1k28 s VAL 195 Ca 0.00 1.71 0.00 0.00 0.00 0.00 0.00 61.98 63.69 1k28 s VAL 195 Cb 0.00 -4.22 -0.00 0.00 0.00 0.00 0.00 36.38 32.16 1k28 s VAL 195 CO 0.00 -0.18 0.01 0.59 0.00 0.00 0.00 175.10 175.52 1k28 n ASN 196 N 6.23 1.53 -3.91 3.32 3.02 -0.51 0.79 115.26 125.73 1k28 n ASN 196 Ca 0.08 -1.20 -0.15 0.00 -0.03 0.00 0.00 54.58 53.28 1k28 n ASN 196 Cb 0.47 0.07 0.02 0.00 -0.61 0.00 0.00 39.78 39.73 1k28 n ASN 196 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 1k28 n ASP 199 N -1.53 1.83 0.35 6.41 3.85 -1.26 -2.17 116.55 124.02 1k28 n ASP 199 Ca -0.01 -2.15 -0.14 0.00 -0.71 0.00 0.00 54.79 51.77 1k28 n ASP 199 Cb 0.06 -0.14 -0.07 0.00 -1.35 0.00 0.00 41.12 39.62 1k28 n ASP 199 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.20 176.41 1k28 h TYR 200 N 0.37 -0.86 -0.08 2.11 -0.00 -1.72 -3.44 116.97 113.35 1k28 h TYR 200 Ca -0.21 -0.02 -0.16 0.00 -0.00 0.00 0.00 58.73 58.34 1k28 h TYR 200 Cb 0.84 0.28 -0.05 0.00 -0.00 0.00 0.00 36.73 37.80 1k28 h TYR 200 CO 0.00 -0.53 1.15 -0.25 -0.00 0.00 0.00 178.16 178.53 1k28 n ASP 201 N -5.24 -0.61 0.00 -2.11 8.00 -1.26 -4.73 116.55 110.60 1k28 n ASP 201 Ca -0.11 -1.16 0.00 0.00 0.71 0.00 0.00 54.79 54.22 1k28 n ASP 201 Cb 0.36 -0.92 0.00 0.00 -0.02 0.00 0.00 41.12 40.55 1k28 n ASP 201 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 1k28 n ILE 204 N 6.35 0.00 -0.72 0.53 2.08 -1.26 -4.60 119.36 121.75 1k28 n ILE 204 Ca 0.45 0.00 -0.06 0.00 0.56 0.00 0.00 62.75 63.70 1k28 n ILE 204 Cb 0.32 0.00 -0.04 0.00 -0.75 0.00 0.00 39.64 39.17 1k28 n ILE 204 CO 0.00 0.00 0.00 0.59 0.56 0.00 0.00 176.55 177.70 1k28 n ASN 205 N 0.85 5.48 -4.37 4.38 3.02 -1.26 -4.78 115.26 118.57 1k28 n ASN 205 Ca 0.00 -2.53 -0.32 0.00 -0.03 0.00 0.00 54.58 51.70 1k28 n ASN 205 Cb 0.00 -1.20 -0.15 0.00 -0.61 0.00 0.00 39.78 37.82 1k28 n ASN 205 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1k28 s GLN 206 N 0.01 2.63 0.04 3.52 0.74 -1.26 -5.10 119.66 120.23 1k28 s GLN 206 Ca 0.24 -0.79 -0.30 0.00 0.05 0.00 0.00 55.36 54.55 1k28 s GLN 206 Cb 0.13 -2.31 -0.07 0.00 1.10 0.00 0.00 33.01 31.86 1k28 s GLN 206 CO -0.01 0.47 1.50 -1.21 -0.55 0.00 0.00 175.29 175.48 1k28 s GLU 207 N -0.34 4.25 0.08 1.67 0.41 -1.26 -4.91 118.70 118.60 1k28 s GLU 207 Ca 0.02 2.12 -0.31 0.00 -0.41 0.00 0.00 54.97 56.39 1k28 s GLU 207 Cb -0.12 -3.55 -0.08 0.00 -1.78 0.00 0.00 34.13 28.59 1k28 s GLU 207 CO 0.02 -0.63 1.52 -1.25 -0.49 0.00 0.00 175.26 174.43 1k28 s PRO 208 N 2.38 4.25 -0.93 0.39 0.04 -1.26 -4.67 135.00 135.21 1k28 s PRO 208 Ca 0.68 2.19 -0.22 0.00 0.04 0.00 0.00 61.00 63.68 1k28 s PRO 208 Cb -0.35 -3.43 0.07 0.00 0.04 0.00 0.00 34.50 30.83 1k28 s PRO 208 CO 0.29 -0.60 1.29 -0.47 0.04 0.00 0.00 177.00 177.55 1k28 s TYR 209 N 1.94 2.68 1.16 0.56 5.04 -0.63 -4.68 117.35 123.43 1k28 s TYR 209 Ca 0.69 -0.88 -0.13 0.00 -2.44 0.00 0.00 57.07 54.31 1k28 s TYR 209 Cb -0.38 -4.53 0.28 0.00 0.35 0.00 0.00 41.96 37.68 1k28 s TYR 209 CO 0.30 -1.80 1.03 -1.25 -1.34 0.00 0.00 175.55 172.49 1k28 s PRO 210 N 4.33 -0.90 0.25 4.97 0.04 -1.26 -3.44 135.00 138.99 1k28 s PRO 210 Ca 0.39 0.91 -0.12 0.00 0.04 0.00 0.00 61.00 62.22 1k28 s PRO 210 Cb -0.04 -1.55 -0.00 0.00 0.04 0.00 0.00 34.50 32.95 1k28 s PRO 210 CO -0.05 -3.73 0.47 0.96 0.04 0.00 0.00 177.00 174.69 1k28 s ILE 212 N -2.44 0.00 -0.33 0.56 -4.36 -0.52 -4.38 121.20 109.73 1k28 s ILE 212 Ca 0.69 -1.44 0.04 0.00 -0.26 0.00 0.00 60.65 59.68 1k28 s ILE 212 Cb -0.25 -2.26 0.31 0.00 1.25 0.00 0.00 42.46 41.51 1k28 s ILE 212 CO 0.65 0.00 1.38 0.55 0.24 0.00 0.00 174.94 177.75 1k28 n VAL 213 N -0.39 0.00 0.00 8.37 3.14 -1.08 -1.91 118.33 126.45 1k28 n VAL 213 Ca -0.01 -0.67 0.00 0.00 -2.96 0.00 0.00 64.34 60.70 1k28 n VAL 213 Cb 0.62 1.05 0.00 0.00 -1.06 0.00 0.00 33.84 34.45 1k28 n VAL 213 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1k28 n GLY 214 N 0.41 2.55 2.49 7.55 0.00 -1.26 -4.59 105.19 112.34 1k28 n GLY 214 Ca -0.07 0.13 -0.14 0.00 0.00 0.00 0.00 46.02 45.94 1k28 n GLY 214 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1k28 n GLU 215 N 0.00 0.91 -2.33 1.61 1.02 -1.26 -4.88 120.64 115.72 1k28 n GLU 215 Ca 0.00 -2.53 -0.26 0.00 -0.02 0.00 0.00 57.16 54.34 1k28 n GLU 215 Cb 0.00 -1.34 0.04 0.00 -0.02 0.00 0.00 31.44 30.12 1k28 n GLU 215 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1k28 s PRO 216 N -0.70 2.70 -0.30 3.49 0.04 -1.26 -4.90 135.00 134.08 1k28 s PRO 216 Ca 0.31 -0.08 -0.15 0.00 0.04 0.00 0.00 61.00 61.12 1k28 s PRO 216 Cb 0.28 -2.24 0.18 0.00 0.04 0.00 0.00 34.50 32.76 1k28 s PRO 216 CO -0.10 -0.87 1.15 -1.54 0.04 0.00 0.00 177.00 175.68 1k28 s SER 217 N -4.37 -0.14 -0.15 6.66 1.04 -1.26 -5.17 113.70 110.32 1k28 s SER 217 Ca 0.56 0.02 0.01 0.00 0.48 0.00 0.00 55.95 57.01 1k28 s SER 217 Cb -0.11 1.09 0.02 0.00 0.10 0.00 0.00 66.02 67.12 1k28 s SER 217 CO 0.45 -0.03 -0.16 -1.59 0.98 0.00 0.00 173.24 172.90 1k28 s LYS 227 N 2.99 2.45 -0.07 4.02 -2.85 -1.26 -5.31 119.74 119.70 1k28 s LYS 227 Ca 0.32 -0.62 0.01 0.00 -1.00 0.00 0.00 55.97 54.68 1k28 s LYS 227 Cb 0.00 -2.17 -0.03 0.00 -2.06 0.00 0.00 37.83 33.58 1k28 s LYS 227 CO -0.22 -0.19 -0.09 0.71 0.10 0.00 0.00 175.35 175.66 1k28 s TYR 228 N 1.32 2.87 0.61 1.78 2.02 -1.26 -5.09 117.35 119.60 1k28 s TYR 228 Ca 0.02 -0.06 -0.18 0.00 -0.37 0.00 0.00 57.07 56.48 1k28 s TYR 228 Cb -0.13 -1.70 -0.13 0.00 -0.40 0.00 0.00 41.96 39.60 1k28 s TYR 228 CO -0.09 0.26 -0.07 -2.30 -1.57 0.00 0.00 175.55 171.78 1k28 n PRO 229 N 2.34 0.10 -3.67 -1.71 -0.02 -1.26 -4.28 135.00 126.50 1k28 n PRO 229 Ca -0.18 0.04 -0.37 0.00 -2.02 0.00 0.00 63.50 60.97 