#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hta h SER -1 N 0.00 0.83 -0.11 0.00 0.87 -1.94 0.24 113.55 113.45 2hta h SER -1 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2hta h SER -1 Cb 0.00 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 61.78 2hta h SER -1 CO 0.00 0.54 0.05 -0.74 -0.53 0.00 0.00 176.83 176.15 2hta h HIS 0 N 0.95 0.16 -0.48 2.24 2.76 -1.99 0.25 115.15 119.05 2hta h HIS 0 Ca 0.35 -0.01 -0.10 0.00 -2.20 0.00 0.00 60.37 58.41 2hta h HIS 0 Cb 0.18 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.08 2hta h HIS 0 CO -0.00 0.24 -0.11 1.98 -1.30 0.00 0.00 177.93 178.74 2hta h MET 1 N 0.04 0.92 -0.43 5.26 1.85 -1.77 -2.46 114.93 118.33 2hta h MET 1 Ca 0.04 -0.35 -0.10 0.00 -0.61 0.00 0.00 59.70 58.68 2hta h MET 1 Cb 0.14 -0.05 -0.02 0.00 0.43 0.00 0.00 31.60 32.10 2hta h MET 1 CO -0.00 1.00 -0.14 0.82 -0.40 0.00 0.00 176.91 178.19 2hta h ILE 2 N 0.76 1.26 -0.22 1.77 2.04 -0.91 -2.48 117.51 119.74 2hta h ILE 2 Ca 0.12 -1.21 -0.03 0.00 1.00 0.00 0.00 64.86 64.74 2hta h ILE 2 Cb 0.66 1.08 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2hta h ILE 2 CO 0.05 0.41 -0.01 0.78 0.00 0.00 0.00 178.15 179.38 2hta h ASN 3 N 0.70 0.30 -0.93 1.72 2.35 -0.84 -2.18 115.58 116.71 2hta h ASN 3 Ca 0.11 -0.04 0.08 0.00 -0.55 0.00 0.00 56.30 55.90 2hta h ASN 3 Cb 0.63 -0.08 -0.07 0.00 0.05 0.00 0.00 38.32 38.85 2hta h ASN 3 CO 0.04 0.36 0.58 0.11 -1.65 0.00 0.00 177.43 176.87 2hta h LYS 4 N 0.32 0.99 -0.22 0.81 1.57 -0.97 -1.64 116.57 117.44 2hta h LYS 4 Ca 0.07 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.70 2hta h LYS 4 Cb 0.23 -0.22 -0.00 0.00 0.08 0.00 0.00 32.23 32.31 2hta h LYS 4 CO 0.01 0.66 -0.23 0.82 -0.57 0.00 0.00 179.45 180.13 2hta h ILE 5 N 1.02 1.32 0.00 1.86 2.04 -1.30 -2.45 117.51 120.00 2hta h ILE 5 Ca 0.42 -1.41 0.00 0.00 1.00 0.00 0.00 64.86 64.87 2hta h ILE 5 Cb 0.24 1.74 0.00 0.00 -0.74 0.00 0.00 36.82 38.05 2hta h ILE 5 CO -0.20 0.43 0.00 0.49 0.00 0.00 0.00 178.15 178.88 2hta n PHE 6 N -4.39 0.19 0.82 1.37 3.72 -1.05 -2.10 117.46 116.03 2hta n PHE 6 Ca -0.05 0.06 0.12 0.00 -0.05 0.00 0.00 57.45 57.54 2hta n PHE 6 Cb 0.43 -0.60 0.30 0.00 -0.94 0.00 0.00 39.48 38.66 2hta n PHE 6 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2hta n ALA 7 N -1.56 3.00 -1.75 4.37 0.00 -0.64 -4.96 120.51 118.97 2hta n ALA 7 Ca 0.05 -0.24 -0.38 0.00 0.00 0.00 0.00 53.44 52.87 2hta n ALA 7 Cb 0.28 -1.23 0.03 0.00 0.00 0.00 0.00 19.45 18.53 2hta n ALA 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2hta s LEU 8 N -3.57 3.83 0.51 0.00 1.43 -0.89 -4.98 118.68 115.02 2hta s LEU 8 Ca 0.10 2.59 -0.23 0.00 -1.03 0.00 0.00 54.13 55.56 2hta s LEU 8 Cb 0.16 -4.35 -0.06 0.00 0.03 0.00 0.00 46.19 41.97 2hta s LEU 8 CO 0.67 -1.46 1.32 -2.84 0.23 0.00 0.00 176.35 174.27 2hta s PRO 9 N -2.97 3.38 -0.14 1.29 0.02 -1.26 -4.98 135.00 130.34 2hta s PRO 9 Ca 0.72 2.15 -0.29 0.00 0.02 0.00 0.00 61.00 63.59 2hta s PRO 9 Cb -0.36 -2.36 -0.01 0.00 0.02 0.00 0.00 34.50 31.78 2hta s PRO 9 CO 0.42 -0.97 1.16 0.08 -0.33 0.00 0.00 177.00 177.36 2hta s VAL 10 N -1.34 4.42 -0.11 3.83 1.01 -1.26 -4.57 120.40 122.38 2hta s VAL 10 Ca 0.68 1.72 -0.11 0.00 0.00 0.00 0.00 61.98 64.27 2hta s VAL 10 Cb -0.38 -4.11 -0.27 0.00 0.00 0.00 0.00 36.38 31.62 2hta s VAL 10 CO 0.46 -0.09 0.46 0.40 0.00 0.00 0.00 175.10 176.33 2hta h ILE 11 N 5.29 0.80 -3.54 2.22 2.04 -1.03 -3.46 117.51 119.83 2hta h ILE 11 Ca -0.28 -2.37 -0.27 0.00 1.00 0.00 0.00 64.86 62.94 2hta h ILE 11 Cb 1.12 2.58 -0.32 0.00 -0.74 0.00 0.00 36.82 39.46 2hta h ILE 11 CO 0.93 0.80 -0.70 -1.83 0.00 0.00 0.00 178.15 177.35 2hta s GLU 12 N -2.53 0.00 -0.43 2.37 -1.05 -1.08 -5.00 118.70 110.99 2hta s GLU 12 Ca -0.21 0.16 -0.23 0.00 -0.15 0.00 0.00 54.97 54.54 2hta s GLU 12 Cb 0.06 -0.15 0.02 0.00 -0.44 0.00 0.00 34.13 33.62 2hta s GLU 12 CO 0.77 -0.11 0.76 -1.14 0.95 0.00 0.00 175.26 176.49 2hta s GLN 13 N 0.72 3.48 -0.06 -4.83 2.00 -1.26 -0.24 119.66 119.47 2hta s GLN 13 Ca -0.06 -0.04 -0.24 0.00 -2.00 0.00 0.00 55.36 53.02 2hta s GLN 13 Cb -0.08 -3.91 -0.28 0.00 0.80 0.00 0.00 33.01 29.54 2hta s GLN 13 CO -0.02 -1.03 0.91 -0.07 -0.50 0.00 0.00 175.29 174.57 2hta h LEU 14 N 9.97 0.34 -8.50 3.68 4.07 -0.90 -3.49 115.31 120.48 2hta h LEU 14 Ca -0.25 -0.92 -0.24 0.00 0.08 0.00 0.00 57.88 56.55 2hta h LEU 14 Cb 1.09 -0.11 -0.09 0.00 1.08 0.00 0.00 40.66 42.63 2hta h LEU 14 CO 0.94 1.23 -0.25 0.42 -1.08 0.00 0.00 178.44 179.70 2hta s THR 15 N -2.57 0.00 0.60 0.22 -4.23 -0.80 -4.98 115.64 103.88 2hta s THR 15 Ca -0.15 -1.63 0.30 0.00 -1.18 0.00 0.00 61.69 59.03 2hta s THR 15 Cb 0.00 -2.53 0.36 0.00 1.34 0.00 0.00 72.50 71.67 2hta s THR 15 CO 0.79 0.00 2.13 -0.65 -0.54 0.00 0.00 174.62 176.35 2hta h PRO 16 N 2.20 0.00 0.00 3.99 0.11 -1.99 -2.92 132.00 133.39 2hta h PRO 16 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2hta h PRO 16 Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 2hta h PRO 16 CO 0.40 0.00 -0.80 1.33 -0.21 0.00 0.00 178.00 178.72 2hta n VAL 17 N -3.70 0.00 -4.57 3.15 0.24 -1.26 -4.94 118.33 107.25 2hta n VAL 17 Ca 0.00 -0.25 -0.33 0.00 -2.04 0.00 0.00 64.34 61.73 2hta n VAL 17 Cb 0.27 0.79 -0.14 0.00 -1.47 0.00 0.00 33.84 33.29 2hta n VAL 17 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2hta s LEU 18 N -2.88 2.83 0.05 1.34 1.43 -1.10 -0.59 118.68 119.76 2hta s LEU 18 Ca 0.02 -0.30 0.02 0.00 -1.03 0.00 0.00 54.13 52.83 2hta s LEU 18 Cb 0.08 -1.66 -0.03 0.00 0.03 0.00 0.00 46.19 44.61 2hta s LEU 18 CO 0.46 0.14 -0.07 -0.94 0.23 0.00 0.00 176.35 176.17 2hta s SER 19 N 0.53 0.82 -0.08 2.29 1.04 -0.69 -0.16 113.70 117.45 2hta s SER 19 Ca -0.07 -0.68 -0.14 0.00 0.48 0.00 0.00 55.95 55.54 2hta s SER 19 Cb -0.15 0.07 -0.05 0.00 0.10 0.00 0.00 66.02 65.99 2hta s SER 19 CO 0.04 -0.31 0.35 -0.60 0.98 0.00 0.00 173.24 173.70 2hta s ARG 20 N -2.27 4.01 0.37 4.02 3.52 0.67 -0.75 118.95 128.52 2hta s ARG 20 Ca -0.04 0.26 0.06 0.00 -0.13 0.00 0.00 55.73 55.88 2hta s ARG 20 Cb -0.05 -3.30 -0.02 0.00 -1.56 0.00 0.00 34.95 30.01 2hta s ARG 20 CO -0.02 0.50 0.23 0.54 -0.81 0.00 0.00 175.30 175.75 2hta n ARG 21 N 2.59 0.47 -3.79 5.12 1.74 -0.16 -0.30 116.66 122.34 2hta n ARG 21 Ca -0.13 -3.45 -0.13 0.00 -0.77 0.00 0.00 57.85 53.36 2hta n ARG 21 Cb 0.52 2.45 -0.14 0.00 -1.02 0.00 0.00 32.46 34.27 2hta n ARG 21 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2hta s GLN 22 N -3.47 0.06 -0.16 5.56 0.74 -1.26 -0.42 119.66 120.72 2hta s GLN 22 Ca 0.33 0.23 0.00 0.00 0.05 0.00 0.00 55.36 55.97 2hta s GLN 22 Cb 0.02 -0.12 0.02 0.00 1.10 0.00 0.00 33.01 34.03 2hta s GLN 22 CO 0.23 -0.11 -0.14 -1.17 -0.55 0.00 0.00 175.29 173.55 2hta s LEU 23 N 0.75 1.77 0.00 3.68 2.96 -0.38 -4.95 118.68 122.51 2hta s LEU 23 Ca -0.06 -0.54 0.00 0.00 -0.22 0.00 0.00 54.13 53.31 2hta s LEU 23 Cb -0.08 -1.20 0.00 0.00 0.50 0.00 0.00 46.19 45.41 2hta s LEU 23 CO -0.03 -0.07 0.00 -0.67 -1.32 0.00 0.00 176.35 174.26 2hta n ASP 24 N 4.76 0.00 0.24 3.68 -0.08 -1.26 -0.79 116.55 123.10 2hta n ASP 24 Ca -0.17 0.00 0.14 0.00 -1.51 0.00 0.00 54.79 53.25 2hta n ASP 24 Cb 0.50 0.00 0.39 0.00 2.34 0.00 0.00 41.12 44.35 2hta n ASP 24 CO 0.00 0.00 0.00 0.44 0.12 0.00 0.00 177.20 177.76 2hta h ASP 25 N 0.00 0.00 -3.33 1.67 3.32 -1.65 -3.47 116.42 112.95 2hta h ASP 25 Ca 0.00 0.00 -0.64 0.00 0.02 0.00 0.00 57.03 56.41 2hta h ASP 25 Cb 0.00 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 39.35 2hta h ASP 25 CO 0.00 0.00 -0.65 -0.76 -1.72 0.00 0.00 179.24 176.11 2hta s LEU 26 N -6.17 3.35 0.07 1.55 1.43 0.03 -4.79 118.68 114.15 2hta s LEU 26 Ca 0.05 -0.06 -0.30 0.00 -1.03 0.00 0.00 54.13 52.79 2hta s LEU 26 Cb 0.07 -1.80 -0.05 0.00 0.03 0.00 0.00 46.19 44.43 2hta s LEU 26 CO 0.61 0.22 1.11 -1.81 0.23 0.00 0.00 176.35 176.71 2hta s ASP 27 N 0.08 7.22 0.04 2.29 1.01 -1.26 -1.25 116.67 124.80 2hta s ASP 27 Ca 0.00 1.92 0.07 0.00 0.71 0.00 0.00 52.55 55.25 2hta s ASP 27 Cb -0.13 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.18 2hta s ASP 27 CO 0.02 -0.35 -0.19 -0.76 0.21 0.00 0.00 175.17 174.11 2hta s LEU 28 N 0.74 2.53 -0.24 1.23 1.43 0.44 -2.10 118.68 122.71 2hta s LEU 28 Ca 0.55 -0.44 -0.07 0.00 -1.03 0.00 0.00 54.13 53.13 2hta s LEU 28 Cb -0.27 -1.48 -0.03 0.00 0.03 0.00 0.00 46.19 44.45 2hta s LEU 28 CO 0.30 0.26 0.05 -0.63 0.23 0.00 0.00 176.35 176.56 2hta s ILE 29 N -0.89 4.23 -0.14 -0.59 -1.09 -0.30 -0.99 121.20 121.43 2hta s ILE 29 Ca 0.14 -0.20 0.01 0.00 -2.23 0.00 0.00 60.65 58.37 2hta s ILE 29 Cb -0.10 -2.97 0.00 0.00 -1.58 0.00 0.00 42.46 37.81 2hta s ILE 29 CO 0.04 0.36 -0.17 -0.69 -1.23 0.00 0.00 174.94 173.25 2hta s VAL 30 N 1.48 2.50 -0.35 2.92 1.01 0.07 -0.56 120.40 127.46 2hta s VAL 30 Ca 0.06 