1k28 n PRO 229 Cb 0.53 -1.18 -0.11 0.00 -0.02 0.00 0.00 33.50 32.71 1k28 n PRO 229 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1k28 s LEU 230 N 4.33 3.80 -0.38 2.45 2.01 -1.26 -1.43 118.68 128.20 1k28 s LEU 230 Ca 0.57 -0.07 -0.14 0.00 0.01 0.00 0.00 54.13 54.50 1k28 s LEU 230 Cb -0.43 -2.04 0.01 0.00 0.01 0.00 0.00 46.19 43.74 1k28 s LEU 230 CO 0.66 -0.03 0.27 0.00 1.01 0.00 0.00 176.35 178.25 1k28 s ALA 231 N 1.63 3.46 0.50 4.21 0.00 -0.80 -4.01 121.76 126.75 1k28 s ALA 231 Ca 0.07 -1.59 0.06 0.00 0.00 0.00 0.00 51.96 50.50 1k28 s ALA 231 Cb -0.15 -2.77 0.01 0.00 0.00 0.00 0.00 23.12 20.21 1k28 s ALA 231 CO 0.08 -1.26 0.36 1.52 0.00 0.00 0.00 175.76 176.45 1k28 s TYR 232 N 1.68 1.96 -1.48 0.00 -0.85 0.45 -4.64 117.35 114.48 1k28 s TYR 232 Ca 0.05 -0.75 -0.15 0.00 -0.52 0.00 0.00 57.07 55.71 1k28 s TYR 232 Cb -0.18 -1.96 0.12 0.00 0.38 0.00 0.00 41.96 40.32 1k28 s TYR 232 CO 0.10 -0.31 0.65 -0.25 -1.52 0.00 0.00 175.55 174.22 1k28 n ASP 233 N -1.64 -3.38 -4.68 -0.18 9.92 -1.26 0.01 116.55 115.34 1k28 n ASP 233 Ca -0.01 -0.71 -0.42 0.00 -0.53 0.00 0.00 54.79 53.11 1k28 n ASP 233 Cb 0.64 -2.79 -0.03 0.00 -0.64 0.00 0.00 41.12 38.31 1k28 n ASP 233 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1k28 s PHE 234 N -3.09 2.88 0.33 1.24 2.19 -1.26 -4.40 117.98 115.87 1k28 s PHE 234 Ca 0.59 0.92 0.07 0.00 0.33 0.00 0.00 56.93 58.84 1k28 s PHE 234 Cb -0.32 -3.58 -0.06 0.00 -1.31 0.00 0.00 43.02 37.74 1k28 s PHE 234 CO 0.72 -2.09 -0.05 0.08 1.83 0.00 0.00 175.22 175.72 1k28 s VAL 235 N 2.68 1.87 -0.62 3.12 1.01 0.28 -4.96 120.40 123.78 1k28 s VAL 235 Ca 0.61 -2.13 0.05 0.00 0.00 0.00 0.00 61.98 60.51 1k28 s VAL 235 Cb -0.28 -2.63 0.17 0.00 0.00 0.00 0.00 36.38 33.64 1k28 s VAL 235 CO 0.23 -0.19 0.45 0.79 0.00 0.00 0.00 175.10 176.38 1k28 n TRP 236 N -0.73 1.97 -0.34 5.22 8.01 -1.26 -2.28 117.44 128.03 1k28 n TRP 236 Ca -0.05 -4.00 0.21 0.00 -1.31 0.00 0.00 57.50 52.35 1k28 n TRP 236 Cb 0.64 -0.35 0.44 0.00 -2.01 0.00 0.00 31.31 30.03 1k28 n TRP 236 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.69 176.61 1k28 h LEU 237 N 5.43 0.59 -6.56 -0.99 -0.00 -1.67 -3.36 115.31 108.76 1k28 h LEU 237 Ca 0.19 0.15 -0.16 0.00 -0.00 0.00 0.00 57.88 58.06 1k28 h LEU 237 Cb 0.80 0.07 -0.30 0.00 -0.00 0.00 0.00 40.66 41.23 1k28 h LEU 237 CO 0.61 0.01 -0.48 -0.89 -0.00 0.00 0.00 178.44 177.69 1k28 s THR 238 N -5.69 -0.58 -0.21 0.22 2.01 -0.47 -4.99 115.64 105.93 1k28 s THR 238 Ca -0.10 -0.05 0.22 0.00 0.31 0.00 0.00 61.69 62.08 1k28 s THR 238 Cb 0.28 -0.78 -0.07 0.00 0.01 0.00 0.00 72.50 71.94 1k28 s THR 238 CO 0.80 -0.11 0.94 1.17 -0.69 0.00 0.00 174.62 176.72 1k28 n LYS 239 N 5.36 0.61 -3.53 4.92 4.81 -1.26 -0.57 118.16 128.50 1k28 n LYS 239 Ca -0.04 0.06 0.01 0.00 -0.87 0.00 0.00 58.31 57.46 1k28 n LYS 239 Cb 0.50 -1.76 -0.06 0.00 0.02 0.00 0.00 35.03 33.73 1k28 n LYS 239 CO 0.00 0.00 0.00 -1.12 1.17 0.00 0.00 177.40 177.45 1k28 s SER 240 N -5.16 -0.32 -0.26 3.14 0.01 -1.26 -4.66 113.70 105.19 1k28 s SER 240 Ca -0.02 0.49 0.00 0.00 1.31 0.00 0.00 55.95 57.73 1k28 s SER 240 Cb 0.11 1.23 0.07 0.00 0.21 0.00 0.00 66.02 67.64 1k28 s SER 240 CO 0.81 -0.07 0.01 0.21 0.41 0.00 0.00 173.24 174.61 1k28 s ASN 241 N 1.58 3.86 0.17 2.44 3.04 -1.26 -5.01 114.94 119.76 1k28 s ASN 241 Ca -0.06 -1.35 -0.08 0.00 0.04 0.00 0.00 52.86 51.41 1k28 s ASN 241 Cb -0.03 -1.06 0.04 0.00 -1.54 0.00 0.00 41.25 38.66 1k28 s ASN 241 CO -0.14 -0.31 1.52 -0.65 -3.04 0.00 0.00 177.10 174.48 1k28 h PRO 242 N 7.99 0.84 0.00 0.43 0.11 -1.98 -3.01 132.00 136.38 1k28 h PRO 242 Ca -0.15 -0.42 0.00 0.00 0.11 0.00 0.00 66.00 65.54 1k28 h PRO 242 Cb 1.06 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.18 1k28 h PRO 242 CO 0.43 1.06 0.50 1.58 -0.21 0.00 0.00 178.00 181.36 1k28 n HIS 243 N -4.06 0.20 0.00 0.65 -0.00 -1.26 -2.63 115.22 108.13 1k28 n HIS 243 Ca -0.02 0.10 0.00 0.00 0.46 0.00 0.00 57.72 58.26 1k28 n HIS 243 Cb 0.53 -0.31 0.00 0.00 -0.12 0.00 0.00 29.99 30.08 1k28 n HIS 243 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97 1k28 n LYS 244 N -1.80 0.00 -0.03 1.57 4.81 -1.24 -4.70 118.16 116.77 1k28 n LYS 244 Ca -0.00 0.00 0.23 0.00 -0.87 0.00 0.00 58.31 57.66 1k28 n LYS 244 Cb 0.51 -0.16 0.56 0.00 0.02 0.00 0.00 35.03 35.96 1k28 n LYS 244 CO 0.00 0.00 0.00 -0.09 1.17 0.00 0.00 177.40 178.48 1k28 h ARG 245 N 0.00 0.00 0.00 1.64 2.43 -1.47 -2.95 114.38 114.02 1k28 h ARG 245 Ca 0.00 0.00 -0.45 0.00 -0.81 0.00 0.00 59.98 58.72 1k28 h ARG 245 Cb 0.31 0.00 -0.07 0.00 -0.42 0.00 0.00 29.97 29.79 1k28 h ARG 245 CO 0.00 0.00 -2.51 -0.25 -1.51 0.00 0.00 179.97 175.70 1k28 n ASP 246 N -3.36 1.91 -2.55 -3.80 8.00 -1.08 -4.66 116.55 111.02 1k28 n ASP 246 Ca 0.14 0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.95 1k28 n ASP 246 Cb 1.07 -0.78 0.00 0.00 -0.02 0.00 0.00 41.12 41.40 1k28 n ASP 246 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 1k28 n PRO 247 N -4.16 0.00 0.00 -0.24 -0.02 -1.12 -3.71 135.00 125.76 1k28 n PRO 247 Ca -0.53 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 60.95 1k28 n PRO 247 Cb 0.88 -0.65 0.00 0.00 -0.02 0.00 0.00 33.50 33.71 1k28 n PRO 247 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 1k28 n LYS 249 N 1.30 0.00 -3.83 -0.52 5.02 -1.26 -4.19 118.16 114.68 1k28 n LYS 249 Ca 0.00 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.01 1k28 n LYS 249 Cb 0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 34.90 1k28 n LYS 249 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1k28 n ASN 250 N 0.00 3.17 -3.52 4.39 5.15 -1.24 -1.32 115.26 121.88 1k28 