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.08 2hta s VAL 30 Cb -0.15 -2.03 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 2hta s VAL 30 CO 0.03 0.53 0.23 -0.69 0.00 0.00 0.00 175.10 175.19 2hta s VAL 31 N 0.73 5.09 -0.48 2.92 1.01 0.70 -1.70 120.40 128.67 2hta s VAL 31 Ca -0.07 -0.36 0.03 0.00 0.00 0.00 0.00 61.98 61.58 2hta s VAL 31 Cb -0.16 -3.65 0.13 0.00 0.00 0.00 0.00 36.38 32.70 2hta s VAL 31 CO 0.01 -0.05 0.24 -0.62 0.00 0.00 0.00 175.10 174.68 2hta s ASP 32 N 1.68 4.06 0.19 3.32 -1.08 0.24 -1.57 116.67 123.51 2hta s ASP 32 Ca 0.05 -2.82 0.10 0.00 -0.52 0.00 0.00 52.55 49.36 2hta s ASP 32 Cb -0.18 -1.39 -0.04 0.00 -1.46 0.00 0.00 42.92 39.85 2hta s ASP 32 CO 0.09 -0.25 -0.17 -2.28 0.52 0.00 0.00 175.17 173.08 2hta s HIS 33 N 0.01 2.46 0.54 -5.34 5.65 -0.47 -4.59 115.29 113.55 2hta s HIS 33 Ca 0.17 -0.29 0.23 0.00 0.25 0.00 0.00 55.06 55.42 2hta s HIS 33 Cb -0.25 -1.20 1.42 0.00 -1.18 0.00 0.00 32.58 31.37 2hta s HIS 33 CO -0.00 0.52 2.06 -1.35 -0.65 0.00 0.00 174.74 175.32 2hta h PRO 34 N 3.01 0.00 -0.01 2.88 0.11 -1.97 -2.56 132.00 133.45 2hta h PRO 34 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 2hta h PRO 34 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 2hta h PRO 34 CO 0.51 0.00 -0.35 1.04 -0.21 0.00 0.00 178.00 178.99 2hta n GLN 35 N -4.29 1.51 -3.62 1.05 1.13 -1.26 -4.82 117.38 107.08 2hta n GLN 35 Ca 0.04 -1.00 -0.11 0.00 -1.94 0.00 0.00 57.00 53.99 2hta n GLN 35 Cb 0.39 -1.37 -0.07 0.00 0.11 0.00 0.00 30.24 29.31 2hta n GLN 35 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 2hta s VAL 36 N -2.11 0.00 -0.09 5.09 0.11 -0.96 -1.55 120.40 120.89 2hta s VAL 36 Ca 0.17 0.00 0.04 0.00 -2.93 0.00 0.00 61.98 59.25 2hta s VAL 36 Cb 0.16 -1.00 -0.01 0.00 -1.53 0.00 0.00 36.38 34.00 2hta s VAL 36 CO 0.46 0.00 -0.20 -0.54 -3.33 0.00 0.00 175.10 171.48 2hta s LYS 37 N -0.13 2.92 0.14 1.54 1.02 -0.38 -1.37 119.74 123.47 2hta s LYS 37 Ca 0.01 -0.82 -0.16 0.00 0.02 0.00 0.00 55.97 55.02 2hta s LYS 37 Cb -0.04 -2.35 0.03 0.00 -0.52 0.00 0.00 37.83 34.95 2hta s LYS 37 CO -0.02 0.30 0.42 0.00 -0.92 0.00 0.00 175.35 175.13 2hta s ALA 38 N 0.07 -0.91 0.08 5.17 0.00 -0.61 -0.53 121.76 125.03 2hta s ALA 38 Ca -0.09 -0.09 -0.15 0.00 0.00 0.00 0.00 51.96 51.63 2hta s ALA 38 Cb -0.15 0.73 0.03 0.00 0.00 0.00 0.00 23.12 23.72 2hta s ALA 38 CO 0.06 -0.67 0.34 -1.54 0.00 0.00 0.00 175.76 173.94 2hta s SER 39 N -2.82 -0.16 0.04 0.00 1.04 -0.97 -0.22 113.70 110.61 2hta s SER 39 Ca 0.04 -0.27 0.00 0.00 0.48 0.00 0.00 55.95 56.21 2hta s SER 39 Cb 0.01 0.41 -0.03 0.00 0.10 0.00 0.00 66.02 66.52 2hta s SER 39 CO -0.10 -0.73 -0.04 -0.36 0.98 0.00 0.00 173.24 172.99 2hta s PHE 40 N -3.20 0.47 -0.03 5.02 0.08 0.27 -0.60 117.98 119.99 2hta s PHE 40 Ca -0.01 -0.68 -0.06 0.00 0.12 0.00 0.00 56.93 56.30 2hta s PHE 40 Cb 0.01 -0.31 -0.04 0.00 -0.57 0.00 0.00 43.02 42.11 2hta s PHE 40 CO -0.08 -0.21 0.21 0.00 -0.10 0.00 0.00 175.22 175.05 2hta s ALA 41 N -2.21 3.88 0.27 5.36 0.00 0.03 -1.15 121.76 127.94 2hta s ALA 41 Ca -0.07 -0.63 -0.04 0.00 0.00 0.00 0.00 51.96 51.22 2hta s ALA 41 Cb -0.04 -2.00 0.35 0.00 0.00 0.00 0.00 23.12 21.43 2hta s ALA 41 CO -0.03 0.66 1.93 -0.07 0.00 0.00 0.00 175.76 178.25 2hta h LEU 42 N 4.25 1.03 -9.19 0.00 3.38 -1.74 -0.59 115.31 112.46 2hta h LEU 42 Ca -0.51 -0.05 -0.55 0.00 0.09 0.00 0.00 57.88 56.86 2hta h LEU 42 Cb 1.20 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 41.69 2hta h LEU 42 CO 0.64 0.77 1.22 -1.58 0.09 0.00 0.00 178.44 179.59 2hta s GLN 43 N -5.92 3.88 0.00 1.13 0.74 -1.26 -0.68 119.66 117.56 2hta s GLN 43 Ca -0.12 2.17 0.00 0.00 0.05 0.00 0.00 55.36 57.46 2hta s GLN 43 Cb 0.18 -4.13 0.00 0.00 1.10 0.00 0.00 33.01 30.16 2hta s GLN 43 CO 0.81 -1.22 0.00 0.41 -0.55 0.00 0.00 175.29 174.74 2hta n GLY 44 N 4.69 0.42 3.81 2.59 0.00 0.70 -3.56 105.19 113.85 2hta n GLY 44 Ca 0.21 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.98 2hta n GLY 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hta n ALA 45 N 1.00 -1.83 -2.52 4.61 0.00 -0.90 -4.51 120.51 116.35 2hta n ALA 45 Ca 0.00 -0.33 -0.43 0.00 0.00 0.00 0.00 53.44 52.68 2hta n ALA 45 Cb 0.09 -1.01 -0.08 0.00 0.00 0.00 0.00 19.45 18.46 2hta n ALA 45 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2hta s HIS 46 N -3.96 3.14 -0.17 0.00 5.04 -0.23 -4.89 115.29 114.21 2hta s HIS 46 Ca 0.14 -0.32 -0.29 0.00 -1.54 0.00 0.00 55.06 53.04 2hta s HIS 46 Cb -0.08 -3.05 -0.04 0.00 0.04 0.00 0.00 32.58 29.45 2hta s HIS 46 CO 0.65 -0.77 1.66 -1.17 -2.34 0.00 0.00 174.74 172.78 2hta s LEU 47 N 2.33 4.01 -0.10 8.88 2.96 -1.26 -0.79 118.68 134.71 2hta s LEU 47 Ca 0.15 1.84 0.08 0.00 -0.22 0.00 0.00 54.13 55.97 2hta s LEU 47 Cb -0.17 -3.53 -0.24 0.00 0.50 0.00 0.00 46.19 42.75 2hta s LEU 47 CO 0.15 -1.19 0.46 0.18 -1.32 0.00 0.00 176.35 174.63 2hta n LEU 48 N 8.20 1.35 -3.48 -0.68 4.77 0.23 -0.79 117.00 126.60 2hta n LEU 48 Ca 0.19 0.28 -0.15 0.00 -0.03 0.00 0.00 56.01 56.30 2hta n LEU 48 Cb 0.44 -0.19 -0.04 0.00 -2.33 0.00 0.00 43.42 41.30 2hta n LEU 48 CO 0.64 0.56 0.40 -0.94 -1.33 0.00 0.00 177.39 176.72 2hta s SER 49 N -6.29 -0.59 -0.24 -1.43 1.04 -1.17 -4.12 113.70 100.90 2hta s SER 49 Ca -0.12 0.33 -0.11 0.00 0.48 0.00 0.00 55.95 56.53 2hta s SER 49 Cb 0.07 0.56 0.09 0.00 0.10 0.00 0.00 66.02 66.84 2hta s SER 49 CO 0.80 -0.79 0.56 0.86 0.98 0.00 0.00 173.24 175.65 2hta s TRP 50 N -2.51 -0.94 -0.26 5.02 -0.00 -1.26 -2.30 118.94 116.68 2hta s TRP 50 Ca -0.05 1.83 -0.04 0.00 -0.00 0.00 0.00 56.10 57.85 2hta s TRP 50 Cb -0.01 0.51 0.10 0.00 -0.00 0.00 0.00 33.47 34.07 2hta s TRP 50 CO -0.02 -0.50 0.16 0.21 -0.00 0.00 0.00 176.95 176.81 2hta s LYS 51 N 1.97 0.19 0.56 5.86 2.20 0.31 -1.13 119.74 129.71 2hta s LYS 51 Ca -0.08 -0.29 -0.17 0.00 -0.36 0.00 0.00 55.97 55.08 2hta s LYS 51 Cb -0.08 -1.20 -0.05 0.00 -1.51 0.00 0.00 37.83 34.98 2hta s LYS 51 CO -0.17 -0.91 1.04 -1.25 -0.36 0.00 0.00 175.35 173.70 2hta s PRO 52 N 2.18 3.51 0.31 4.03 0.04 -1.25 -1.25 135.00 142.56 2hta s PRO 52 Ca 0.07 1.20 -0.29 0.00 0.04 0.00 0.00 61.00 62.02 2hta s PRO 52 Cb -0.16 -2.06 -0.12 0.00 0.04 0.00 0.00 34.50 32.20 2hta s PRO 52 CO -0.28 -0.65 1.45 1.55 0.04 0.00 0.00 177.00 179.11 2hta n VAL 53 N -1.74 1.43 -0.43 -0.36 3.14 -0.59 -1.77 118.33 118.01 2hta n VAL 53 Ca 0.09 -0.36 0.00 0.00 -2.96 0.00 0.00 64.34 61.11 2hta n VAL 53 Cb 0.53 -1.75 0.00 0.00 -1.06 0.00 0.00 33.84 31.56 2hta n VAL 53 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2hta n GLY 54 N 1.49 1.14 3.40 7.55 0.00 -1.26 -5.04 105.19 112.47 2hta n GLY 54 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2hta n GLY 54 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hta s GLU 55 N -0.38 1.47 0.69 1.61 0.41 -0.73 -5.14 118.70 116.63 2hta s GLU 55 Ca 0.00 -1.56 -0.12 0.00 -0.41 0.00 0.00 54.97 52.88 2hta s GLU 55 Cb 0.00 -1.60 0.01 0.00 -1.78 0.00 0.00 34.13 30.76 2hta s GLU 55 CO 0.00 0.32 1.07 -1.21 -0.49 0.00 0.00 175.26 174.95 2hta s GLU 56 N -3.03 2.89 0.16 1.61 0.41 -0.19 -4.69 118.70 115.85 2hta s GLU 56 Ca 0.22 1.03 -0.32 0.00 -0.41 0.00 0.00 54.97 55.49 2hta s GLU 56 Cb -0.06 -1.98 -0.17 0.00 -1.78 0.00 0.00 34.13 30.14 2hta s GLU 56 CO 0.10 -1.14 0.91 0.39 -0.49 0.00 0.00 175.26 175.03 2hta n GLU 57 N -3.02 0.55 -0.03 1.61 -0.58 -1.01 -4.76 120.64 113.41 2hta n GLU 57 Ca 0.08 0.19 -0.20 0.00 -0.42 0.00 0.00 57.16 56.81 2hta n GLU 57 Cb 0.53 -1.51 -0.14 0.00 -0.57 0.00 0.00 31.44 29.75 2hta n GLU 57 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2hta n VAL 58 N 0.87 1.71 -3.66 2.62 0.31 -0.28 -4.67 118.33 115.22 2hta n VAL 58 Ca 0.17 -0.65 -0.35 0.00 -0.01 0.00 0.00 64.34 63.49 2hta n VAL 58 Cb 0.22 -1.61 -0.06 0.00 -0.91 0.00 0.00 33.84 31.48 2hta n VAL 58 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2hta s LEU 59 N -6.86 4.38 -0.02 7.52 1.43 -1.25 -1.08 118.68 122.82 2hta s LEU 59 Ca -0.24 0.70 -0.12 0.00 -1.03 0.00 0.00 54.13 53.44 2hta s LEU 59 Cb 0.07 -2.70 -0.05 0.00 0.03 0.00 0.00 46.19 43.54 2hta s LEU 59 CO 0.74 0.26 0.35 0.86 0.23 0.00 0.00 176.35 178.78 2hta s TRP 60 N -1.26 3.68 -0.02 0.29 -0.00 0.07 -4.54 118.94 117.15 2hta s TRP 60 Ca 0.27 0.86 0.03 0.00 -0.00 0.00 0.00 56.10 57.26 2hta s TRP 60 Cb -0.14 -2.19 -0.00 0.00 -0.00 0.00 0.00 33.47 31.14 2hta s TRP 60 CO 0.15 0.65 -0.10 -1.17 -0.00 0.00 0.00 176.95 176.48 2hta s LEU 61 N -1.18 1.88 -0.04 5.86 2.96 -1.26 -0.07 118.68 126.84 2hta s LEU 61 Ca 0.23 -0.19 -0.30 0.00 -0.22 0.00 0.00 54.13 53.65 2hta s LEU 61 Cb -0.15 -0.55 -0.04 0.00 0.50 0.00 0.00 46.19 45.94 2hta s LEU 61 CO 0.12 0.09 1.29 -0.55 -1.32 0.00 0.00 176.35 175.98 2hta s SER 62 N 0.02 6.96 0.00 3.68 0.15 -0.71 -4.09 113.70 119.71 2hta s SER 62 Ca -0.00 1.94 0.10 0.00 0.70 0.00 0.00 55.95 58.69 2hta s SER 62 Cb -0.07 -2.56 0.47 0.00 -1.71 0.00 0.00 66.02 62.16 2hta s SER 62 CO 0.00 -0.65 1.29 -3.20 1.20 0.00 0.00 173.24 171.89 2hta n ASN 63 N 5.34 0.00 -0.48 5.45 4.05 -1.26 -2.52 115.26 125.84 2hta n ASN 63 Ca 0.12 0.37 0.04 0.00 0.45 0.00 0.00 54.58 55.56 2hta n ASN 63 Cb 0.45 -0.42 0.12 0.00 1.23 0.00 0.00 39.78 41.15 2hta n ASN 63 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 2hta n ASN 64 N -1.42 2.70 -4.74 1.20 4.13 -1.26 -5.00 115.26 110.87 2hta n ASN 64 Ca 0.03 -2.02 -0.41 0.00 1.68 0.00 0.00 54.58 53.87 2hta n ASN 64 Cb 0.11 -0.18 -0.04 0.00 -1.54 0.00 0.00 39.78 38.13 2hta n ASN 64 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 2hta s THR 65 N -1.03 3.56 0.72 3.41 -1.32 -1.05 -4.41 115.64 115.52 2hta s THR 65 Ca 0.18 1.36 -0.15 0.00 -1.21 0.00 0.00 61.69 61.87 2hta s THR 65 Cb 0.09 -3.87 0.03 0.00 -1.51 0.00 0.00 72.50 67.25 2hta s THR 65 CO 0.12 0.24 1.17 -2.84 -2.21 0.00 0.00 174.62 171.10 2hta s PRO 66 N -0.53 2.26 -0.71 7.08 0.02 -1.26 -4.99 135.00 136.87 2hta s PRO 66 Ca 0.51 1.64 0.05 0.00 0.02 0.00 0.00 61.00 63.21 2hta s PRO 66 Cb -0.32 -1.86 0.20 0.00 0.02 0.00 0.00 34.50 32.54 2hta s PRO 66 CO 0.38 -1.72 0.61 1.19 -0.33 0.00 0.00 177.00 177.14 2hta n PHE 67 N -2.74 3.45 -4.51 6.54 3.72 -1.26 -4.78 117.46 117.88 2hta n PHE 67 Ca 0.12 -4.23 -0.21 0.00 -0.05 0.00 0.00 57.45 53.09 2hta n PHE 67 Cb 0.51 -0.66 -0.15 0.00 -0.94 0.00 0.00 39.48 38.24 2hta n PHE 67 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 2hta s LYS 68 N -1.80 1.00 -0.24 -1.08 -0.14 -1.26 -1.49 119.74 114.74 2hta s LYS 68 Ca 0.30 -0.54 -0.38 0.00 -1.36 0.00 0.00 55.97 53.99 2hta s LYS 68 Cb 0.01 -0.98 -0.14 0.00 -1.68 0.00 0.00 37.83 35.04 2hta s LYS 68 CO -0.11 0.26 1.84 2.41 -0.76 0.00 0.00 175.35 178.99 2hta n THR 69 N 2.52 0.37 -0.38 2.17 -1.04 -1.26 -1.70 114.28 114.96 2hta n THR 69 Ca -0.15 -0.09 0.00 0.00 -2.04 0.00 0.00 64.05 61.77 2hta n THR 69 Cb 0.55 -1.46 0.00 0.00 -1.82 0.00 0.00 70.33 67.61 2hta n THR 69 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2hta n GLY 70 N 4.57 1.61 3.72 3.41 0.00 -1.25 -5.02 105.19 112.24 2hta n GLY 70 Ca 0.27 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.93 2hta n GLY 70 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hta s VAL 71 N -3.15 5.33 0.26 1.61 1.01 -0.69 -4.78 120.40 119.99 2hta s VAL 71 Ca 0.00 0.44 -0.30 0.00 0.00 0.00 0.00 61.98 62.12 2hta s VAL 71 Cb 0.00 -3.58 -0.11 0.00 0.00 0.00 0.00 36.38 32.69 2hta s VAL 71 CO 0.00 0.40 1.54 0.00 0.00 0.00 0.00 175.10 177.04 2hta s ALA 72 N 0.50 3.72 0.16 5.51 0.00 -1.26 -4.70 121.76 125.69 2hta s ALA 72 Ca 0.14 1.46 -0.30 0.00 0.00 0.00 0.00 51.96 53.26 2hta s ALA 72 Cb -0.12 -3.61 -0.07 0.00 0.00 0.00 0.00 23.12 19.31 2hta s ALA 72 CO 0.02 -0.87 0.94 -0.51 0.00 0.00 0.00 175.76 175.34 2hta s LEU 73 N -0.18 4.56 -0.36 0.00 1.43 -1.26 -4.85 118.68 118.02 2hta s LEU 73 Ca 0.63 1.83 -0.16 0.00 -1.03 0.00 0.00 54.13 55.40 2hta s LEU 73 Cb -0.45 -3.57 -0.00 0.00 0.03 0.00 0.00 46.19 42.20 2hta s LEU 73 CO 0.43 0.04 0.41 -0.60 0.23 0.00 0.00 176.35 176.87 2hta s ARG 74 N -0.52 3.49 0.00 1.70 6.06 -1.26 -4.87 118.95 123.54 2hta s ARG 74 Ca 0.44 -0.42 0.00 0.00 -2.50 0.00 0.00 55.73 53.25 2hta s ARG 74 Cb -0.24 -3.84 0.00 0.00 0.06 0.00 0.00 34.95 30.93 2hta s ARG 74 CO 0.30 -0.62 0.00 0.41 -2.50 0.00 0.00 175.30 172.90 2hta n GLY 75 N 4.95 0.14 7.00 8.12 0.00 -1.26 -1.74 105.19 122.39 2hta n GLY 75 Ca -0.08 -2.30 0.00 0.00 0.00 0.00 0.00 46.02 43.65 2hta n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hta n GLY 76 N -0.56 2.25 2.67 -0.02 0.00 0.90 -4.12 105.19 106.31 2hta n GLY 76 Ca 0.00 -0.52 -0.28 0.00 0.00 0.00 0.00 46.02 45.22 2hta n GLY 76 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hta s VAL 77 N 0.00 1.71 0.23 1.61 1.01 0.03 -1.23 120.40 123.77 2hta s VAL 77 Ca 0.00 -3.50 -0.32 0.00 0.00 0.00 0.00 61.98 58.16 2hta s VAL 77 Cb 0.00 -2.14 -0.12 0.00 0.00 0.00 0.00 36.38 34.11 2hta s VAL 77 CO 0.00 -1.11 1.60 -2.65 0.00 0.00 0.00 175.10 172.95 2hta n PRO 78 N 2.41 2.51 -3.11 2.72 -0.02 -1.26 -4.19 135.00 134.06 2hta n PRO 78 Ca 0.24 0.90 -0.41 0.00 -2.02 0.00 0.00 63.50 62.20 2hta n PRO 78 Cb 0.41 -2.68 -0.06 0.00 -0.02 0.00 0.00 33.50 31.14 2hta n PRO 78 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2hta s ILE 79 N 0.53 4.93 -0.41 4.25 1.01 -1.26 -1.45 121.20 128.80 2hta s ILE 79 Ca 0.71 0.84 -0.12 0.00 0.00 0.00 0.00 60.65 62.09 2hta s ILE 79 Cb -0.56 -4.01 0.05 0.00 0.01 0.00 0.00 42.46 37.95 2hta s ILE 79 CO 0.41 -0.16 0.26 0.00 0.00 0.00 0.00 174.94 175.45 2hta s TRP 81 N 1.54 -0.72 -0.49 0.00 -0.00 -1.15 -1.74 118.94 116.38 2hta s TRP 81 Ca 0.03 1.62 0.08 0.00 -0.00 0.00 0.00 56.10 57.83 2hta s TRP 81 Cb -0.21 0.32 0.52 0.00 -0.00 0.00 0.00 33.47 34.10 2hta s TRP 81 CO 0.06 -0.43 1.33 -0.35 -0.00 0.00 0.00 176.95 177.56 2hta n PRO 82 N 2.13 3.40 -4.03 5.86 -0.04 -1.26 -1.64 135.00 139.42 2hta n PRO 82 Ca -0.15 -2.03 -0.09 0.00 -0.04 0.00 0.00 63.50 61.19 2hta n PRO 82 Cb 0.56 -1.98 -0.11 0.00 -0.04 0.00 0.00 33.50 31.93 2hta n PRO 82 CO 0.00 0.00 0.00 1.67 -0.04 0.00 0.00 175.50 177.13 2hta s TRP 83 N -2.14 0.39 -0.13 0.54 -2.14 -0.83 -2.30 118.94 112.33 2hta s TRP 83 Ca 0.35 -0.71 -0.05 0.00 2.66 0.00 0.00 56.10 58.35 2hta s TRP 83 Cb 0.27 -0.28 -0.04 0.00 -3.10 0.00 0.00 33.47 30.33 2hta s TRP 83 CO 0.10 -0.24 0.05 0.12 -2.66 0.00 0.00 176.95 174.32 2hta s PHE 84 N -2.30 3.28 0.00 1.66 5.36 -1.19 -2.41 117.98 122.39 2hta s PHE 84 Ca -0.07 0.21 0.00 0.00 -0.96 0.00 0.00 56.93 56.11 2hta s PHE 84 Cb -0.04 -1.92 0.00 0.00 -0.34 0.00 0.00 43.02 40.72 2hta s PHE 84 CO -0.04 0.41 0.00 0.41 -1.46 0.00 0.00 175.22 174.54 2hta n GLY 85 N 2.60 -1.69 3.73 13.12 0.00 -1.26 -4.73 105.19 116.96 2hta n GLY 85 Ca -0.18 -1.42 -0.42 0.00 0.00 0.00 0.00 46.02 43.99 2hta n GLY 85 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2hta n PRO 86 N 0.00 2.45 -1.87 1.61 -0.02 -1.26 -1.14 135.00 134.77 2hta n PRO 86 Ca 0.00 0.86 -0.39 0.00 -2.02 0.00 0.00 63.50 61.95 2hta n PRO 86 Cb 0.00 -2.56 0.02 0.00 -0.02 0.00 0.00 33.50 30.94 2hta n PRO 86 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2hta s ALA 87 N -0.66 3.11 0.21 3.55 0.00 -1.24 -4.87 121.76 121.86 2hta s ALA 87 Ca 0.59 1.35 -0.07 0.00 0.00 0.00 0.00 51.96 53.84 2hta s ALA 87 Cb -0.53 -3.55 0.17 0.00 0.00 0.00 0.00 23.12 19.21 2hta s ALA 87 CO 0.57 -1.14 1.71 0.00 0.00 0.00 0.00 175.76 176.90 2hta h ALA 88 N 2.14 0.96 -2.70 0.00 0.00 -1.92 -3.45 119.26 114.29 2hta h ALA 88 Ca -0.51 -0.27 -0.57 0.00 0.00 0.00 0.00 54.91 53.56 2hta h ALA 88 Cb 1.27 -0.23 -0.04 0.00 0.00 0.00 0.00 17.79 18.78 2hta h ALA 88 CO 0.60 0.64 -0.04 -0.65 0.00 0.00 0.00 179.25 179.81 2hta s GLN 89 N -5.12 4.21 0.18 0.00 -0.21 -1.26 -5.01 119.66 112.44 2hta s GLN 89 Ca -0.11 0.73 -0.33 0.00 0.02 0.00 0.00 55.36 55.67 2hta s GLN 89 Cb 0.14 -3.25 -0.14 0.00 1.00 0.00 0.00 33.01 30.76 2hta s GLN 89 CO 0.84 0.61 1.49 0.94 -2.12 0.00 0.00 175.29 177.05 2hta n GLN 90 N 1.83 1.98 0.00 2.91 7.27 -1.26 -2.36 117.38 127.75 2hta n GLN 90 Ca -0.10 0.71 0.00 0.00 0.07 0.00 0.00 57.00 57.68 2hta n GLN 90 Cb 0.51 -2.43 0.00 0.00 2.41 0.00 0.00 30.24 30.73 2hta n GLN 90 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2hta n GLY 91 N 2.91 2.57 3.81 1.69 0.00 -1.26 -5.04 105.19 109.86 2hta n GLY 91 Ca 0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.84 2hta n GLY 91 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2hta s LEU 92 N 0.00 3.86 0.75 0.99 2.01 -0.99 -5.06 118.68 120.24 2hta s LEU 92 Ca 0.00 1.85 -0.12 0.00 0.01 0.00 0.00 54.13 55.87 2hta s LEU 92 Cb 0.00 -4.55 0.04 0.00 0.01 0.00 0.00 46.19 41.69 2hta s LEU 92 CO 0.00 -0.67 1.11 -2.16 1.01 0.00 0.00 176.35 175.64 2hta s PRO 93 N -3.27 2.45 0.76 1.29 0.04 -1.26 -4.38 135.00 130.62 2hta s PRO 93 Ca 0.65 0.44 -0.15 0.00 0.04 0.00 0.00 61.00 61.99 2hta s PRO 93 Cb -0.14 -1.98 0.05 0.00 0.04 0.00 0.00 34.50 32.48 2hta s PRO 93 CO 0.19 -1.32 1.21 0.43 0.04 0.00 0.00 177.00 177.55 2hta n SER 94 N -3.20 1.29 -1.97 6.66 7.64 -1.26 -3.70 113.62 119.08 2hta n SER 94 Ca 0.07 0.66 -0.16 0.00 1.01 0.00 0.00 58.87 60.45 2hta n SER 94 Cb 0.58 -1.52 0.00 0.00 -1.01 0.00 0.00 64.21 62.26 2hta n SER 94 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2hta n HIS 95 N -2.86 -0.97 -4.05 1.43 8.25 -0.29 -4.82 115.22 111.91 2hta n HIS 95 Ca 0.14 0.12 0.00 0.00 -0.26 0.00 0.00 57.72 57.72 2hta n HIS 95 Cb 0.50 -3.38 0.00 0.00 1.12 0.00 0.00 29.99 28.22 2hta n HIS 95 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2hta n GLY 96 N -1.11 -0.59 0.00 -1.41 0.00 -1.01 -2.92 105.19 98.15 2hta n GLY 96 Ca -0.16 