n ASN 250 Ca 0.00 -3.25 -0.11 0.00 -0.60 0.00 0.00 54.58 50.62 1k28 n ASN 250 Cb 0.00 -0.75 -0.04 0.00 -0.53 0.00 0.00 39.78 38.46 1k28 n ASN 250 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1k28 s ALA 251 N -1.62 -1.84 -0.04 5.20 0.00 -0.83 -2.07 121.76 120.56 1k28 s ALA 251 Ca 0.27 1.21 0.04 0.00 0.00 0.00 0.00 51.96 53.48 1k28 s ALA 251 Cb -0.02 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.09 1k28 s ALA 251 CO -0.15 -0.52 -0.16 0.99 0.00 0.00 0.00 175.76 175.92 1k28 s THR 252 N -2.22 2.93 -0.39 0.00 2.01 0.14 -1.41 115.64 116.71 1k28 s THR 252 Ca 0.00 -0.79 -0.09 0.00 0.31 0.00 0.00 61.69 61.13 1k28 s THR 252 Cb -0.01 -2.14 0.06 0.00 0.01 0.00 0.00 72.50 70.43 1k28 s THR 252 CO -0.03 0.58 0.22 -0.63 -0.69 0.00 0.00 174.62 174.07 1k28 s ILE 253 N -0.73 4.18 -0.13 1.82 1.01 0.14 -0.88 121.20 126.62 1k28 s ILE 253 Ca 0.11 -1.26 -0.19 0.00 0.00 0.00 0.00 60.65 59.32 1k28 s ILE 253 Cb -0.11 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.84 1k28 s ILE 253 CO 0.00 -0.39 0.51 -0.31 0.00 0.00 0.00 174.94 174.76 1k28 s TYR 254 N 1.44 3.49 -0.43 3.97 2.02 0.15 -2.14 117.35 125.85 1k28 s TYR 254 Ca 0.02 0.90 -0.14 0.00 -0.37 0.00 0.00 57.07 57.49 1k28 s TYR 254 Cb -0.22 -2.61 0.05 0.00 -0.40 0.00 0.00 41.96 38.78 1k28 s TYR 254 CO 0.03 0.09 0.31 0.00 -1.57 0.00 0.00 175.55 174.41 1k28 s ALA 255 N 0.89 3.44 -0.04 3.71 0.00 -0.45 -0.55 121.76 128.77 1k28 s ALA 255 Ca 0.27 -1.92 -0.02 0.00 0.00 0.00 0.00 51.96 50.29 1k28 s ALA 255 Cb -0.15 -2.86 -0.04 0.00 0.00 0.00 0.00 23.12 20.07 1k28 s ALA 255 CO 0.11 -1.57 0.08 -1.58 0.00 0.00 0.00 175.76 172.80 1k28 s HIS 256 N 1.60 3.33 -0.07 0.00 2.46 -0.56 -3.58 115.29 118.47 1k28 s HIS 256 Ca 0.04 0.27 -0.03 0.00 0.47 0.00 0.00 55.06 55.81 1k28 s HIS 256 Cb -0.21 -1.79 0.04 0.00 -0.13 0.00 0.00 32.58 30.48 1k28 s HIS 256 CO 0.07 0.57 0.16 0.45 -2.47 0.00 0.00 174.74 173.52 1k28 s SER 257 N -1.43 -0.13 0.52 9.88 0.15 -1.26 0.01 113.70 121.45 1k28 s SER 257 Ca 0.19 0.33 0.34 0.00 0.70 0.00 0.00 55.95 57.52 1k28 s SER 257 Cb -0.12 0.22 1.57 0.00 -1.71 0.00 0.00 66.02 65.98 1k28 s SER 257 CO 0.10 -0.15 2.02 -0.26 1.20 0.00 0.00 173.24 176.15 1k28 h PHE 258 N 7.22 0.00 0.00 3.44 0.04 -1.97 -3.04 116.94 122.62 1k28 h PHE 258 Ca -0.43 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.28 1k28 h PHE 258 Cb 1.14 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 39.28 1k28 h PHE 258 CO 0.42 0.00 -0.32 -0.07 -0.60 0.00 0.00 178.31 177.74 1k28 h LEU 259 N 0.00 0.00 -8.59 1.54 3.38 -1.95 -3.47 115.31 106.23 1k28 h LEU 259 Ca 0.00 0.00 -0.27 0.00 0.09 0.00 0.00 57.88 57.70 1k28 h LEU 259 Cb 0.33 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 40.95 1k28 h LEU 259 CO 0.00 0.32 -0.42 1.51 0.09 0.00 0.00 178.44 179.94 1k28 s ASP 260 N -6.33 0.61 -0.16 -0.43 1.47 -1.15 -5.06 116.67 105.61 1k28 s ASP 260 Ca 0.04 -1.41 0.17 0.00 1.18 0.00 0.00 52.55 52.52 1k28 s ASP 260 Cb 0.08 0.51 0.76 0.00 -0.34 0.00 0.00 42.92 43.93 1k28 s ASP 260 CO 0.70 -1.03 1.67 -1.54 0.68 0.00 0.00 175.17 175.65 1k28 n SER 261 N -0.81 5.12 -4.85 2.11 3.41 -1.26 -4.60 113.62 112.75 1k28 n SER 261 Ca 0.02 -2.63 -0.35 0.00 -0.26 0.00 0.00 58.87 55.66 1k28 n SER 261 Cb 0.64 -0.62 -0.06 0.00 -0.26 0.00 0.00 64.21 63.90 1k28 n SER 261 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1k28 s SER 262 N -0.84 6.12 -0.60 4.04 0.01 -1.26 -5.04 113.70 116.13 1k28 s SER 262 Ca 0.52 0.34 0.06 0.00 1.31 0.00 0.00 55.95 58.18 1k28 s SER 262 Cb 0.36 -1.90 0.23 0.00 0.21 0.00 0.00 66.02 64.92 1k28 s SER 262 CO 0.21 0.34 0.63 -0.38 0.41 0.00 0.00 173.24 174.46 1k28 n ILE 263 N 1.58 1.47 -0.29 1.44 5.41 -1.26 -4.50 119.36 123.20 1k28 n ILE 263 Ca -0.16 -4.83 -0.09 0.00 1.00 0.00 0.00 62.75 58.67 1k28 n ILE 263 Cb 0.54 -2.07 0.08 0.00 -0.71 0.00 0.00 39.64 37.49 1k28 n ILE 263 CO 0.00 0.00 0.00 -2.65 0.00 0.00 0.00 176.55 173.90 1k28 n PRO 264 N 1.30 -0.73 0.00 0.38 -0.02 -1.23 -4.54 135.00 130.15 1k28 n PRO 264 Ca 0.26 -0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.33 1k28 n PRO 264 Cb 0.42 -0.85 0.00 0.00 -0.02 0.00 0.00 33.50 33.06 1k28 n PRO 264 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1k28 n ILE 266 N -3.59 0.00 -4.22 4.25 5.41 -0.91 -1.33 119.36 118.97 1k28 n ILE 266 Ca 0.04 0.00 -0.19 0.00 1.00 0.00 0.00 62.75 63.59 1k28 n ILE 266 Cb 0.17 0.00 -0.12 0.00 -0.71 0.00 0.00 39.64 38.98 1k28 n ILE 266 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 176.55 176.83 1k28 s THR 267 N 0.00 1.30 0.11 1.39 -1.32 -1.26 0.28 115.64 116.14 1k28 s THR 267 Ca 0.00 -1.47 0.09 0.00 -1.21 0.00 0.00 61.69 59.10 1k28 s THR 267 Cb 0.00 -1.30 -0.04 0.00 -1.51 0.00 0.00 72.50 69.65 1k28 s THR 267 CO 0.00 -0.24 -0.23 0.42 -2.21 0.00 0.00 174.62 172.36 1k28 s THR 268 N -1.49 1.88 0.00 5.08 -4.23 -0.50 -4.99 115.64 111.39 1k28 s THR 268 Ca 0.03 -1.59 0.00 0.00 -1.18 0.00 0.00 61.69 58.95 1k28 s THR 268 Cb -0.09 -1.69 0.00 0.00 1.34 0.00 0.00 72.50 72.06 1k28 s THR 268 CO 0.03 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.72 1k28 n GLY 269 N 1.08 2.07 0.31 3.99 0.00 -0.44 -1.97 105.19 110.23 1k28 n GLY 269 Ca -0.19 -0.52 0.14 0.00 0.00 0.00 0.00 46.02 45.45 1k28 n GLY 269 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1k28 n LYS 270 N 9.57 1.24 -3.63 1.61 5.02 -1.26 -4.91 118.16 125.79 1k28 n LYS 270 Ca 0.00 -0.62 -0.27 0.00 -2.02 0.00 0.00 58.31 55.41 1k28 n LYS 270 Cb 0.00 -1.49 0.04 0.00 -0.02 0.00 0.00 35.03 33.56 1k28 n LYS 270 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1k28 n GLY 271 N 1.21 -0.51 0.14 0.72 0.00 -0.87 -4.86 