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.72 2hta n GLY 96 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2hta n PHE 97 N 0.00 0.00 0.25 1.61 -1.74 -0.65 -4.69 117.46 112.24 2hta n PHE 97 Ca 0.00 0.00 0.08 0.00 -0.56 0.00 0.00 57.45 56.97 2hta n PHE 97 Cb 0.00 0.00 0.63 0.00 1.52 0.00 0.00 39.48 41.63 2hta n PHE 97 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2hta h ALA 98 N 0.00 1.81 0.00 1.98 0.00 -1.65 -1.94 119.26 119.46 2hta h ALA 98 Ca 0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2hta h ALA 98 Cb 0.05 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2hta h ALA 98 CO 0.00 0.08 0.00 2.89 0.00 0.00 0.00 179.25 182.22 2hta n ARG 99 N -4.34 0.03 0.00 0.00 1.85 -1.24 -3.01 116.66 109.96 2hta n ARG 99 Ca -0.03 0.15 0.10 0.00 -1.00 0.00 0.00 57.85 57.07 2hta n ARG 99 Cb 0.14 -1.55 -0.11 0.00 -1.05 0.00 0.00 32.46 29.90 2hta n ARG 99 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2hta n ASN 100 N -1.61 1.06 -4.66 2.89 4.13 -0.73 -3.70 115.26 112.64 2hta n ASN 100 Ca 0.05 -1.03 -0.28 0.00 1.68 0.00 0.00 54.58 55.00 2hta n ASN 100 Cb 0.27 0.95 -0.08 0.00 -1.54 0.00 0.00 39.78 39.38 2hta n ASN 100 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 2hta s LEU 101 N -2.93 3.30 -0.00 3.41 1.43 -1.16 -3.79 118.68 118.95 2hta s LEU 101 Ca 0.09 -0.35 -0.30 0.00 -1.03 0.00 0.00 54.13 52.53 2hta s LEU 101 Cb 0.16 -1.99 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 2hta s LEU 101 CO 0.82 0.12 1.21 -2.16 0.23 0.00 0.00 176.35 176.57 2hta s PRO 102 N -2.72 4.39 0.14 1.29 0.04 -1.26 -0.21 135.00 136.66 2hta s PRO 102 Ca 0.26 1.73 0.02 0.00 0.04 0.00 0.00 61.00 63.05 2hta s PRO 102 Cb -0.10 -3.47 -0.04 0.00 0.04 0.00 0.00 34.50 30.93 2hta s PRO 102 CO 0.18 -0.37 0.29 -1.58 0.04 0.00 0.00 177.00 175.56 2hta s TRP 103 N 1.71 3.49 0.10 0.56 0.52 0.15 -4.91 118.94 120.55 2hta s TRP 103 Ca 0.58 0.17 -0.14 0.00 0.02 0.00 0.00 56.10 56.73 2hta s TRP 103 Cb -0.27 -1.70 -0.06 0.00 -1.15 0.00 0.00 33.47 30.28 2hta s TRP 103 CO 0.25 0.51 0.48 0.00 0.02 0.00 0.00 176.95 178.22 2hta s ALA 104 N -1.73 3.64 -0.57 0.98 0.00 -0.27 -4.75 121.76 119.06 2hta s ALA 104 Ca 0.35 -0.20 -0.25 0.00 0.00 0.00 0.00 51.96 51.86 2hta s ALA 104 Cb -0.11 -2.44 0.04 0.00 0.00 0.00 0.00 23.12 20.61 2hta s ALA 104 CO 0.28 0.49 0.98 -1.17 0.00 0.00 0.00 175.76 176.34 2hta s LEU 105 N -1.72 4.02 -0.03 0.00 2.96 -1.26 -0.78 118.68 121.86 2hta s LEU 105 Ca 0.33 -0.35 -0.04 0.00 -0.22 0.00 0.00 54.13 53.85 2hta s LEU 105 Cb -0.15 -2.83 -0.28 0.00 0.50 0.00 0.00 46.19 43.43 2hta s LEU 105 CO 0.18 -1.29 0.72 0.50 -1.32 0.00 0.00 176.35 175.14 2hta h LYS 106 N 9.38 0.27 -3.28 1.98 3.64 -1.13 -3.49 116.57 123.95 2hta h LYS 106 Ca -0.26 -0.47 -0.03 0.00 -1.27 0.00 0.00 60.65 58.62 2hta h LYS 106 Cb 1.07 0.17 -0.12 0.00 -0.41 0.00 0.00 32.23 32.95 2hta h LYS 106 CO 1.11 1.13 0.02 0.00 -2.27 0.00 0.00 179.45 179.45 2hta s ALA 107 N -2.60 -1.07 -0.07 5.00 0.00 -1.03 -5.00 121.76 117.01 2hta s ALA 107 Ca -0.12 -0.01 -0.29 0.00 0.00 0.00 0.00 51.96 51.53 2hta s ALA 107 Cb 0.06 0.80 0.11 0.00 0.00 0.00 0.00 23.12 24.09 2hta s ALA 107 CO 0.84 -0.73 0.91 -3.38 0.00 0.00 0.00 175.76 173.40 2hta s HIS 108 N -3.82 -0.38 0.17 0.00 -3.43 -1.26 -0.76 115.29 105.81 2hta s HIS 108 Ca 0.05 0.44 -0.09 0.00 -0.80 0.00 0.00 55.06 54.66 2hta s HIS 108 Cb 0.00 0.50 -0.01 0.00 -1.43 0.00 0.00 32.58 31.64 2hta s HIS 108 CO -0.09 -0.48 0.29 0.54 -2.00 0.00 0.00 174.74 173.01 2hta s ASN 109 N -1.88 0.03 0.10 7.38 2.20 -0.52 -4.98 114.94 117.27 2hta s ASN 109 Ca 0.01 -0.90 -0.16 0.00 -0.94 0.00 0.00 52.86 50.87 2hta s ASN 109 Cb -0.01 0.45 0.03 0.00 -2.00 0.00 0.00 41.25 39.72 2hta s ASN 109 CO -0.04 -0.91 0.38 -1.83 -2.94 0.00 0.00 177.10 171.76 2hta s GLU 110 N -3.98 1.00 0.00 3.55 -1.05 -1.26 -0.44 118.70 116.53 2hta s GLU 110 Ca 0.19 -0.65 0.00 0.00 -0.15 0.00 0.00 54.97 54.36 2hta s GLU 110 Cb 0.03 0.44 0.00 0.00 -0.44 0.00 0.00 34.13 34.16 2hta s GLU 110 CO 0.01 -0.37 0.00 -0.40 0.95 0.00 0.00 175.26 175.45 2hta n ASP 111 N -0.02 0.00 0.09 0.83 5.68 -0.73 -5.01 116.55 117.38 2hta n ASP 111 Ca -0.17 -0.98 0.09 0.00 -0.50 0.00 0.00 54.79 53.23 2hta n ASP 111 Cb 0.63 0.00 0.39 0.00 -1.14 0.00 0.00 41.12 41.00 2hta n ASP 111 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2hta n ASP 112 N -1.93 0.38 -0.05 -1.12 8.00 -1.26 -3.13 116.55 117.44 2hta n ASP 112 Ca 0.00 0.62 -0.05 0.00 0.71 0.00 0.00 54.79 56.07 2hta n ASP 112 Cb 0.00 -0.69 -0.14 0.00 -0.02 0.00 0.00 41.12 40.27 2hta n ASP 112 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2hta n ASN 113 N -1.95 0.35 0.00 -2.24 3.02 -1.26 -4.76 115.26 108.43 2hta n ASN 113 Ca 0.01 0.16 0.00 0.00 -0.03 0.00 0.00 54.58 54.73 2hta n ASN 113 Cb 0.14 0.73 0.00 0.00 -0.61 0.00 0.00 39.78 40.04 2hta n ASN 113 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2hta n GLY 114 N 1.58 -0.59 2.99 7.41 0.00 -1.18 -4.27 105.19 111.12 2hta n GLY 114 Ca -0.21 -0.66 -0.14 0.00 0.00 0.00 0.00 46.02 45.00 2hta n GLY 114 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2hta s VAL 115 N -3.77 0.39 -0.02 1.61 1.01 -0.45 -1.77 120.40 117.39 2hta s VAL 115 Ca 0.00 -0.56 0.05 0.00 0.00 0.00 0.00 61.98 61.47 2hta s VAL 115 Cb 0.00 -0.40 -0.03 0.00 0.00 0.00 0.00 36.38 35.96 2hta s VAL 115 CO 0.00 -0.12 -0.15 -0.04 0.00 0.00 0.00 175.10 174.78 2hta s MET 116 N -0.73 2.37 0.00 2.72 -1.94 0.42 -0.82 119.30 121.31 2hta s MET 116 Ca -0.04 -0.79 -0.01 0.00 -1.71 0.00 0.00 55.69 53.14 2hta s MET 116 Cb -0.05 -2.32 -0.01 0.00 2.01 0.00 0.00 34.83 34.47 2hta s MET 116 CO -0.00 0.60 0.02 -0.51 -0.01 0.00 0.00 175.02 175.11 2hta s LEU 117 N -0.98 1.98 -0.12 -0.03 1.02 -0.39 -1.44 118.68 118.74 2hta s LEU 117 Ca 0.13 -0.17 0.02 0.00 0.02 0.00 0.00 54.13 54.12 2hta s LEU 117 Cb -0.11 0.16 0.02 0.00 0.02 0.00 0.00 46.19 46.28 2hta s LEU 117 CO 0.02 -0.15 -0.16 -0.89 0.02 0.00 0.00 176.35 175.20 2hta s THR 118 N -0.67 1.54 0.11 5.49 2.01 0.06 -0.51 115.64 123.67 2hta s THR 118 Ca -0.07 -0.66 0.06 0.00 0.31 0.00 0.00 61.69 61.32 2hta s THR 118 Cb -0.05 -1.41 -0.04 0.00 0.01 0.00 0.00 72.50 71.01 2hta s THR 118 CO -0.00 0.45 -0.01 -0.36 -0.69 0.00 0.00 174.62 174.01 2hta s PHE 119 N 1.03 2.93 -0.01 4.92 0.40 0.20 -0.49 117.98 126.97 2hta s PHE 119 Ca -0.05 -0.06 0.03 0.00 -0.60 0.00 0.00 56.93 56.24 2hta s PHE 119 Cb -0.15 -1.50 -0.01 0.00 0.51 0.00 0.00 43.02 41.88 2hta s PHE 119 CO -0.03 0.48 -0.09 -2.00 0.70 0.00 0.00 175.22 174.28 2hta s GLU 120 N -2.41 0.75 -0.04 0.44 2.12 0.04 -1.16 118.70 118.44 2hta s GLU 120 Ca 0.25 -0.33 0.05 0.00 0.36 0.00 0.00 54.97 55.31 2hta s GLU 120 Cb -0.11 -0.72 -0.01 0.00 0.26 0.00 0.00 34.13 33.55 2hta s GLU 120 CO 0.18 0.20 -0.19 -1.17 -0.54 0.00 0.00 175.26 173.73 2hta s LEU 121 N -0.21 1.98 0.15 2.70 2.96 0.71 -1.12 118.68 125.84 2hta s LEU 121 Ca 0.04 -0.39 0.08 0.00 -0.22 0.00 0.00 54.13 53.64 2hta s LEU 121 Cb -0.04 -1.07 -0.04 0.00 0.50 0.00 0.00 46.19 45.55 2hta s LEU 121 CO -0.00 0.19 -0.18 -1.10 -1.32 0.00 0.00 176.35 173.94 2hta s GLN 122 N -0.13 1.22 0.82 1.98 -0.21 -1.26 -0.30 119.66 121.79 2hta s GLN 122 Ca -0.01 -1.35 -0.12 0.00 0.02 0.00 0.00 55.36 53.90 2hta s GLN 122 Cb -0.11 -1.28 0.09 0.00 1.00 0.00 0.00 33.01 32.71 2hta s GLN 122 CO 0.02 0.26 1.15 -1.54 -2.12 0.00 0.00 175.29 173.06 2hta s SER 123 N -2.54 3.70 0.32 5.90 1.04 -0.70 -4.99 113.70 116.43 2hta s SER 123 Ca 0.14 2.16 -0.06 0.00 0.48 0.00 0.00 55.95 58.66 2hta s SER 123 Cb -0.06 -2.56 0.01 0.00 0.10 0.00 0.00 66.02 63.50 2hta s SER 123 CO 0.06 -2.59 0.50 -0.94 0.98 0.00 0.00 173.24 171.25 2hta s SER 124 N -2.63 0.57 0.27 7.02 1.04 -1.26 -4.92 113.70 113.78 2hta s SER 124 Ca 0.68 -1.32 -0.03 0.00 0.48 0.00 0.00 55.95 55.76 2hta s SER 124 Cb -0.23 0.66 0.39 0.00 0.10 0.00 0.00 66.02 66.94 2hta s SER 124 CO 0.53 -1.29 1.90 -0.08 0.98 0.00 0.00 173.24 175.28 2hta h GLU 125 N 2.15 1.17 -0.34 4.02 4.81 -1.98 -0.80 114.58 123.60 2hta h GLU 125 Ca -0.28 -0.07 0.03 0.00 -0.13 0.00 0.00 59.36 58.90 2hta h GLU 125 Cb 1.24 -0.26 -0.03 0.00 0.63 0.00 0.00 28.75 30.33 2hta h GLU 125 CO 0.39 0.77 0.16 0.00 -0.73 0.00 0.00 179.01 179.60 2hta h ALA 126 N 1.44 0.41 -0.37 2.92 0.00 -2.00 -2.52 119.26 119.14 2hta h ALA 126 Ca 0.41 0.02 -0.15 0.00 0.00 0.00 0.00 54.91 55.18 2hta h ALA 126 Cb 0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2hta h ALA 126 CO -0.15 -0.22 -0.37 1.79 0.00 0.00 0.00 179.25 180.30 2hta h THR 127 N 0.33 1.28 0.00 0.00 1.35 -1.82 -2.65 112.91 111.40 2hta h THR 127 Ca 0.14 -1.54 0.00 0.00 -0.55 0.00 0.00 66.41 64.46 2hta h THR 127 Cb 0.07 1.