105.19 101.01 1k28 n GLY 271 Ca 0.17 0.19 0.13 0.00 0.00 0.00 0.00 46.02 46.51 1k28 n GLY 271 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1k28 h GLU 272 N -1.97 0.00 -6.31 1.61 5.08 -1.86 -3.36 114.58 107.77 1k28 h GLU 272 Ca -0.55 0.00 -0.45 0.00 -1.00 0.00 0.00 59.36 57.36 1k28 h GLU 272 Cb 1.36 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.61 1k28 h GLU 272 CO 0.61 0.00 -0.34 -0.80 -1.00 0.00 0.00 179.01 177.48 1k28 s ASN 273 N -4.46 5.62 -0.01 1.42 0.02 -0.88 -4.98 114.94 111.68 1k28 s ASN 273 Ca 0.06 -0.39 -0.07 0.00 -1.02 0.00 0.00 52.86 51.43 1k28 s ASN 273 Cb 0.10 -0.93 0.00 0.00 0.02 0.00 0.00 41.25 40.44 1k28 s ASN 273 CO 0.46 -0.54 0.15 -0.94 0.02 0.00 0.00 177.10 176.25 1k28 s SER 274 N -4.18 -0.02 -0.04 -1.22 1.04 -1.26 -0.69 113.70 107.33 1k28 s SER 274 Ca 0.47 -0.10 -0.01 0.00 0.48 0.00 0.00 55.95 56.79 1k28 s SER 274 Cb -0.08 0.23 0.03 0.00 0.10 0.00 0.00 66.02 66.31 1k28 s SER 274 CO 0.30 -0.32 0.08 -0.63 0.98 0.00 0.00 173.24 173.65 1k28 s ILE 275 N -1.14 -0.08 -0.13 -1.02 1.01 -0.06 -4.92 121.20 114.86 1k28 s ILE 275 Ca -0.12 0.25 0.01 0.00 0.00 0.00 0.00 60.65 60.78 1k28 s ILE 275 Cb -0.06 -0.16 -0.01 0.00 0.01 0.00 0.00 42.46 42.24 1k28 s ILE 275 CO 0.01 0.10 -0.15 0.68 0.00 0.00 0.00 174.94 175.58 1k28 s VAL 276 N 1.37 2.81 0.16 2.92 -7.23 -1.26 0.35 120.40 119.52 1k28 s VAL 276 Ca -0.06 -0.74 0.08 0.00 -1.81 0.00 0.00 61.98 59.44 1k28 s VAL 276 Cb -0.12 -2.17 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 1k28 s VAL 276 CO -0.04 0.53 -0.05 0.68 -0.31 0.00 0.00 175.10 175.91 1k28 s VAL 277 N 0.42 3.51 0.11 1.32 -7.23 0.29 -4.94 120.40 113.88 1k28 s VAL 277 Ca -0.12 -1.45 0.00 0.00 -1.81 0.00 0.00 61.98 58.61 1k28 s VAL 277 Cb -0.16 -2.73 -0.04 0.00 0.56 0.00 0.00 36.38 34.01 1k28 s VAL 277 CO 0.05 -0.06 0.27 -0.55 -0.31 0.00 0.00 175.10 174.50 1k28 s SER 278 N -2.76 6.37 -0.29 4.85 0.15 -1.26 -1.50 113.70 119.26 1k28 s SER 278 Ca 0.26 0.28 0.18 0.00 0.70 0.00 0.00 55.95 57.36 1k28 s SER 278 Cb -0.10 -1.96 0.49 0.00 -1.71 0.00 0.00 66.02 62.74 1k28 s SER 278 CO 0.17 0.10 1.10 0.54 1.20 0.00 0.00 173.24 176.34 1k28 n ARG 279 N -0.12 2.10 -4.26 5.44 5.12 0.10 -4.85 116.66 120.19 1k28 n ARG 279 Ca -0.05 -3.66 -0.25 0.00 -1.93 0.00 0.00 57.85 51.96 1k28 n ARG 279 Cb 0.52 -1.72 -0.08 0.00 -1.16 0.00 0.00 32.46 30.03 1k28 n ARG 279 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 1k28 s SER 280 N -3.63 4.29 0.82 0.55 0.01 -1.26 -3.90 113.70 110.59 1k28 s SER 280 Ca 0.33 -1.08 0.00 0.00 1.31 0.00 0.00 55.95 56.51 1k28 s SER 280 Cb 0.37 -0.50 0.00 0.00 0.21 0.00 0.00 66.02 66.10 1k28 s SER 280 CO -0.02 -0.43 0.00 0.61 0.41 0.00 0.00 173.24 173.81 1k28 n GLY 281 N -1.11 2.93 0.28 3.44 0.00 -1.26 -0.57 105.19 108.90 1k28 n GLY 281 Ca -0.03 -0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.05 1k28 n GLY 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1k28 h ALA 282 N -0.43 1.87 0.00 4.61 0.00 -2.00 -1.24 119.26 122.06 1k28 h ALA 282 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1k28 h ALA 282 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1k28 h ALA 282 CO 0.00 -0.05 0.00 0.66 0.00 0.00 0.00 179.25 179.86 1k28 n TYR 283 N -4.28 0.00 1.06 0.00 4.01 0.27 -2.17 117.16 116.05 1k28 n TYR 283 Ca -0.02 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.84 1k28 n TYR 283 Cb 0.13 -0.23 0.59 0.00 -0.31 0.00 0.00 39.34 39.52 1k28 n TYR 283 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1k28 n SER 284 N -1.23 0.00 -4.32 7.72 3.41 -0.47 -4.46 113.62 114.26 1k28 n SER 284 Ca 0.12 0.16 -0.45 0.00 -0.26 0.00 0.00 58.87 58.45 1k28 n SER 284 Cb 0.16 -0.38 0.00 0.00 -0.26 0.00 0.00 64.21 63.74 1k28 n SER 284 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1k28 n GLU 285 N -1.38 3.60 -0.13 4.33 -0.58 -0.92 -4.71 120.64 120.84 1k28 n GLU 285 Ca 0.10 -4.33 -0.26 0.00 -0.42 0.00 0.00 57.16 52.25 1k28 n GLU 285 Cb 0.24 -2.65 -0.10 0.00 -0.57 0.00 0.00 31.44 28.35 1k28 n GLU 285 CO 0.00 0.00 0.00 2.41 -0.48 0.00 0.00 177.13 179.06 1k28 n THR 287 N 2.95 1.48 -4.76 2.62 -1.04 -1.26 -4.76 114.28 109.51 1k28 n THR 287 Ca 0.27 -0.43 -0.33 0.00 -2.04 0.00 0.00 64.05 61.52 1k28 n THR 287 Cb 0.39 -1.73 -0.12 0.00 -1.82 0.00 0.00 70.33 67.05 1k28 n THR 287 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1k28 s TYR 288 N -2.50 2.77 0.23 -1.42 2.02 -1.26 -2.74 117.35 114.46 1k28 s TYR 288 Ca -0.37 -0.11 -0.03 0.00 -0.37 0.00 0.00 57.07 56.20 1k28 s TYR 288 Cb 0.13 -1.63 0.25 0.00 -0.40 0.00 0.00 41.96 40.31 1k28 s TYR 288 CO 0.51 0.25 1.67 -0.09 -1.57 0.00 0.00 175.55 176.31 1k28 h ARG 289 N 5.15 0.71 -7.08 -0.62 9.65 -0.94 -3.44 114.38 117.81 1k28 h ARG 289 Ca -0.47 -0.27 -0.45 0.00 -1.10 0.00 0.00 59.98 57.69 1k28 h ARG 289 Cb 1.16 -0.04 0.07 0.00 -1.39 0.00 0.00 29.97 29.76 1k28 h ARG 289 CO 0.51 0.86 0.10 0.54 2.80 0.00 0.00 179.97 184.77 1k28 s ASN 290 N -6.75 4.94 0.00 -3.80 4.22 -1.25 -4.88 114.94 107.43 1k28 s ASN 290 Ca -0.09 0.15 -0.03 0.00 -2.14 0.00 0.00 52.86 50.76 1k28 s ASN 290 Cb 0.13 -0.87 -0.11 0.00 1.28 0.00 0.00 41.25 41.68 1k28 s ASN 290 CO 0.82 -1.44 1.89 0.61 -2.04 0.00 0.00 177.10 176.94 1k28 n GLY 291 N -2.66 1.92 0.00 0.45 0.00 -1.26 -4.57 105.19 99.07 1k28 n GLY 291 Ca 0.09 -0.51 0.00 0.00 0.00 0.00 0.00 46.02 45.60 1k28 n GLY 291 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1k28 n TYR 292 N 2.59 0.00 0.00 1.61 9.36 -1.26 0.19 117.16 129.65 1k28 n TYR 292 Ca 0.18 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.40 1k28 n TYR 292 Cb 0.43 -0.46 0.00 0.00 -0.63 0.00 0.00 39.34 38.68 