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.87 2hta h THR 127 CO -0.11 0.51 0.00 0.03 -0.25 0.00 0.00 175.52 175.70 2hta h ARG 128 N 0.73 0.00 -0.64 4.72 3.08 -1.07 0.82 114.38 122.02 2hta h ARG 128 Ca 0.06 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.04 2hta h ARG 128 Cb 0.95 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.97 2hta h ARG 128 CO 0.09 0.00 0.11 -0.22 -1.07 0.00 0.00 179.97 178.88 2hta h LYS 129 N 0.00 1.05 -0.00 0.04 3.64 -1.07 -3.29 116.57 116.94 2hta h LYS 129 Ca 0.00 -0.27 0.00 0.00 -1.27 0.00 0.00 60.65 59.11 2hta h LYS 129 Cb 0.04 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 2hta h LYS 129 CO 0.00 0.97 -0.49 2.48 -2.27 0.00 0.00 179.45 180.14 2hta n TYR 130 N -4.27 0.00 -3.34 1.91 0.18 -0.88 -4.83 117.16 105.93 2hta n TYR 130 Ca 0.04 0.00 -0.14 0.00 1.88 0.00 0.00 57.90 59.68 2hta n TYR 130 Cb 0.28 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.17 2hta n TYR 130 CO 0.00 0.00 0.00 -0.46 -2.08 0.00 0.00 176.86 174.32 2hta s TRP 131 N -1.99 -0.53 -1.31 -3.48 -0.00 0.23 -5.07 118.94 106.79 2hta s TRP 131 Ca 0.06 -0.62 -0.09 0.00 -0.00 0.00 0.00 56.10 55.45 2hta s TRP 131 Cb 0.09 -0.30 -0.07 0.00 -0.00 0.00 0.00 33.47 33.20 2hta s TRP 131 CO 0.45 -1.00 2.55 -0.35 -0.00 0.00 0.00 176.95 178.60 2hta n PRO 132 N 4.33 2.94 -3.78 5.86 -0.04 -1.24 -3.98 135.00 139.09 2hta n PRO 132 Ca 0.10 -1.93 -0.14 0.00 -0.04 0.00 0.00 63.50 61.50 2hta n PRO 132 Cb 0.47 -2.70 -0.15 0.00 -0.04 0.00 0.00 33.50 31.08 2hta n PRO 132 CO 0.00 0.00 0.00 -1.01 -0.04 0.00 0.00 175.50 174.45 2hta s HIS 133 N 2.83 -0.08 0.45 0.54 3.76 -1.26 -5.08 115.29 116.44 2hta s HIS 133 Ca 0.56 0.29 -0.20 0.00 -0.15 0.00 0.00 55.06 55.56 2hta s HIS 133 Cb 0.15 -0.09 -0.10 0.00 1.11 0.00 0.00 32.58 33.64 2hta s HIS 133 CO -0.04 -0.10 0.98 -0.51 -0.85 0.00 0.00 174.74 174.21 2hta s ASP 134 N 0.79 6.74 0.12 1.40 1.01 -1.26 -4.83 116.67 120.65 2hta s ASP 134 Ca -0.06 1.75 -0.23 0.00 0.71 0.00 0.00 52.55 54.71 2hta s ASP 134 Cb -0.09 -2.54 0.06 0.00 1.01 0.00 0.00 42.92 41.37 2hta s ASP 134 CO -0.03 -0.50 0.58 0.72 0.21 0.00 0.00 175.17 176.15 2hta s PHE 135 N -2.16 -0.50 -0.08 4.23 -0.71 -1.26 -4.52 117.98 112.97 2hta s PHE 135 Ca 0.63 0.39 -0.00 0.00 -1.04 0.00 0.00 56.93 56.91 2hta s PHE 135 Cb -0.11 0.48 0.02 0.00 -1.21 0.00 0.00 43.02 42.21 2hta s PHE 135 CO 0.16 -0.78 -0.06 0.99 -1.34 0.00 0.00 175.22 174.19 2hta s THR 136 N -3.31 0.80 -0.13 -4.49 2.01 -0.85 -1.71 115.64 107.96 2hta s THR 136 Ca -0.01 -0.18 -0.01 0.00 0.31 0.00 0.00 61.69 61.80 2hta s THR 136 Cb -0.01 -0.84 -0.02 0.00 0.01 0.00 0.00 72.50 71.65 2hta s THR 136 CO -0.09 0.32 -0.10 -0.76 -0.69 0.00 0.00 174.62 173.30 2hta s LEU 137 N 1.50 2.92 -0.07 4.42 1.43 0.59 -0.63 118.68 128.84 2hta s LEU 137 Ca -0.00 -0.24 0.04 0.00 -1.03 0.00 0.00 54.13 52.90 2hta s LEU 137 Cb -0.13 -1.67 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 2hta s LEU 137 CO -0.04 0.19 -0.18 -0.76 0.23 0.00 0.00 176.35 175.79 2hta s LEU 138 N 0.22 2.51 -0.20 1.79 1.43 0.27 -0.21 118.68 124.50 2hta s LEU 138 Ca -0.06 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.73 2hta s LEU 138 Cb -0.15 -1.51 0.04 0.00 0.03 0.00 0.00 46.19 44.60 2hta s LEU 138 CO 0.04 0.28 -0.14 0.00 0.23 0.00 0.00 176.35 176.76 2hta s ALA 139 N -0.32 2.24 -0.16 4.21 0.00 -0.31 -1.07 121.76 126.35 2hta s ALA 139 Ca 0.02 -1.32 -0.03 0.00 0.00 0.00 0.00 51.96 50.63 2hta s ALA 139 Cb -0.13 -1.30 -0.02 0.00 0.00 0.00 0.00 23.12 21.67 2hta s ALA 139 CO 0.02 -0.71 -0.05 1.03 0.00 0.00 0.00 175.76 176.06 2hta s ARG 140 N 1.30 3.58 0.07 0.00 0.52 0.04 -0.63 118.95 123.83 2hta s ARG 140 Ca -0.00 -0.56 0.09 0.00 -0.52 0.00 0.00 55.73 54.73 2hta s ARG 140 Cb -0.16 -2.90 -0.03 0.00 0.52 0.00 0.00 34.95 32.38 2hta s ARG 140 CO -0.09 0.16 -0.23 -0.06 0.02 0.00 0.00 175.30 175.10 2hta s PHE 141 N 0.57 2.43 -0.20 -0.53 0.40 0.33 -0.49 117.98 120.48 2hta s PHE 141 Ca -0.04 -0.34 0.01 0.00 -0.60 0.00 0.00 56.93 55.96 2hta s PHE 141 Cb -0.15 -1.39 0.05 0.00 0.51 0.00 0.00 43.02 42.04 2hta s PHE 141 CO 0.03 0.24 -0.08 0.15 0.70 0.00 0.00 175.22 176.25 2hta s LYS 142 N -1.55 1.84 -0.18 0.44 1.02 -0.18 -1.26 119.74 119.88 2hta s LYS 142 Ca 0.14 -0.82 -0.01 0.00 0.02 0.00 0.00 55.97 55.30 2hta s LYS 142 Cb -0.10 -2.38 0.00 0.00 -0.52 0.00 0.00 37.83 34.83 2hta s LYS 142 CO 0.05 -0.46 -0.14 0.14 -0.92 0.00 0.00 175.35 174.02 2hta s VAL 143 N 1.44 2.67 0.00 3.17 -7.23 -0.00 -0.98 120.40 119.46 2hta s VAL 143 Ca -0.02 -0.74 0.00 0.00 -1.81 0.00 0.00 61.98 59.41 2hta s VAL 143 Cb -0.17 -2.16 0.00 0.00 0.56 0.00 0.00 36.38 34.62 2hta s VAL 143 CO -0.08 0.50 0.00 0.61 -0.31 0.00 0.00 175.10 175.82 2hta n GLY 144 N 4.50 2.64 0.32 2.32 0.00 -1.26 -1.34 105.19 112.36 2hta n GLY 144 Ca -0.19 0.00 0.05 0.00 0.00 0.00 0.00 46.02 45.88 2hta n GLY 144 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2hta h LYS 145 N 0.00 0.54 -5.25 1.61 3.64 -1.81 -3.41 116.57 111.90 2hta h LYS 145 Ca 0.00 -0.03 -0.67 0.00 -1.27 0.00 0.00 60.65 58.68 2hta h LYS 145 Cb 0.00 -0.12 -0.13 0.00 -0.41 0.00 0.00 32.23 31.57 2hta h LYS 145 CO 0.00 0.36 -0.53 0.95 -2.27 0.00 0.00 179.45 177.96 2hta s THR 146 N -5.50 1.23 -0.08 1.00 -4.23 -1.26 -4.66 115.64 102.14 2hta s THR 146 Ca -0.08 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 58.43 2hta s THR 146 Cb 0.18 -2.28 0.02 0.00 1.34 0.00 0.00 72.50 71.76 2hta s THR 146 CO 0.74 0.00 -0.07 0.00 -0.54 0.00 0.00 174.62 174.74 2hta s GLU 148 N 1.25 2.40 -0.07 0.00 2.02 -0.15 -0.50 118.70 123.65 2hta s GLU 148 Ca -0.04 -0.76 0.01 0.00 0.02 0.00 0.00 54.97 54.20 2hta s GLU 148 Cb -0.14 -2.30 0.02 0.00 0.10 0.00 0.00 34.13 31.81 2hta s GLU 148 CO -0.02 0.61 -0.08 0.42 0.02 0.00 0.00 175.26 176.20 2hta s ILE 149 N -0.72 0.91 -0.08 -1.63 1.01 0.74 -1.01 121.20 120.42 2hta s ILE 149 Ca 0.11 -0.30 -0.01 0.00 0.00 0.00 0.00 60.65 60.46 2hta s ILE 149 Cb -0.10 -0.89 0.03 0.00 0.01 0.00 0.00 42.46 41.51 2hta s ILE 149 CO 0.00 0.32 -0.03 -0.70 0.00 0.00 0.00 174.94 174.54 2hta s GLU 150 N 1.08 0.88 -0.18 2.79 2.12 0.36 -1.18 118.70 124.58 2hta s GLU 150 Ca -0.07 -0.02 -0.08 0.00 0.36 0.00 0.00 54.97 55.15 2hta s GLU 150 Cb -0.14 -1.12 -0.04 0.00 0.26 0.00 0.00 34.13 33.08 2hta s GLU 150 CO -0.01 -0.26 0.10 -1.17 -0.54 0.00 0.00 175.26 173.38 2hta s LEU 151 N 1.76 4.06 -0.05 2.70 2.96 0.13 -0.78 118.68 129.46 2hta s LEU 151 Ca 0.03 0.20 -0.01 0.00 -0.22 0.00 0.00 54.13 54.13 2hta s LEU 151 Cb -0.13 -2.03 0.03 0.00 0.50 0.00 0.00 46.19 44.56 2hta s LEU 151 CO -0.05 0.21 0.02 -0.70 -1.32 0.00 0.00 176.35 174.51 2hta s GLU 152 N 0.16 0.30 -0.19 1.98 2.12 -0.23 -0.96 118.70 121.88 2hta s GLU 152 Ca 0.07 0.18 -0.02 0.00 0.36 0.00 0.00 54.97 55.56 2hta s GLU 152 Cb -0.12 -0.67 -0.00 0.00 0.26 0.00 0.00 34.13 33.60 2hta s GLU 152 CO -0.00 -0.25 -0.10 0.00 -0.54 0.00 0.00 175.26 174.37 2hta s ALA 153 N 1.72 2.67 -0.17 6.30 0.00 -0.48 -0.56 121.76 131.22 2hta s ALA 153 Ca 0.00 -1.13 -0.07 0.00 0.00 0.00 0.00 51.96 50.77 2hta s ALA 153 Cb -0.13 -1.49 -0.04 0.00 0.00 0.00 0.00 23.12 21.46 2hta s ALA 153 CO -0.03 -0.29 0.05 -1.01 0.00 0.00 0.00 175.76 174.48 2hta s HIS 154 N 1.23 3.24 -5.00 0.00 3.76 0.20 -1.65 115.29 117.07 2hta s HIS 154 Ca 0.03 0.06 0.00 0.00 -0.15 0.00 0.00 55.06 55.00 2hta s HIS 154 Cb -0.14 -2.04 0.00 0.00 1.11 0.00 0.00 32.58 31.51 2hta s HIS 154 CO -0.04 0.19 0.00 0.41 -0.85 0.00 0.00 174.74 174.45 2hta n GLY 155 N 3.35 -0.61 2.84 -2.22 0.00 -1.26 -2.00 105.19 105.29 2hta n GLY 155 Ca -0.17 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.21 2hta n GLY 155 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hta s GLU 156 N -2.00 1.02 0.03 1.61 0.41 -1.26 -2.53 118.70 115.98 2hta s GLU 156 Ca 0.00 -1.41 -0.29 0.00 -0.41 0.00 0.00 54.97 52.86 2hta s GLU 156 Cb 0.00 -2.45 0.10 0.00 -1.78 0.00 0.00 34.13 30.00 2hta s GLU 156 CO 0.00 -0.98 1.14 -0.59 -0.49 0.00 0.00 175.26 174.34 2hta s PHE 157 N 1.30 -0.10 -0.07 1.61 -0.12 -0.88 -4.98 117.98 114.73 2hta s PHE 157 Ca 0.11 -0.08 0.04 0.00 -0.05 0.00 0.00 56.93 56.95 2hta s PHE 157 Cb -0.18 0.58 0.00 0.00 -0.63 0.00 0.00 43.02 42.79 2hta s PHE 157 CO -0.18 -0.48 -0.18 0.00 -0.05 0.00 0.00 175.22 174.33 2hta s ALA 158 N -2.77 1.64 0.21 1.99 0.00 -1.26 -1.44 121.76 120.13 2hta s ALA 158 Ca 0.13 -0.68 0.01 0.00 0.00 0.00 0.00 51.96 51.41 2hta s ALA 158 Cb 0.02 -0.62 -0.05 0.00 0.00 0.00 0.00 23.12 22.47 2hta s ALA 158 CO -0.02 0.23 0.06 0.95 0.00 0.00 0.00 175.76 176.98 2hta s THR 159 N 0.35 0.49 0.13 0.00 -4.23 -0.71 -4.88 115.64 106.79 2hta s THR 159 Ca -0.12 -1.98 0.08 0.00 -1.18 0.00 0.00 61.69 58.48 2hta s THR 159 Cb -0.15 -2.38 -0.04 0.00 1.34 0.00 0.00 72.50 71.27 2hta s THR 159 CO 0.05 -0.21 -0.19 0.42 -0.54 0.00 0.00 174.62 174.14 2hta s THR 160 N -3.79 1.72 0.27 3.99 -4.23 -0.97 -0.46 115.64 112.16 2hta s THR 160 Ca 0.32 -1.72 -0.18 0.00 -1.18 0.00 0.00 61.69 58.92 2hta s THR 160 Cb 0.07 -1.67 0.01 0.00 1.34 0.00 0.00 72.50 72.25 2hta s THR 160 CO 0.09 -0.21 0.65 -0.94 -0.54 0.00 0.00 174.62 173.67 2hta s SER 161 N -2.29 -0.20 0.01 3.99 1.04 -0.84 -1.97 113.70 113.44 2hta s SER 161 Ca 0.11 -0.72 -0.26 0.00 0.48 0.00 0.00 55.95 55.56 2hta s SER 161 Cb -0.08 0.69 0.06 0.00 0.10 0.00 0.00 66.02 66.79 2hta s SER 161 CO 0.05 -1.29 0.58 0.00 0.98 0.00 0.00 173.24 173.56 2hta s ALA 162 N -3.92 -1.51 -0.38 5.32 0.00 -0.71 -0.57 121.76 119.98 2hta s ALA 162 Ca 0.15 0.88 -0.09 0.00 0.00 0.00 0.00 51.96 52.90 2hta s ALA 162 Cb -0.04 0.26 0.05 0.00 0.00 0.00 0.00 23.12 23.39 2hta s ALA 162 CO 0.08 -0.46 0.19 -0.51 0.00 0.00 0.00 175.76 175.06 2hta s LEU 163 N -1.68 4.77 -0.79 0.00 1.43 0.49 -1.16 118.68 121.74 2hta s LEU 163 Ca -0.08 -1.26 -0.04 0.00 -1.03 0.00 0.00 54.13 51.72 2hta s LEU 163 Cb -0.01 -1.95 0.12 0.00 0.03 0.00 0.00 46.19 44.37 2hta s LEU 163 CO 0.02 -0.43 2.54 1.57 0.23 0.00 0.00 176.35 180.29 2hta n HIS 164 N 4.90 2.08 -1.91 0.29 -0.00 -0.53 -1.89 115.22 118.16 2hta n HIS 164 Ca -0.11 -2.28 -0.41 0.00 0.46 0.00 0.00 57.72 55.38 2hta n HIS 164 Cb 0.44 -1.50 -0.02 0.00 -0.12 0.00 0.00 29.99 28.80 2hta n HIS 164 CO 0.00 0.00 0.00 -1.12 0.46 0.00 0.00 176.34 175.68 2hta s SER 165 N 0.16 6.52 -0.29 0.26 0.01 -1.26 -4.18 113.70 114.92 2hta s SER 165 Ca 0.56 2.80 -0.09 0.00 1.31 0.00 0.00 55.95 60.53 2hta s SER 165 Cb 0.32 -2.63 -0.02 0.00 0.21 0.00 0.00 66.02 63.90 2hta s SER 165 CO -0.19 -0.80 0.14 -0.31 0.41 0.00 0.00 173.24 172.49 2hta s TYR 166 N -0.05 3.16 -0.16 2.43 1.51 -0.36 -2.43 117.35 121.45 2hta s TYR 166 Ca 0.61 -0.43 -0.06 0.00 -1.01 0.00 0.00 57.07 56.18 2hta s TYR 166 Cb -0.45 -2.33 -0.04 0.00 -0.11 0.00 0.00 41.96 39.04 2hta s TYR 166 CO 0.46 -0.39 0.03 -0.06 -1.11 0.00 0.00 175.55 174.48 2hta s PHE 167 N 1.64 3.18 -0.05 2.71 0.40 -0.51 -0.75 117.98 124.60 2hta s PHE 167 Ca 0.05 -0.02 -0.30 0.00 -0.60 0.00 0.00 56.93 56.07 2hta s PHE 167 Cb -0.16 -2.01 -0.04 0.00 0.51 0.00 0.00 43.02 41.31 2hta s PHE 167 CO 0.06 0.14 1.40 1.21 0.70 0.00 0.00 175.22 178.73 2hta s ASN 168 N 0.23 6.86 0.15 1.36 2.47 -0.24 -1.77 114.94 124.00 2hta s ASN 168 Ca 0.02 2.01 0.07 0.00 0.42 0.00 0.00 52.86 55.38 2hta s ASN 168 Cb -0.13 -2.55 -0.04 0.00 -1.45 0.00 0.00 41.25 37.08 2hta s ASN 168 CO 0.01 -0.76 -0.16 0.68 -3.72 0.00 0.00 177.10 173.15 2hta s VAL 169 N 2.94 1.62 0.06 -5.21 -7.23 0.05 -4.91 120.40 107.72 2hta s VAL 169 Ca 0.63 -1.85 -0.20 0.00 -1.81 0.00 0.00 61.98 58.75 2hta s VAL 169 Cb -0.29 -1.73 -0.11 0.00 0.56 0.00 0.00 36.38 34.81 2hta s VAL 169 CO 0.24 -0.36 1.45 1.23 -0.31 0.00 0.00 175.10 177.34 2hta h GLY 170 N 3.33 0.40 -5.57 2.32 0.00 -1.87 -3.40 103.07 98.29 2hta h GLY 170 Ca -0.41 -0.34 -0.00 0.00 0.00 0.00 0.00 47.33 46.58 2hta h GLY 170 CO 0.51 0.31 -0.26 -0.35 0.00 0.00 0.00 176.54 176.75 2hta s ASP 171 N -5.98 -0.73 0.54 0.19 -1.08 -1.26 -4.76 116.67 103.59 2hta s ASP 171 Ca -0.14 1.17 0.21 0.00 -0.52 0.00 0.00 52.55 53.27 2hta s ASP 171 Cb 0.06 1.84 1.43 0.00 -1.46 0.00 0.00 42.92 44.80 2hta s ASP 171 CO 0.74 -0.24 2.16 -0.29 0.52 0.00 0.00 175.17 178.07 2hta h ILE 172 N 6.08 0.84 0.00 4.11 6.09 -1.15 -1.13 117.51 132.34 2hta h ILE 172 Ca -0.18 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.30 2hta h ILE 172 Cb 1.11 0.97 -0.00 0.00 0.47 0.00 0.00 36.82 39.37 2hta h ILE 172 CO 0.14 0.00 -0.07 0.00 -3.07 0.00 0.00 178.15 175.15 2hta h ALA 173 N 1.96 1.25 -0.02 0.18 0.00 -1.85 -1.76 119.26 119.03 2hta h ALA 173 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2hta h ALA 173 Cb 0.12 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.89 2hta h ALA 173 CO -0.00 0.09 -0.02 0.27 0.00 0.00 0.00 179.25 179.59 2hta n ASN 174 N -3.53 2.43 -4.74 0.00 0.23 -0.43 -4.92 115.26 104.29 2hta n ASN 174 Ca -0.02 -1.71 -0.41 0.00 -0.53 0.00 0.00 54.58 51.91 2hta n ASN 174 Cb 0.19 0.02 -0.03 0.00 -2.08 0.00 0.00 39.78 37.88 2hta n ASN 174 CO 0.00 0.00 0.00 -0.69 -0.93 0.00 0.00 177.26 175.64 2hta s VAL 175 N -1.49 3.44 0.08 3.53 1.01 -0.66 -4.78 120.40 121.54 2hta s VAL 175 Ca 0.20 1.22 0.07 0.00 0.00 0.00 0.00 61.98 63.47 2hta s VAL 175 Cb 0.15 -3.78 -0.03 0.00 0.00 0.00 0.00 36.38 32.71 2hta s VAL 175 CO 0.23 0.20 -0.18 -1.59 0.00 0.00 0.00 175.10 173.76 2hta s LYS 176 N -0.33 1.00 -0.12 2.72 -2.85 -1.20 -4.11 119.74 114.84 2hta s LYS 176 Ca 0.53 -1.05 0.02 0.00 -1.00 0.00 0.00 55.97 54.47 2hta s LYS 176 Cb -0.34 -1.14 -0.00 0.00 -2.06 0.00 0.00 37.83 34.29 2hta s LYS 176 CO 0.38 0.26 -0.20 0.08 0.10 0.00 0.00 175.35 175.97 2hta s VAL 177 N -1.18 2.38 0.50 1.79 1.01 0.00 -0.48 120.40 124.43 2hta s VAL 177 Ca 0.03 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.17 2hta s VAL 177 Cb -0.10 -1.95 0.01 0.00 0.00 0.00 0.00 36.38 34.34 2hta s VAL 177 CO 0.03 0.54 0.33 -0.94 0.00 0.00 0.00 175.10 175.06 2hta s SER 178 N 0.50 4.59 0.00 3.32 1.04 0.38 -0.29 113.70 123.25 2hta s SER 178 Ca -0.13 -1.20 0.00 0.00 0.48 0.00 0.00 55.95 55.10 2hta s SER 178 Cb -0.17 0.17 0.00 0.00 0.10 0.00 0.00 66.02 66.12 2hta s SER 178 CO 0.05 -0.94 0.00 0.61 0.98 0.00 0.00 173.24 173.94 2hta n GLY 179 N -1.60 0.48 0.52 7.32 0.00 -0.99 -1.02 105.19 109.90 2hta n GLY 179 Ca -0.03 -0.52 0.11 0.00 0.00 0.00 0.00 46.02 45.58 2hta n GLY 179 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hta n LEU 180 N 0.00 1.58 0.00 0.99 4.77 -0.55 -0.89 117.00 122.90 2hta n LEU 180 Ca 0.00 -0.64 0.00 0.00 -0.03 0.00 0.00 56.01 55.34 2hta n LEU 180 Cb 0.00 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 2hta n LEU 180 CO 0.00 0.32 0.00 0.61 -1.33 0.00 0.00 177.39 176.99 2hta n GLY 181 N 1.13 0.92 0.54 -0.72 0.00 -1.26 -3.87 105.19 101.93 2hta n GLY 181 Ca 0.17 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.43 2hta n GLY 181 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2hta n ASP 182 N 4.13 0.00 -4.80 1.61 5.68 -1.26 -2.69 116.55 119.22 2hta n ASP 182 Ca 0.00 0.00 -0.34 0.00 -0.50 0.00 0.00 54.79 53.95 2hta n ASP 182 Cb 0.00 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 39.94 2hta n ASP 182 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2hta s ARG 183 N -0.46 3.93 0.09 0.11 0.52 -1.26 0.15 118.95 122.03 2hta s ARG 183 Ca 0.00 1.35 -0.15 0.00 -0.52 0.00 0.00 55.73 56.41 2hta s ARG 183 Cb 0.00 -2.19 0.03 0.00 0.52 0.00 0.00 34.95 33.31 2hta s ARG 183 CO 0.00 -0.31 0.36 -0.59 0.02 0.00 0.00 175.30 174.77 2hta s PHE 184 N -1.95 -0.15 -0.21 -0.53 -0.12 -0.70 -1.59 117.98 112.74 2hta s PHE 184 Ca 0.65 -0.10 -0.06 0.00 -0.05 0.00 0.00 56.93 57.36 2hta s PHE 184 Cb -0.16 0.18 -0.03 0.00 -0.63 0.00 0.00 43.02 42.37 2hta s PHE 184 CO 0.20 -0.62 0.03 0.42 -0.05 0.00 0.00 175.22 175.21 2hta s ILE 185 N -3.35 4.28 -0.53 -4.49 1.01 0.16 -0.81 121.20 117.46 2hta s ILE 185 Ca 0.00 -0.20 -0.17 0.00 0.00 0.00 0.00 60.65 60.28 2hta s ILE 185 Cb 0.01 -2.95 0.10 0.00 0.01 0.00 0.00 42.46 39.64 2hta s ILE 185 CO -0.09 0.42 0.55 -0.62 0.00 0.00 0.00 174.94 175.20 2hta s ASP 186 N 0.95 6.18 0.46 3.58 -1.08 -0.12 -0.81 116.67 125.84 2hta s ASP 186 Ca 0.03 -1.45 0.29 0.00 -0.52 0.00 0.00 52.55 50.90 2hta s ASP 186 Cb -0.14 -2.24 1.03 0.00 -1.46 0.00 0.00 42.92 40.11 2hta s ASP 186 CO 0.02 -0.88 1.84 0.11 0.52 0.00 0.00 175.17 176.79 2hta h LYS 187 N 8.95 0.00 -0.01 4.34 1.57 -1.25 -0.93 116.57 129.24 2hta h LYS 187 Ca -0.29 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.36 2hta h LYS 187 Cb 1.10 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.39 2hta h LYS 187 CO 1.00 0.00 -0.62 0.28 -0.57 0.00 0.00 179.45 179.54 2hta h VAL 188 N 0.00 1.44 -2.18 0.50 2.07 -1.92 -3.38 116.25 112.78 2hta h VAL 188 Ca 0.00 -2.13 -0.59 0.00 0.82 0.00 0.00 66.70 64.81 2hta h VAL 188 Cb 0.62 2.14 -0.42 0.00 -1.52 0.00 0.00 31.29 32.12 2hta h VAL 188 CO 0.00 0.61 -0.70 0.59 0.02 0.00 0.00 177.57 178.09 2hta n ASN 189 N -3.80 3.38 -1.71 0.57 3.02 -0.84 -4.89 115.26 110.97 2hta n ASN 189 Ca -0.01 -3.40 -0.17 0.00 -0.03 0.00 0.00 54.58 50.97 2hta n ASN 189 Cb 0.62 -0.64 -0.03 0.00 -0.61 0.00 0.00 39.78 39.12 2hta n ASN 189 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 2hta n ASP 190 N 0.60 -5.04 -2.85 6.41 8.00 -1.24 -2.24 116.55 120.19 2hta n ASP 190 Ca 0.29 0.14 -0.19 0.00 0.71 0.00 0.00 54.79 55.74 2hta n ASP 190 Cb 0.43 -4.10 0.00 0.00 -0.02 0.00 0.00 41.12 37.44 2hta n ASP 190 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2hta n ALA 191 N -0.68 -0.89 -1.77 2.24 0.00 -0.41 -4.94 120.51 114.06 2hta n ALA 191 Ca -0.19 0.15 -0.37 0.00 0.00 0.00 0.00 53.44 53.02 2hta n ALA 191 Cb 0.62 -2.52 -0.02 0.00 0.00 0.00 0.00 19.45 17.54 2hta n ALA 191 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2hta