1k28 n TYR 292 CO 0.00 0.00 0.00 -0.85 0.22 0.00 0.00 176.86 176.23 1k28 n GLU 293 N -1.88 0.00 -0.12 2.98 0.00 -1.26 -0.63 120.64 119.73 1k28 n GLU 293 Ca 0.00 0.27 -0.23 0.00 0.00 0.00 0.00 57.16 57.20 1k28 n GLU 293 Cb 0.00 -1.72 -0.10 0.00 0.00 0.00 0.00 31.44 29.62 1k28 n GLU 293 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 1k28 n GLU 294 N -1.26 0.56 0.27 3.44 4.71 -1.14 -3.92 120.64 123.29 1k28 n GLU 294 Ca 0.00 0.20 -0.18 0.00 -0.01 0.00 0.00 57.16 57.17 1k28 n GLU 294 Cb 0.22 -1.43 -0.10 0.00 -1.01 0.00 0.00 31.44 29.12 1k28 n GLU 294 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1k28 h ALA 295 N -0.54 -1.13 -0.92 0.62 0.00 0.22 0.42 119.26 117.93 1k28 h ALA 295 Ca -0.60 -0.18 0.26 0.00 0.00 0.00 0.00 54.91 54.39 1k28 h ALA 295 Cb 1.67 0.76 -0.15 0.00 0.00 0.00 0.00 17.79 20.07 1k28 h ALA 295 CO -0.27 -1.18 0.26 0.82 0.00 0.00 0.00 179.25 178.89 1k28 h ILE 296 N -0.97 0.25 -0.04 0.00 1.08 -1.13 0.98 117.51 117.68 1k28 h ILE 296 Ca -0.05 -0.06 -0.04 0.00 -0.39 0.00 0.00 64.86 64.31 1k28 h ILE 296 Cb 0.86 0.06 0.00 0.00 -3.07 0.00 0.00 36.82 34.66 1k28 h ILE 296 CO -0.10 0.03 -0.15 -0.09 -0.69 0.00 0.00 178.15 177.16 1k28 h ARG 297 N 0.18 0.17 0.00 2.37 2.43 -1.49 -3.19 114.38 114.84 1k28 h ARG 297 Ca 0.60 -0.13 -0.04 0.00 -0.81 0.00 0.00 59.98 59.60 1k28 h ARG 297 Cb 1.27 0.02 -0.01 0.00 -0.42 0.00 0.00 29.97 30.84 1k28 h ARG 297 CO -0.70 0.77 -0.19 -0.07 -1.51 0.00 0.00 179.97 178.28 1k28 h LEU 298 N -0.40 0.00 -2.19 3.80 3.38 0.13 -2.89 115.31 117.14 1k28 h LEU 298 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1k28 h LEU 298 Cb 0.79 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.54 1k28 h LEU 298 CO 0.03 0.19 0.00 0.00 0.09 0.00 0.00 178.44 178.75 1k28 n GLN 299 N -3.37 2.74 -0.14 1.13 6.02 0.32 -3.86 117.38 120.23 1k28 n GLN 299 Ca 0.00 -1.94 0.07 0.00 -0.01 0.00 0.00 57.00 55.12 1k28 n GLN 299 Cb 0.40 -1.64 0.10 0.00 1.02 0.00 0.00 30.24 30.12 1k28 n GLN 299 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 1k28 n THR 300 N 0.76 1.40 0.00 5.09 -1.04 -1.09 -4.81 114.28 114.59 1k28 n THR 300 Ca 0.18 -1.66 0.00 0.00 -2.04 0.00 0.00 64.05 60.53 1k28 n THR 300 Cb 0.61 0.01 0.00 0.00 -1.82 0.00 0.00 70.33 69.13 1k28 n THR 300 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1k28 n ALA 302 N -1.04 0.00 0.15 2.41 0.00 -1.25 -3.95 120.51 116.83 1k28 n ALA 302 Ca 0.11 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.58 1k28 n ALA 302 Cb 0.60 -0.01 0.11 0.00 0.00 0.00 0.00 19.45 20.15 1k28 n ALA 302 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1k28 h GLN 303 N 0.00 0.00 -3.29 0.00 4.20 -1.87 -3.36 115.11 110.79 1k28 h GLN 303 Ca 0.00 0.00 -0.75 0.00 0.06 0.00 0.00 58.65 57.96 1k28 h GLN 303 Cb 0.00 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 27.65 1k28 h GLN 303 CO 0.00 0.49 2.28 0.66 -0.67 0.00 0.00 178.83 181.59 1k28 n TYR 304 N -3.31 2.85 1.71 2.96 4.01 -1.25 -3.54 117.16 120.60 1k28 n TYR 304 Ca 0.01 -2.82 0.14 0.00 -0.16 0.00 0.00 57.90 55.07 1k28 n TYR 304 Cb 0.68 -1.98 0.68 0.00 -0.31 0.00 0.00 39.34 38.41 1k28 n TYR 304 CO 0.00 0.00 0.00 -0.40 -0.46 0.00 0.00 176.86 176.00 1k28 n ASP 305 N 3.46 0.80 -4.78 7.72 3.85 -1.22 -4.68 116.55 121.69 1k28 n ASP 305 Ca 0.48 -1.32 -0.38 0.00 -0.71 0.00 0.00 54.79 52.86 1k28 n ASP 305 Cb 0.33 -0.01 -0.06 0.00 -1.35 0.00 0.00 41.12 40.03 1k28 n ASP 305 CO 0.00 0.00 0.00 -0.83 -1.01 0.00 0.00 177.20 175.36 1k28 s GLY 306 N -1.92 2.51 -0.19 6.12 0.00 0.44 -4.28 107.32 110.01 1k28 s GLY 306 Ca 0.40 -0.12 -0.04 0.00 0.00 0.00 0.00 44.72 44.97 1k28 s GLY 306 CO 0.33 0.50 0.20 -0.47 0.00 0.00 0.00 173.10 173.66 1k28 s TYR 307 N -0.41 -0.21 -0.01 1.90 5.04 0.26 -0.60 117.35 123.31 1k28 s TYR 307 Ca 0.27 0.21 0.04 0.00 -2.44 0.00 0.00 57.07 55.15 1k28 s TYR 307 Cb -0.17 -0.38 -0.01 0.00 0.35 0.00 0.00 41.96 41.75 1k28 s TYR 307 CO 0.14 -0.55 -0.13 0.00 -1.34 0.00 0.00 175.55 173.67 1k28 s ALA 308 N 2.30 1.09 -0.10 3.97 0.00 -1.26 -1.37 121.76 126.40 1k28 s ALA 308 Ca 0.06 -0.55 0.04 0.00 0.00 0.00 0.00 51.96 51.50 1k28 s ALA 308 Cb -0.15 -0.29 0.00 0.00 0.00 0.00 0.00 23.12 22.68 1k28 s ALA 308 CO -0.11 0.26 -0.23 -1.59 0.00 0.00 0.00 175.76 174.09 1k28 s LYS 309 N -0.25 2.90 0.00 0.00 -2.85 -0.97 -4.57 119.74 114.01 1k28 s LYS 309 Ca 0.04 -0.83 0.00 0.00 -1.00 0.00 0.00 55.97 54.18 1k28 s LYS 309 Cb -0.06 -2.22 0.00 0.00 -2.06 0.00 0.00 37.83 33.50 1k28 s LYS 309 CO -0.00 0.15 0.00 0.00 0.10 0.00 0.00 175.35 175.59 1k28 s SER 311 N 0.20 -0.47 0.44 0.00 0.01 0.10 -2.83 113.70 111.14 1k28 s SER 311 Ca 0.00 0.85 0.07 0.00 1.31 0.00 0.00 55.95 58.18 1k28 s SER 311 Cb 0.00 0.77 -0.02 0.00 0.21 0.00 0.00 66.02 66.97 1k28 s SER 311 CO 0.00 -0.18 0.29 0.28 0.41 0.00 0.00 173.24 174.05 1k28 s THR 312 N 1.03 2.32 0.00 1.44 -1.32 -0.49 0.17 115.64 118.79 1k28 s THR 312 Ca -0.07 -1.53 0.00 0.00 -1.21 0.00 0.00 61.69 58.88 1k28 s THR 312 Cb -0.07 -2.85 0.00 0.00 -1.51 0.00 0.00 72.50 68.07 1k28 s THR 312 CO -0.08 0.00 0.87 -0.38 -2.21 0.00 0.00 174.62 172.81 1k28 n ILE 313 N -1.44 0.00 -3.30 5.08 -0.00 -1.26 -3.22 119.36 115.22 1k28 n ILE 313 Ca 0.00 1.37 0.03 0.00 -0.00 0.00 0.00 62.75 64.15 1k28 n ILE 313 Cb 0.63 -2.30 -0.04 0.00 -0.00 0.00 0.00 39.64 37.94 1k28 n ILE 313 CO 0.00 0.00 0.00 -0.83 -0.00 0.00 0.00 176.55 175.72 1k28 s GLY 314 N -0.74 0.03 -0.25 7.39 0.00 -1.26 -2.89 107.32 109.60 1k28 s GLY 314 Ca 0.00 3.33 -0.03 0.00 0.00 0.00 0.00 44.72 48.02 1k28 s GLY 314 CO 0.00 3.31 0.40 0.21 0.00 0.00 0.00 173.10 177.02 1k28 s ASN 315 N 2.27 0.10 0.00 1.64 3.04 -1.26 -4.68 114.94 116.05 1k28 s ASN 315 Ca -0.01 0.30 0.00 0.00 0.04 0.00 0.00 52.86 53.19 1k28 s ASN 315 Cb -0.04 1.21 0.00 0.00 -1.54 0.00 0.00 41.25 40.88 1k28 s ASN 315 CO -0.17 -0.29 0.53 0.49 -3.04 0.00 0.00 177.10 174.61 1k28 n PHE 316 N 5.37 0.00 -0.01 0.43 3.72 -1.26 -2.48 117.46 123.22 1k28 n PHE 316 Ca -0.04 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.42 1k28 n PHE 316 Cb 0.50 -0.09 -0.12 0.00 -0.94 0.00 0.00 39.48 38.84 1k28 n PHE 316 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1k28 n ASN 317 N -0.03 1.58 -4.55 4.37 3.02 -1.26 -4.86 115.26 113.52 1k28 n ASN 317 Ca 0.00 0.00 -0.39 0.00 -0.03 0.00 0.00 54.58 54.16 1k28 n ASN 317 Cb 0.22 1.58 -0.03 0.00 -0.61 0.00 0.00 39.78 40.93 1k28 n ASN 317 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1k28 s LEU 318 N -4.17 3.30 0.30 3.41 1.02 -1.04 -4.96 118.68 116.55 1k28 s LEU 318 Ca -0.06 0.37 0.09 0.00 0.02 0.00 0.00 54.13 54.55 1k28 s LEU 318 Cb 0.09 -2.61 -0.04 0.00 0.02 0.00 0.00 46.19 43.65 1k28 s LEU 318 CO 0.62 -2.30 0.10 0.42 0.02 0.00 0.00 176.35 175.20 1k28 s THR 319 N 8.76 3.36 0.35 5.49 -4.23 -1.26 -4.86 115.64 123.25 1k28 s THR 319 Ca 0.67 -1.74 -0.27 0.00 -1.18 0.00 0.00 61.69 59.17 1k28 s THR 319 Cb -0.13 -2.98 -0.09 0.00 1.34 0.00 0.00 72.50 70.64 1k28 s THR 319 CO 0.21 -0.27 1.13 -2.16 -0.54 0.00 0.00 174.62 172.99 1k28 s PRO 320 N -3.78 4.30 0.00 3.99 0.04 -1.26 -3.37 135.00 134.92 1k28 s PRO 320 Ca 0.35 1.79 0.00 0.00 0.04 0.00 0.00 61.00 63.18 1k28 s PRO 320 Cb -0.05 -2.86 0.00 0.00 0.04 0.00 0.00 34.50 31.64 1k28 s PRO 320 CO 0.22 -0.09 0.00 0.41 0.04 0.00 0.00 177.00 177.58 1k28 n GLY 321 N 0.78 0.73 3.76 0.56 0.00 0.98 -4.95 105.19 107.06 1k28 n GLY 321 Ca 0.02 -0.29 -0.28 0.00 0.00 0.00 0.00 46.02 45.46 1k28 n GLY 321 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1k28 s VAL 322 N -2.00 4.35 0.10 1.61 0.11 -1.22 -4.89 120.40 118.47 1k28 s VAL 322 Ca 0.00 -0.98 -0.17 0.00 -2.93 0.00 0.00 61.98 57.90 1k28 s VAL 322 Cb 0.00 -3.15 -0.07 0.00 -1.53 0.00 0.00 36.38 31.63 1k28 s VAL 322 CO 0.00 0.02 0.55 -0.75 -3.33 0.00 0.00 175.10 171.59 1k28 s LYS 323 N -2.69 4.09 -0.24 1.54 2.20 -1.26 -1.77 119.74 121.60 1k28 s LYS 323 Ca 0.29 0.62 -0.03 0.00 -0.36 0.00 0.00 55.97 56.48 1k28 s LYS 323 Cb -0.11 -3.10 0.10 0.00 -1.51 0.00 0.00 37.83 33.21 1k28 s LYS 323 CO 0.22 0.57 0.20 0.42 -0.36 0.00 0.00 175.35 176.40 1k28 s ILE 324 N -1.26 -0.26 0.15 5.43 1.01 -0.03 -1.60 121.20 124.64 1k28 s ILE 324 Ca 0.32 -0.35 -0.13 0.00 0.00 0.00 0.00 60.65 60.49 1k28 s ILE 324 Cb -0.17 -0.80 -0.07 0.00 0.01 0.00 0.00 42.46 41.42 1k28 s ILE 324 CO 0.19 -0.39 0.53 -0.51 0.00 0.00 0.00 174.94 174.75 1k28 s ILE 325 N 2.26 4.90 -0.08 2.92 -1.16 -1.22 -1.63 121.20 127.20 1k28 s ILE 325 Ca 0.07 0.72 0.03 0.00 -0.51 0.00 0.00 60.65 60.96 1k28 s ILE 325 Cb -0.15 -3.71 -0.02 0.00 0.61 0.00 0.00 42.46 39.19 1k28 s ILE 325 CO -0.22 0.21 -0.15 -0.36 -2.81 0.00 0.00 174.94 171.60 1k28 s PHE 326 N -1.50 2.70 -0.11 3.50 0.08 -1.26 -4.02 117.98 117.37 1k28 s PHE 326 Ca 0.38 -0.39 -0.03 0.00 0.12 0.00 0.00 56.93 57.02 1k28 s PHE 326 Cb -0.14 -1.70 -0.03 0.00 -0.57 0.00 0.00 43.02 40.58 1k28 s PHE 326 CO 0.19 0.00 -0.01 -0.80 -0.10 0.00 0.00 175.22 174.50 1k28 s ASN 327 N -0.30 5.08 0.09 1.36 -0.87 -1.26 -4.65 114.94 114.38 1k28 s ASN 327 Ca 0.02 0.04 -0.09 0.00 -1.57 0.00 0.00 52.86 51.26 1k28 s ASN 327 Cb -0.13 -1.57 -0.00 0.00 -0.02 0.00 0.00 41.25 39.53 1k28 s ASN 327 CO 0.03 0.30 0.19 -0.62 -2.57 0.00 0.00 177.10 174.43 1k28 s ASP 328 N -0.40 0.11 0.05 -1.22 2.15 -1.26 -2.65 116.67 113.45 1k28 s ASP 328 Ca 0.07 -0.64 -0.01 0.00 0.43 0.00 0.00 52.55 52.40 1k28 s ASP 328 Cb -0.12 0.34 -0.27 0.00 -0.30 0.00 0.00 42.92 42.57 1k28 s ASP 328 CO 0.02 -0.73 1.02 -1.28 -0.17 0.00 0.00 175.17 174.03 1k28 h SER 329 N 2.76 0.32 0.82 -0.34 0.87 -1.90 -3.28 113.55 112.80 1k28 h SER 329 Ca -0.34 -0.39 0.00 0.00 -1.23 0.00 0.00 61.79 59.83 1k28 h SER 329 Cb 1.20 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 1k28 h SER 329 CO 0.56 1.32 -0.71 0.50 -0.53 0.00 0.00 176.83 177.97 1k28 h LYS 330 N 0.06 0.00 -5.88 2.24 1.63 -1.96 -3.49 116.57 109.17 1k28 h LYS 330 Ca -0.17 0.00 -0.18 0.00 -0.85 0.00 0.00 60.65 59.45 1k28 h LYS 330 Cb 1.96 0.00 0.01 0.00 -0.60 0.00 0.00 32.23 33.60 1k28 h LYS 330 CO 0.17 0.00 -0.75 0.09 -3.45 0.00 0.00 179.45 175.50 1k28 n ASN 331 N -2.14 -6.79 -0.39 4.20 3.02 -1.24 -4.94 115.26 106.98 1k28 n ASN 331 Ca 0.03 0.09 0.06 0.00 -0.03 0.00 0.00 54.58 54.72 1k28 n ASN 331 Cb 0.45 -3.72 0.03 0.00 -0.61 0.00 0.00 39.78 35.93 1k28 n ASN 331 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1k28 n GLN 332 N -0.64 1.17 -3.24 3.52 6.02 -1.26 -4.89 117.38 118.06 1k28 n GLN 332 Ca -0.01 -1.00 -0.03 0.00 -0.01 0.00 0.00 57.00 55.96 1k28 n GLN 332 Cb 0.57 -1.19 -0.03 0.00 1.02 0.00 0.00 30.24 30.61 1k28 n GLN 332 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 177.06 175.46 1k28 s PHE 333 N -1.17 -1.38 -1.35 1.08 -0.71 -1.26 -4.98 117.98 108.21 1k28 s PHE 333 Ca 0.12 0.68 0.12 0.00 -1.04 0.00 0.00 56.93 56.82 1k28 s PHE 333 Cb 0.10 0.06 0.20 0.00 -1.21 0.00 0.00 43.02 42.17 1k28 s PHE 333 CO 0.20 -1.02 1.05 1.17 -1.34 0.00 0.00 175.22 175.28 1k28 n LYS 334 N 5.38 1.59 -3.64 1.99 3.00 -1.26 -4.45 118.16 120.77 1k28 n LYS 334 Ca 0.02 -1.60 -0.38 0.00 -0.00 0.00 0.00 58.31 56.36 1k28 n LYS 334 Cb 0.51 -1.26 -0.11 0.00 0.00 0.00 0.00 35.03 34.16 1k28 n LYS 334 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.40 178.35 1k28 s THR 335 N -1.02 4.99 0.31 3.15 -4.23 -1.26 -4.95 115.64 112.63 1k28 s