s LYS 192 N -5.48 3.95 -0.16 0.00 1.02 -0.95 -4.53 119.74 113.58 2hta s LYS 192 Ca 0.19 1.75 -0.19 0.00 0.02 0.00 0.00 55.97 57.74 2hta s LYS 192 Cb -0.09 -2.54 -0.04 0.00 -0.52 0.00 0.00 37.83 34.65 2hta s LYS 192 CO 0.23 -0.38 0.53 -2.00 -0.92 0.00 0.00 175.35 172.81 2hta s GLU 193 N -2.51 4.27 0.47 1.68 2.12 -1.26 -0.94 118.70 122.53 2hta s GLU 193 Ca 0.60 0.49 0.06 0.00 0.36 0.00 0.00 54.97 56.48 2hta s GLU 193 Cb -0.28 -3.51 -0.01 0.00 0.26 0.00 0.00 34.13 30.59 2hta s GLU 193 CO 0.35 -0.03 0.26 0.20 -0.54 0.00 0.00 175.26 175.50 2hta s GLY 194 N 0.93 2.40 -0.05 -1.50 0.00 0.01 -4.95 107.32 104.16 2hta s GLY 194 Ca 0.26 -1.60 -0.02 0.00 0.00 0.00 0.00 44.72 43.37 2hta s GLY 194 CO 0.11 -1.93 0.03 0.14 0.00 0.00 0.00 173.10 171.45 2hta s VAL 195 N -2.67 0.10 0.27 1.40 1.01 -1.26 -1.73 120.40 117.51 2hta s VAL 195 Ca 0.36 0.29 -0.23 0.00 0.00 0.00 0.00 61.98 62.40 2hta s VAL 195 Cb 0.01 -0.31 -0.09 0.00 0.00 0.00 0.00 36.38 35.99 2hta s VAL 195 CO 0.21 0.21 0.83 -0.76 0.00 0.00 0.00 175.10 175.58 2hta s LEU 196 N 2.02 4.36 0.00 3.92 1.43 0.12 -4.97 118.68 125.57 2hta s LEU 196 Ca 0.04 1.63 0.21 0.00 -1.03 0.00 0.00 54.13 54.98 2hta s LEU 196 Cb -0.12 -3.77 -0.09 0.00 0.03 0.00 0.00 46.19 42.24 2hta s LEU 196 CO -0.04 -0.00 0.99 0.35 0.23 0.00 0.00 176.35 177.88 2hta n THR 197 N 0.70 0.00 -0.74 5.49 -2.24 -1.26 -4.46 114.28 111.77 2hta n THR 197 Ca -0.01 -0.17 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 2hta n THR 197 Cb 0.50 1.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.89 2hta n THR 197 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2hta n ASP 198 N -0.60 0.29 -0.64 3.42 5.68 -1.26 -5.02 116.55 118.42 2hta n ASP 198 Ca 0.07 -1.04 -0.08 0.00 -0.50 0.00 0.00 54.79 53.24 2hta n ASP 198 Cb 0.40 0.00 -0.04 0.00 -1.14 0.00 0.00 41.12 40.35 2hta n ASP 198 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2hta n GLY 199 N -0.02 1.00 3.33 6.12 0.00 -1.09 -4.74 105.19 109.79 2hta n GLY 199 Ca 0.00 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 2hta n GLY 199 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2hta s ILE 200 N -2.23 3.26 -0.12 -0.61 1.01 -1.26 -1.48 121.20 119.77 2hta s ILE 200 Ca 0.00 -0.55 -0.00 0.00 0.00 0.00 0.00 60.65 60.10 2hta s ILE 200 Cb 0.00 -2.45 -0.02 0.00 0.01 0.00 0.00 42.46 40.00 2hta s ILE 200 CO 0.00 0.46 -0.10 -1.58 0.00 0.00 0.00 174.94 173.72 2hta s GLN 201 N 1.14 3.26 0.36 2.79 2.00 0.60 -4.96 119.66 124.84 2hta s GLN 201 Ca 0.01 -0.63 0.08 0.00 -2.00 0.00 0.00 55.36 52.83 2hta s GLN 201 Cb -0.14 -2.66 -0.03 0.00 0.80 0.00 0.00 33.01 30.97 2hta s GLN 201 CO -0.02 0.33 0.23 0.95 -0.50 0.00 0.00 175.29 176.29 2hta s THR 202 N 0.06 3.08 -0.46 -0.34 -4.23 -1.26 -0.82 115.64 111.66 2hta s THR 202 Ca -0.03 -1.53 0.08 0.00 -1.18 0.00 0.00 61.69 59.02 2hta s THR 202 Cb -0.14 -3.05 0.29 0.00 1.34 0.00 0.00 72.50 70.93 2hta s THR 202 CO 0.04 -0.14 0.67 0.49 -0.54 0.00 0.00 174.62 175.14 2hta n PHE 203 N -1.29 1.17 0.32 3.99 3.01 -1.26 -4.89 117.46 118.50 2hta n PHE 203 Ca -0.01 -3.81 0.14 0.00 1.01 0.00 0.00 57.45 54.78 2hta n PHE 203 Cb 0.61 -0.43 0.39 0.00 -0.01 0.00 0.00 39.48 40.04 2hta n PHE 203 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 2hta h PRO 204 N 3.66 0.00 0.00 -1.08 0.13 -1.91 -3.42 132.00 129.38 2hta h PRO 204 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 2hta h PRO 204 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 2hta h PRO 204 CO 0.59 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.96 2hta n ASP 205 N -2.89 0.00 -4.71 1.44 5.75 -1.26 -5.02 116.55 109.87 2hta n ASP 205 Ca 0.03 -0.88 -0.57 0.00 -0.01 0.00 0.00 54.79 53.36 2hta n ASP 205 Cb 0.42 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.44 2hta n ASP 205 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 2hta n ARG 206 N 0.00 1.24 -4.30 0.11 0.63 -1.26 -4.64 116.66 108.44 2hta n ARG 206 Ca 0.00 0.45 -0.21 0.00 -0.92 0.00 0.00 57.85 57.17 2hta n ARG 206 Cb 0.00 -2.15 -0.16 0.00 0.45 0.00 0.00 32.46 30.60 2hta n ARG 206 CO 0.00 0.00 0.00 0.99 -2.51 0.00 0.00 177.63 176.11 2hta s THR 207 N 3.48 0.72 -0.34 5.15 2.01 -0.65 -4.97 115.64 121.04 2hta s THR 207 Ca 0.97 -0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.77 2hta s THR 207 Cb -1.03 -0.70 0.16 0.00 0.01 0.00 0.00 72.50 70.94 2hta s THR 207 CO 0.64 0.26 0.43 -0.62 -0.69 0.00 0.00 174.62 174.64 2hta s ASP 208 N 0.77 0.34 -0.03 3.53 -1.08 -1.25 -1.62 116.67 117.32 2hta s ASP 208 Ca -0.12 -0.87 0.03 0.00 -0.52 0.00 0.00 52.55 51.07 2hta s ASP 208 Cb -0.14 1.06 0.00 0.00 -1.46 0.00 0.00 42.92 42.38 2hta s ASP 208 CO 0.01 -0.29 -0.10 -0.13 0.52 0.00 0.00 175.17 175.18 2hta s ARG 209 N 2.04 1.07 -0.40 4.34 0.52 -0.74 -0.74 118.95 125.03 2hta s ARG 209 Ca 0.13 -0.35 -0.13 0.00 -0.52 0.00 0.00 55.73 54.87 2hta s ARG 209 Cb -0.12 -0.98 0.04 0.00 0.52 0.00 0.00 34.95 34.40 2hta s ARG 209 CO -0.17 0.14 0.27 0.08 0.02 0.00 0.00 175.30 175.63 2hta s VAL 210 N 0.15 4.83 0.01 3.52 1.01 0.01 -1.52 120.40 128.41 2hta s VAL 210 Ca -0.03 -0.90 -0.29 0.00 0.00 0.00 0.00 61.98 60.76 2hta s VAL 210 Cb -0.09 -3.75 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 2hta s VAL 210 CO 0.01 -0.34 0.94 -0.31 0.00 0.00 0.00 175.10 175.39 2hta s TYR 211 N 1.59 3.68 -0.42 5.22 1.51 0.10 -0.67 117.35 128.36 2hta s TYR 211 Ca 0.03 1.66 0.23 0.00 -1.01 0.00 0.00 57.07 57.98 2hta s TYR 211 Cb -0.20 -3.06 -0.00 0.00 -0.11 0.00 0.00 41.96 38.58 2hta s TYR 211 CO 0.07 0.05 0.97 1.28 -1.11 0.00 0.00 175.55 176.81 2hta n LEU 212 N 3.67 0.60 -2.71 -1.29 4.77 -0.62 -2.65 117.00 118.77 2hta n LEU 212 Ca 0.04 0.10 -0.05 0.00 -0.03 0.00 0.00 56.01 56.07 2hta n LEU 212 Cb 0.51 -0.08 0.07 0.00 -2.33 0.00 0.00 43.42 41.59 2hta n LEU 212 CO 0.51 -0.04 0.13 -3.20 -1.33 0.00 0.00 177.39 173.46 2hta n ASN 213 N -2.22 0.42 -4.81 -1.43 5.15 -1.26 -4.88 115.26 106.24 2hta n ASN 213 Ca 0.01 -2.43 -0.32 0.00 -0.60 0.00 0.00 54.58 51.24 2hta n ASN 213 Cb 0.49 -0.05 0.04 0.00 -0.53 0.00 0.00 39.78 39.74 2hta n ASN 213 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 2hta s PRO 214 N -2.21 2.95 0.83 1.20 0.04 -1.25 -4.14 135.00 132.42 2hta s PRO 214 Ca 0.24 1.07 -0.12 0.00 0.04 0.00 0.00 61.00 62.23 2hta s PRO 214 Cb 0.41 -1.99 0.09 0.00 0.04 0.00 0.00 34.50 33.05 2hta s PRO 214 CO -0.03 -1.09 1.12 -1.21 0.04 0.00 0.00 177.00 175.83 2hta s GLU 215 N -4.71 1.79 0.30 4.56 2.02 -0.07 -4.87 118.70 117.73 2hta s GLU 215 Ca 0.60 0.44 0.00 0.00 0.02 0.00 0.00 54.97 56.03 2hta s GLU 215 Cb -0.15 -1.90 0.52 0.00 0.10 0.00 0.00 34.13 32.69 2hta s GLU 215 CO 0.49 -1.78 1.93 0.00 0.02 0.00 0.00 175.26 175.92 2hta h ALA 216 N -1.20 1.50 -3.12 5.21 0.00 -1.87 -3.39 119.26 116.38 2hta h ALA 216 Ca -0.48 -0.03 -0.67 0.00 0.00 0.00 0.00 54.91 53.72 2hta h ALA 216 Cb 1.30 -0.28 -0.29 0.00 0.00 0.00 0.00 17.79 18.52 2hta h ALA 216 CO 0.61 0.40 -0.68 0.00 0.00 0.00 0.00 179.25 179.58 2hta s SER 218 N 1.43 7.14 -0.14 0.00 0.01 0.19 -4.50 113.70 117.81 2hta s SER 218 Ca 0.02 1.45 0.01 0.00 1.31 0.00 0.00 55.95 58.75 2hta s SER 218 Cb -0.17 -2.43 0.02 0.00 0.21 0.00 0.00 66.02 63.65 2hta s SER 218 CO -0.01 0.10 -0.18 -0.69 0.41 0.00 0.00 173.24 172.87 2hta s VAL 219 N -1.39 1.80 -0.24 3.43 1.01 -0.19 -0.81 120.40 124.01 2hta s VAL 219 Ca 0.40 -0.80 -0.17 0.00 0.00 0.00 0.00 61.98 61.41 2hta s VAL 219 Cb -0.18 -1.63 -0.03 0.00 0.00 0.00 0.00 36.38 34.53 2hta s VAL 219 CO 0.22 0.50 0.44 -0.63 0.00 0.00 0.00 175.10 175.63 2hta s ILE 220 N 1.15 5.14 -0.25 2.22 1.01 0.41 -0.47 121.20 130.41 2hta s ILE 220 Ca -0.01 0.75 -0.09 0.00 0.00 0.00 0.00 60.65 61.31 2hta s ILE 220 Cb -0.14 -3.77 -0.04 0.00 0.01 0.00 0.00 42.46 38.52 2hta s ILE 220 CO -0.07 0.16 0.11 -1.00 0.00 0.00 0.00 174.94 174.14 2hta s HIS 221 N 1.93 3.17 -0.34 3.97 3.76 0.37 -1.29 115.29 126.85 2hta s HIS 221 Ca 0.19 -0.12 0.02 0.00 -0.15 0.00 0.00 55.06 55.00 2hta s HIS 221 Cb -0.15 -2.25 0.10 0.00 1.11 0.00 0.00 32.58 31.39 2hta s HIS 221 CO 0.09 -0.17 0.09 0.34 -0.85 0.00 0.00 174.74 174.24 2hta s ASP 222 N 1.39 4.37 0.28 1.40 -1.08 -0.43 -3.26 116.67 119.33 2hta s ASP 222 Ca 0.06 -2.01 0.04 0.00 -0.52 0.00 0.00 52.55 50.12 2hta s ASP 222 Cb -0.15 -1.27 0.40 0.00 -1.46 0.00 0.00 42.92 40.44 2hta s ASP 222 CO 0.05 -0.38 1.68 0.00 0.52 0.00 0.00 175.17 177.05 2hta h ALA 223 N 7.71 1.06 -0.16 3.66 0.00 -1.86 -0.59 119.26 129.07 2hta h ALA 223 Ca -0.08 -0.40 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 2hta h ALA 223 Cb 1.01 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.69 2hta h ALA 223 CO 0.51 0.59 -0.10 1.15 0.00 0.00 0.00 179.25 181.40 2hta h THR 224 N 0.29 1.32 -0.01 0.00 2.02 -1.93 -2.85 112.91 111.74 2hta h THR 224 Ca 0.03 -1.19 