THR 335 Ca 0.19 0.05 -0.28 0.00 -1.18 0.00 0.00 61.69 60.46 1k28 s THR 335 Cb 0.12 -3.37 -0.13 0.00 1.34 0.00 0.00 72.50 70.46 1k28 s THR 335 CO 0.16 0.27 1.22 -1.84 -0.54 0.00 0.00 174.62 173.89 1k28 n GLU 336 N 5.02 1.88 -3.95 3.99 0.28 -1.26 -4.80 120.64 121.81 1k28 n GLU 336 Ca -0.15 0.66 -0.22 0.00 -0.16 0.00 0.00 57.16 57.30 1k28 n GLU 336 Cb 0.52 -2.19 -0.04 0.00 1.43 0.00 0.00 31.44 31.15 1k28 n GLU 336 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1k28 s PHE 337 N -0.98 2.89 -0.07 -1.84 0.40 -0.64 -4.65 117.98 113.09 1k28 s PHE 337 Ca 0.58 -0.28 0.01 0.00 -0.60 0.00 0.00 56.93 56.64 1k28 s PHE 337 Cb -0.62 -1.67 0.02 0.00 0.51 0.00 0.00 43.02 41.26 1k28 s PHE 337 CO 0.60 0.29 -0.09 0.71 0.70 0.00 0.00 175.22 177.44 1k28 s TYR 338 N -2.30 1.22 -0.12 0.36 1.51 -0.84 -0.85 117.35 116.32 1k28 s TYR 338 Ca 0.38 -0.46 -0.29 0.00 -1.01 0.00 0.00 57.07 55.69 1k28 s TYR 338 Cb -0.05 -0.97 -0.06 0.00 -0.11 0.00 0.00 41.96 40.77 1k28 s TYR 338 CO 0.25 -0.30 1.91 0.08 -1.11 0.00 0.00 175.55 176.39 1k28 s VAL 339 N 0.98 3.26 -0.06 0.71 1.01 -0.73 -1.71 120.40 123.87 1k28 s VAL 339 Ca -0.09 0.30 -0.23 0.00 0.00 0.00 0.00 61.98 61.96 1k28 s VAL 339 Cb -0.15 -3.26 -0.30 0.00 0.00 0.00 0.00 36.38 32.68 1k28 s VAL 339 CO 0.00 -0.10 0.90 -0.78 0.00 0.00 0.00 175.10 175.13 1k28 h ASP 340 N 11.86 0.40 -3.21 3.32 3.58 0.38 0.28 116.42 133.04 1k28 h ASP 340 Ca -0.42 -0.94 0.04 0.00 0.42 0.00 0.00 57.03 56.13 1k28 h ASP 340 Cb 1.21 -0.13 -0.24 0.00 1.72 0.00 0.00 39.33 41.89 1k28 h ASP 340 CO 0.97 1.31 0.25 -1.83 -2.88 0.00 0.00 179.24 177.06 1k28 s GLU 341 N -2.50 0.61 -0.04 0.28 -1.05 -0.94 -0.21 118.70 114.86 1k28 s GLU 341 Ca -0.14 0.86 0.00 0.00 -0.15 0.00 0.00 54.97 55.54 1k28 s GLU 341 Cb 0.01 0.22 -0.03 0.00 -0.44 0.00 0.00 34.13 33.89 1k28 s GLU 341 CO 0.81 -0.10 0.00 0.54 0.95 0.00 0.00 175.26 177.47 1k28 s VAL 342 N 0.85 4.23 -0.32 1.83 0.11 -1.13 -1.50 120.40 124.46 1k28 s VAL 342 Ca -0.03 -0.45 0.03 0.00 -2.93 0.00 0.00 61.98 58.60 1k28 s VAL 342 Cb -0.05 -2.84 0.09 0.00 -1.53 0.00 0.00 36.38 32.05 1k28 s VAL 342 CO -0.10 0.47 0.02 -0.63 -3.33 0.00 0.00 175.10 171.54 1k28 s ILE 343 N -1.00 2.09 -0.07 7.04 1.01 -0.04 -2.05 121.20 128.17 1k28 s ILE 343 Ca 0.17 -2.08 -0.29 0.00 0.00 0.00 0.00 60.65 58.44 1k28 s ILE 343 Cb -0.11 -2.48 -0.02 0.00 0.01 0.00 0.00 42.46 39.86 1k28 s ILE 343 CO 0.07 -0.49 0.98 -1.00 0.00 0.00 0.00 174.94 174.51 1k28 s HIS 344 N 1.03 3.56 -0.26 3.97 3.76 -1.26 -1.86 115.29 124.23 1k28 s HIS 344 Ca 0.07 1.61 0.01 0.00 -0.15 0.00 0.00 55.06 56.60 1k28 s HIS 344 Cb -0.19 -3.15 0.07 0.00 1.11 0.00 0.00 32.58 30.43 1k28 s HIS 344 CO -0.09 -0.14 -0.00 -2.00 -0.85 0.00 0.00 174.74 171.65 1k28 s GLU 345 N 1.63 1.38 0.04 1.40 2.12 0.52 -4.22 118.70 121.57 1k28 s GLU 345 Ca 0.49 -1.11 -0.02 0.00 0.36 0.00 0.00 54.97 54.69 1k28 s GLU 345 Cb -0.19 -2.55 -0.03 0.00 0.26 0.00 0.00 34.13 31.62 1k28 s GLU 345 CO 0.21 -0.73 -0.00 -0.48 -0.54 0.00 0.00 175.26 173.73 1k28 s LEU 346 N 1.39 2.29 0.00 2.70 2.34 -0.82 0.04 118.68 126.62 1k28 s LEU 346 Ca -0.00 -0.82 0.00 0.00 0.06 0.00 0.00 54.13 53.37 1k28 s LEU 346 Cb -0.18 0.28 0.00 0.00 -0.56 0.00 0.00 46.19 45.72 1k28 s LEU 346 CO -0.10 -0.53 0.00 -1.54 -1.06 0.00 0.00 176.35 173.12 1k28 n SER 347 N 0.49 1.64 -2.22 1.48 3.41 -1.07 0.96 113.62 118.31 1k28 n SER 347 Ca -0.17 -0.83 -0.22 0.00 -0.26 0.00 0.00 58.87 57.40 1k28 n SER 347 Cb 0.60 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 1k28 n SER 347 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1k28 n ASN 348 N -1.12 6.35 0.00 4.04 0.23 -1.26 -3.79 115.26 119.72 1k28 n ASN 348 Ca 0.00 -3.09 0.00 0.00 -0.53 0.00 0.00 54.58 50.96 1k28 n ASN 348 Cb 0.00 -1.19 0.00 0.00 -2.08 0.00 0.00 39.78 36.51 1k28 n ASN 348 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 1k28 n ASN 349 N 0.83 0.00 -0.90 0.53 0.23 -1.26 -5.04 115.26 109.66 1k28 n ASN 349 Ca 0.41 0.00 0.00 0.00 -0.53 0.00 0.00 54.58 54.46 1k28 n ASN 349 Cb 0.59 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.29 1k28 n ASN 349 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1k28 n ASN 350 N -0.42 0.00 -3.63 0.53 5.15 -1.25 -4.66 115.26 110.99 1k28 n ASN 350 Ca 0.00 -0.90 -0.12 0.00 -0.60 0.00 0.00 54.58 52.97 1k28 n ASN 350 Cb 0.00 0.00 -0.07 0.00 -0.53 0.00 0.00 39.78 39.18 1k28 n ASN 350 CO 0.00 0.00 0.00 -0.94 1.40 0.00 0.00 177.26 177.72 1k28 s SER 351 N -0.71 -0.60 -0.13 1.20 1.04 0.12 -2.59 113.70 112.02 1k28 s SER 351 Ca 0.00 1.16 0.02 0.00 0.48 0.00 0.00 55.95 57.60 1k28 s SER 351 Cb 0.00 1.17 0.01 0.00 0.10 0.00 0.00 66.02 67.31 1k28 s SER 351 CO 0.00 -0.20 -0.18 0.54 0.98 0.00 0.00 173.24 174.38 1k28 s VAL 352 N 0.29 1.73 -0.18 5.02 0.11 0.11 -4.12 120.40 123.36 1k28 s VAL 352 Ca 0.01 -0.77 -0.12 0.00 -2.93 0.00 0.00 61.98 58.18 1k28 s VAL 352 Cb -0.05 -1.57 -0.05 0.00 -1.53 0.00 0.00 36.38 33.18 1k28 s VAL 352 CO -0.02 0.49 0.21 -0.89 -3.33 0.00 0.00 175.10 171.55 1k28 s THR 353 N 1.03 5.36 -0.06 5.04 2.01 -1.14 -0.36 115.64 127.53 1k28 s THR 353 Ca -0.04 0.36 0.03 0.00 0.31 0.00 0.00 61.69 62.35 1k28 s THR 353 Cb -0.15 -3.55 -0.03 0.00 0.01 0.00 0.00 72.50 68.79 1k28 s THR 353 CO -0.04 0.42 -0.13 -1.00 -0.69 0.00 0.00 174.62 173.19 1k28 s HIS 354 N 0.34 2.76 -0.22 4.92 3.76 -0.78 -1.39 115.29 124.68 1k28 s HIS 354 Ca 0.12 -0.14 0.01 0.00 -0.15 0.00 0.00 55.06 54.91 1k28 s HIS 354 Cb -0.12 -1.66 0.05 0.00 1.11 0.00 0.00 32.58 31.97 1k28 s HIS 354 CO 0.01 0.20 -0.07 -0.51 -0.85 0.00 0.00 174.74 173.53 1k28 s LEU 355 N -0.71 2.42 0.07 0.89 1.43 -1.13 -0.86 118.68 120.79 1k28 s LEU 355 Ca 0.11 -1.05 -0.08 0.00 -1.03 0.00 0.00 54.13 52.08 1k28 s LEU 355 Cb -0.11 -1.18 -0.05 0.00 0.03 0.00 0.00 46.19 44.88 1k28 s LEU 355 CO 0.01 -0.20 0.35 -0.31 0.23 0.00 0.00 176.35 176.43 1k28 s TYR 356 N 1.41 3.55 -0.15 0.29 1.51 -0.56 -2.40 117.35 121.00 1k28 s TYR 356 Ca -0.04 0.66 -0.29 0.00 -1.01 0.00 0.00 57.07 56.39 1k28 s TYR 356 Cb -0.18 -2.07 0.10 0.00 -0.11 0.00 0.00 41.96 39.71 1k28 s TYR 356 CO -0.07 0.53 0.87 -0.59 -1.11 0.00 0.00 175.55 175.18 1k28 s PHE 358 N -1.43 -0.52 0.29 2.71 -0.12 -0.69 0.11 117.98 118.32 1k28 s PHE 358 Ca 0.33 1.00 -0.11 0.00 -0.05 0.00 0.00 56.93 58.10 1k28 s PHE 358 Cb -0.13 0.41 0.01 0.00 -0.63 0.00 0.00 43.02 42.67 1k28 s PHE 358 CO 0.19 -0.42 0.54 -0.08 -0.05 0.00 0.00 175.22 175.40 1k28 s THR 359 N -0.80 0.00 0.19 -4.49 -1.32 0.23 -1.99 115.64 107.46 1k28 s THR 359 Ca -0.04 -1.36 -0.20 0.00 -1.21 0.00 0.00 61.69 58.88 1k28 s THR 359 Cb -0.01 -2.39 -0.08 0.00 -1.51 0.00 0.00 72.50 68.50 1k28 s THR 359 CO 0.03 0.00 0.70 0.54 -2.21 0.00 0.00 174.62 173.68 1k28 s ASN 360 N -3.07 7.07 0.00 8.08 6.03 -1.26 -0.42 114.94 131.36 1k28 s ASN 360 Ca 0.23 1.39 0.22 0.00 -1.03 0.00 0.00 52.86 53.67 1k28 s ASN 360 Cb -0.02 -2.41 0.54 0.00 -3.03 0.00 0.00 41.25 36.34 1k28 s ASN 360 CO 0.12 0.08 1.45 0.00 -2.03 0.00 0.00 177.10 176.72 1k28 n ALA 361 N 0.91 2.46 0.00 3.54 0.00 -1.23 -4.88 120.51 121.32 1k28 n ALA 361 Ca -0.04 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.62 1k28 n ALA 361 Cb 0.51 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 19.00 1k28 n ALA 361 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1k28 n THR 362 N 1.01 0.00 -4.14 0.00 5.66 -1.26 -5.14 114.28 110.41 1k28 n THR 362 Ca 0.18 0.00 -0.26 0.00 -3.05 0.00 0.00 64.05 60.92 1k28 n THR 362 Cb 0.50 0.00 -0.06 0.00 -1.55 0.00 0.00 70.33 69.21 1k28 n THR 362 CO 0.00 0.00 0.00 -0.75 -3.05 0.00 0.00 175.07 171.27 1k28 s LYS 363 N -0.22 2.69 -0.22 1.09 2.20 -1.26 -4.96 119.74 119.06 1k28 s LYS 363 Ca 0.00 -1.01 -0.27 0.00 -0.36 0.00 0.00 55.97 54.33 1k28 s LYS 363 Cb 0.00 -2.50 0.13 0.00 -1.51 0.00 0.00 37.83 33.94 1k28 s LYS 363 CO 0.00 0.46 1.02 -1.17 -0.36 0.00 0.00 175.35 175.30 1k28 s LEU 364 N -3.18 -0.41 0.33 5.43 1.98 -1.26 -5.16 118.68 116.42 1k28 s LEU 364 Ca 0.30 0.63 -0.29 0.00 -2.89 0.00 0.00 54.13 51.89 1k28 s LEU 364 Cb -0.09 1.86 -0.12 0.00 0.66 0.00 0.00 46.19 48.50 1k28 s LEU 364 CO 0.22 -0.24 1.47 -1.84 -1.89 0.00 0.00 176.35 174.07 1k28 n GLU 365 N 1.50 2.52 0.00 1.98 0.00 -1.26 -4.92 120.64 120.45 1k28 n GLU 365 Ca -0.11 0.89 0.00 0.00 0.00 0.00 0.00 57.16 57.93 1k28 n GLU 365 Cb 0.57 -2.60 0.00 0.00 0.00 0.00 0.00 31.44 29.41 1k28 n GLU 365 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.13 174.76 1k28 n THR 366 N 1.04 0.00 0.41 3.84 5.66 -1.26 -4.92 114.28 119.05 1k28 n THR 366 Ca 0.05 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.05 1k28 n THR 366 Cb 0.37 0.67 0.00 0.00 -1.55 0.00 0.00 70.33 69.81 1k28 n THR 366 CO 0.00 0.00 0.00 -0.38 -3.05 0.00 0.00 175.07 171.64 1k28 n ILE 367 N 0.00 0.32 -2.43 1.09 2.08 -1.26 -3.68 119.36 115.48 1k28 n ILE 367 Ca 0.00 0.00 0.03 0.00 0.56 0.00 0.00 62.75 63.34 1k28 n ILE 367 Cb 0.00 -0.60 0.05 0.00 -0.75 0.00 0.00 39.64 38.34 1k28 n ILE 367 CO 0.00 0.00 0.00 0.47 0.56 0.00 0.00 176.55 177.58 1k28 n ASP 368 N 0.69 1.25 -4.64 4.38 10.43 -1.26 -5.05 116.55 122.34 1k28 n ASP 368 Ca 0.00 -2.27 -0.43 0.00 2.57 0.00 0.00 54.79 54.66 1k28 n ASP 368 Cb 0.18 -0.35 -0.02 0.00 1.84 0.00 0.00 41.12 42.77 1k28 n ASP 368 CO 0.00 0.00 0.00 -2.16 -1.07 0.00 0.00 177.20 173.97 1k28 s PRO 369 N -0.98 3.94 -0.07 -0.24 0.04 -1.24 -4.84 135.00 131.60 1k28 s PRO 369 Ca 0.34 1.57 -0.12 0.00 0.04 0.00 0.00 61.00 62.82 1k28 s PRO 369 Cb 0.38 -3.94 -0.06 0.00 0.04 0.00 0.00 34.50 30.93 1k28 s PRO 369 CO -0.14 -1.11 0.38 1.33 0.04 0.00 0.00 177.00 177.51 1k28 n VAL 370 N 6.10 0.00 -4.55 -0.36 0.24 -1.26 -4.92 118.33 113.59 1k28 n VAL 370 Ca 0.16 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 62.13 1k28 n VAL 370 Cb 0.45 -0.07 -0.13 0.00 -1.47 0.00 0.00 33.84 32.62 1k28 n VAL 370 CO 0.00 0.00 0.00 -1.59 -2.14 0.00 0.00 176.83 173.10 1k28 s LYS 371 N 0.45 3.50 -0.35 7.34 -2.85 -1.26 -4.85 119.74 121.72 1k28 s LYS 371 Ca 0.27 -0.57 -0.06 0.00 -1.00 0.00 0.00 55.97 54.61 1k28 s LYS 371 Cb -0.39 -2.79 0.05 0.00 -2.06 0.00 0.00 37.83 32.64 1k28 s LYS 371 CO 0.20 0.27 0.11 0.08 0.10 0.00 0.00 175.35 176.12 1k28 s VAL 372 N 0.24 3.71 0.51 1.79 1.01 -1.26 -5.07 120.40 121.33 1k28 s VAL 372 Ca -0.05 -1.24 -0.23 0.00 0.00 0.00 0.00 61.98 60.46 1k28 s VAL 372 Cb -0.14 -3.15 -0.07 0.00 0.00 0.00 0.00 36.38 33.02 1k28 s VAL 372 CO 0.04 -0.23 1.29 1.17 0.00 0.00 0.00 175.10 177.36 1k28 n LYS 373 N 4.79 1.71 -3.27 2.72 4.81 -1.26 -0.45 118.16 127.20 1k28 n LYS 373 Ca -0.12 0.62 -0.38 0.00 -0.87 0.00 0.00 58.31 57.56 1k28 n LYS 373 Cb 0.44 -2.47 -0.06 0.00 0.02 0.00 0.00 35.03 32.96 1k28 n LYS 373 CO 0.00 0.00 0.00 1.21 1.17 0.00 0.00 177.40 179.78 1k28 s ASN 374 N -0.81 6.80 0.00 3.14 3.04 -1.11 -4.28 114.94 121.73 1k28 s ASN 374 Ca 0.68 0.96 0.00 0.00 0.04 0.00 0.00 52.86 54.54 1k28 s ASN 374 Cb -0.45 -2.32 0.00 0.00 -1.54 0.00 0.00 41.25 36.95 1k28 s ASN 374 CO 0.52 0.04 0.65 -0.62 -3.04 0.00 0.00 177.10 174.65 1k28 n GLU 375 N 3.28 0.78 -0.26 0.43 1.02 -1.26 -4.92 120.64 119.71 1k28 n GLU 375 Ca -0.07 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.07 1k28 n GLU 375 Cb 0.51 -1.20 0.00 0.00 -0.02 0.00 0.00 31.44 30.73 1k28 n GLU 375 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65