0.00 0.00 0.77 0.00 0.00 66.41 66.02 2hta h THR 224 Cb 0.80 1.76 0.00 0.00 -1.74 0.00 0.00 68.15 68.97 2hta h THR 224 CO 0.06 0.35 -0.01 0.18 0.37 0.00 0.00 175.52 176.48 2hta n LEU 225 N -4.59 1.39 -3.53 2.58 4.77 -1.24 -4.95 117.00 111.43 2hta n LEU 225 Ca -0.06 -0.46 -0.20 0.00 -0.03 0.00 0.00 56.01 55.26 2hta n LEU 225 Cb 0.32 -0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.49 2hta n LEU 225 CO 0.39 0.23 0.13 0.59 -1.33 0.00 0.00 177.39 177.40 2hta n ASN 226 N 0.08 -3.32 -3.89 -1.43 3.02 -0.33 -4.95 115.26 104.44 2hta n ASN 226 Ca 0.19 -0.63 -0.09 0.00 -0.03 0.00 0.00 54.58 54.02 2hta n ASN 226 Cb 0.34 -4.93 -0.06 0.00 -0.61 0.00 0.00 39.78 34.52 2hta n ASN 226 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2hta s ARG 227 N -5.76 1.16 0.10 3.52 1.70 -0.60 -1.82 118.95 117.25 2hta s ARG 227 Ca 0.20 -1.06 0.08 0.00 -0.47 0.00 0.00 55.73 54.48 2hta s ARG 227 Cb -0.09 0.41 -0.04 0.00 -0.57 0.00 0.00 34.95 34.66 2hta s ARG 227 CO 0.74 -0.44 -0.14 0.95 -1.08 0.00 0.00 175.30 175.34 2hta s THR 228 N -3.93 3.10 -0.17 4.99 -4.23 0.93 -1.32 115.64 115.02 2hta s THR 228 Ca 0.13 -1.35 -0.02 0.00 -1.18 0.00 0.00 61.69 59.28 2hta s THR 228 Cb 0.03 -2.42 -0.01 0.00 1.34 0.00 0.00 72.50 71.43 2hta s THR 228 CO -0.03 0.14 -0.10 -0.63 -0.54 0.00 0.00 174.62 173.47 2hta s ILE 229 N -1.15 3.17 -0.16 2.99 1.01 -0.41 -1.10 121.20 125.55 2hta s ILE 229 Ca 0.19 -0.59 -0.16 0.00 0.00 0.00 0.00 60.65 60.08 2hta s ILE 229 Cb -0.11 -2.38 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 2hta s ILE 229 CO 0.11 0.49 0.41 -1.81 0.00 0.00 0.00 174.94 174.14 2hta s ASP 230 N 0.83 6.54 -0.27 3.58 1.01 0.11 -0.45 116.67 128.02 2hta s ASP 230 Ca -0.03 0.64 0.03 0.00 0.71 0.00 0.00 52.55 53.90 2hta s ASP 230 Cb -0.15 -2.24 0.06 0.00 1.01 0.00 0.00 42.92 41.60 2hta s ASP 230 CO 0.01 -0.01 -0.09 -0.69 0.21 0.00 0.00 175.17 174.60 2hta s VAL 231 N 0.85 2.20 -0.17 -1.27 1.01 0.01 -1.44 120.40 121.59 2hta s VAL 231 Ca 0.21 -1.72 -0.08 0.00 0.00 0.00 0.00 61.98 60.39 2hta s VAL 231 Cb -0.14 -2.34 -0.04 0.00 0.00 0.00 0.00 36.38 33.85 2hta s VAL 231 CO 0.08 -0.10 0.09 -0.69 0.00 0.00 0.00 175.10 174.48 2hta s VAL 232 N 1.08 5.07 -0.12 2.92 1.01 0.84 -0.64 120.40 130.55 2hta s VAL 232 Ca -0.06 0.06 -0.01 0.00 0.00 0.00 0.00 61.98 61.97 2hta s VAL 232 Cb -0.20 -3.27 -0.02 0.00 0.00 0.00 0.00 36.38 32.89 2hta s VAL 232 CO -0.05 0.49 -0.09 -1.00 0.00 0.00 0.00 175.10 174.44 2hta s HIS 233 N 0.08 2.89 0.01 5.22 3.76 0.33 -1.38 115.29 126.20 2hta s HIS 233 Ca 0.07 -0.35 0.03 0.00 -0.15 0.00 0.00 55.06 54.66 2hta s HIS 233 Cb -0.12 -1.83 -0.01 0.00 1.11 0.00 0.00 32.58 31.73 2hta s HIS 233 CO 0.00 -0.01 -0.10 -1.01 -0.85 0.00 0.00 174.74 172.78 2hta s HIS 234 N 0.02 0.84 -0.19 1.40 3.76 -0.33 -4.80 115.29 116.00 2hta s HIS 234 Ca -0.02 -0.24 0.00 0.00 -0.15 0.00 0.00 55.06 54.65 2hta s HIS 234 Cb -0.14 -0.53 0.00 0.00 1.11 0.00 0.00 32.58 33.03 2hta s HIS 234 CO 0.03 -0.01 0.00 0.72 -0.85 0.00 0.00 174.74 174.63 2hta n HIS 235 N 2.46 0.00 -2.76 1.40 8.25 -1.26 -2.01 115.22 121.30 2hta n HIS 235 Ca -0.16 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.10 2hta n HIS 235 Cb 0.56 -1.34 0.05 0.00 1.12 0.00 0.00 29.99 30.38 2hta n HIS 235 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2hta s HIS 236 N -1.56 2.34 -0.06 4.41 -0.00 -1.26 -4.74 115.29 114.42 2hta s HIS 236 Ca 0.00 -0.26 0.08 0.00 -0.00 0.00 0.00 55.06 54.88 2hta s HIS 236 Cb 0.00 -2.65 -0.11 0.00 -0.00 0.00 0.00 32.58 29.82 2hta s HIS 236 CO 0.00 -1.02 0.07 -0.11 -0.00 0.00 0.00 174.74 173.69 2hta n LEU 237 N -2.34 0.00 -4.03 5.38 7.94 -0.27 -5.00 117.00 118.67 2hta n LEU 237 Ca 0.11 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.92 2hta n LEU 237 Cb 0.60 0.14 -0.09 0.00 0.53 0.00 0.00 43.42 44.60 2hta n LEU 237 CO 0.42 0.14 -0.24 0.20 -1.11 0.00 0.00 177.39 176.81 2hta s ASN 238 N -3.72 0.31 0.01 1.96 0.02 -0.38 -4.71 114.94 108.43 2hta s ASN 238 Ca -0.04 -0.95 0.07 0.00 -1.02 0.00 0.00 52.86 50.92 2hta s ASN 238 Cb 0.03 0.28 -0.02 0.00 0.02 0.00 0.00 41.25 41.56 2hta s ASN 238 CO 0.34 -0.69 -0.22 -0.69 0.02 0.00 0.00 177.10 175.86 2hta s VAL 239 N -3.94 1.72 -0.12 1.60 1.01 -1.08 -1.64 120.40 117.94 2hta s VAL 239 Ca 0.12 -1.07 -0.00 0.00 0.00 0.00 0.00 61.98 61.03 2hta s VAL 239 Cb 0.07 -1.45 -0.02 0.00 0.00 0.00 0.00 36.38 34.97 2hta s VAL 239 CO -0.06 0.36 -0.12 -0.69 0.00 0.00 0.00 175.10 174.59 2hta s VAL 240 N -0.64 3.18 -0.16 2.92 1.01 -0.80 0.03 120.40 125.94 2hta s VAL 240 Ca 0.08 -0.62 -0.04 0.00 0.00 0.00 0.00 61.98 61.40 2hta s VAL 240 Cb -0.09 -2.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.93 2hta s VAL 240 CO 0.00 0.53 -0.03 -0.83 0.00 0.00 0.00 175.10 174.78 2hta s GLY 241 N 0.20 1.74 -0.08 4.51 0.00 -0.58 -0.63 107.32 112.49 2hta s GLY 241 Ca -0.07 -0.81 -0.06 0.00 0.00 0.00 0.00 44.72 43.78 2hta s GLY 241 CO 0.05 -0.07 0.20 0.86 0.00 0.00 0.00 173.10 174.14 2hta s TRP 242 N 0.34 -0.22 -0.06 1.90 -0.00 -0.37 -1.79 118.94 118.73 2hta s TRP 242 Ca -0.03 0.55 -0.04 0.00 -0.00 0.00 0.00 56.10 56.58 2hta s TRP 242 Cb -0.14 0.05 0.03 0.00 -0.00 0.00 0.00 33.47 33.41 2hta s TRP 242 CO 0.03 -0.13 0.15 1.21 -0.00 0.00 0.00 176.95 178.20 2hta s ASN 243 N 0.40 -0.13 0.37 5.86 3.84 -0.64 -0.75 114.94 123.89 2hta s ASN 243 Ca -0.02 0.30 0.26 0.00 0.21 0.00 0.00 52.86 53.61 2hta s ASN 243 Cb -0.04 0.24 0.81 0.00 -0.55 0.00 0.00 41.25 41.71 2hta s ASN 243 CO -0.02 -0.10 1.76 1.55 -2.79 0.00 0.00 177.10 177.50 2hta h PRO 244 N 6.61 0.00 0.00 0.43 0.13 -1.90 -1.73 132.00 135.53 2hta h PRO 244 Ca -0.34 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 64.99 2hta h PRO 244 Cb 1.17 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.25 2hta h PRO 244 CO 0.42 0.00 -0.27 0.41 -0.23 0.00 0.00 178.00 178.33 2hta n GLY 245 N 0.74 -2.03 0.15 1.56 0.00 -1.26 -4.24 105.19 100.10 2hta n GLY 245 Ca 0.03 -1.32 -0.15 0.00 0.00 0.00 0.00 46.02 44.59 2hta n GLY 245 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2hta h PRO 246 N 0.00 0.41 -0.00 1.61 0.13 -1.95 -2.11 132.00 130.08 2hta h PRO 246 Ca 0.02 -0.32 0.03 0.00 -0.87 0.00 0.00 66.00 64.86 2hta h PRO 246 Cb 0.68 0.06 -0.04 0.00 0.13 0.00 0.00 31.00 31.83 2hta h PRO 246 CO 0.01 0.94 -0.26 0.00 -0.23 0.00 0.00 178.00 178.46 2hta h ALA 247 N 0.47 -0.35 -0.66 -0.56 0.00 -1.93 -0.39 119.26 115.84 2hta h ALA 247 Ca -0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.86 2hta h ALA 247 Cb 0.99 0.45 -0.03 0.00 0.00 0.00 0.00 17.79 19.21 2hta h ALA 247 CO 0.08 -0.76 0.30 -0.07 0.00 0.00 0.00 179.25 178.79 2hta h LEU 248 N -0.39 0.86 -1.15 0.00 3.38 -1.74 -1.47 115.31 114.80 2hta h LEU 248 Ca 0.06 -0.10 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2hta h LEU 248 Cb 0.48 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2hta h LEU 248 CO -0.23 0.75 0.50 -1.28 0.09 0.00 0.00 178.44 178.27 2hta h SER 249 N 0.94 0.95 -0.36 -0.43 0.87 -0.91 -1.45 113.55 113.15 2hta h SER 249 Ca 0.23 -0.05 -0.07 0.00 -1.23 0.00 0.00 61.79 60.68 2hta h SER 249 Cb 0.13 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.84 2hta h SER 249 CO -0.03 0.72 -0.03 0.58 -0.53 0.00 0.00 176.83 177.54 2hta h VAL 250 N 1.10 1.27 0.00 2.23 2.07 -0.53 -3.28 116.25 119.10 2hta h VAL 250 Ca 0.29 -1.05 0.00 0.00 0.82 0.00 0.00 66.70 66.76 2hta h VAL 250 Cb -0.07 1.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.92 2hta h VAL 250 CO -0.06 0.35 -0.14 0.77 0.02 0.00 0.00 177.57 178.51 2hta h SER 251 N 0.47 0.00 -3.29 0.57 4.64 -0.98 -3.43 113.55 111.54 2hta h SER 251 Ca 0.10 -0.03 -0.57 0.00 -0.47 0.00 0.00 61.79 60.82 2hta h SER 251 Cb 0.51 0.00 -0.06 0.00 -0.31 0.00 0.00 62.40 62.54 2hta h SER 251 CO 0.02 0.02 0.92 -0.04 -0.87 0.00 0.00 176.83 176.88 2hta s MET 252 N -3.15 3.95 0.53 4.77 -1.94 -0.57 -4.92 119.30 117.96 2hta s MET 252 Ca 0.09 1.09 0.31 0.00 -1.71 0.00 0.00 55.69 55.46 2hta s MET 252 Cb 0.10 -3.83 1.39 0.00 2.01 0.00 0.00 34.83 34.51 2hta s MET 252 CO 0.64 -1.07 2.01 0.78 -0.01 0.00 0.00 175.02 177.37 2hta h GLY 253 N 10.63 0.00 -2.19 -0.03 0.00 -1.88 -2.80 103.07 106.80 2hta h GLY 253 Ca -0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.10 2hta h GLY 253 CO 1.05 0.00 0.00 2.09 0.00 0.00 0.00 176.54 179.68 2hta n ASP 254 N -3.29 3.28 -4.22 0.19 3.85 -1.26 -4.86 116.55 110.23 2hta n ASP 254 Ca -0.00 -2.25 -0.26 0.00 -0.71 0.00 0.00 54.79 51.57 2hta n ASP 254 Cb 0.30 -0.45 -0.15 0.00 -1.35 0.00 0.00 41.12 39.47 2hta n ASP 254 CO 0.00 0.00 0.00 -0.32 -1.01 0.00 0.00 177.20 175.87 2hta s MET 255 N -1.67 1.49 0.55 0.11 1.75 -1.06 -3.00 119.30 117.47 2hta s MET 255 Ca 0.35 -0.80 -0.21 0.00 -1.25 0.00 0.00 55.69 53.78 2hta s MET 255 Cb 0.22 -1.51 -0.05 0.00 2.84 0.00 0.00 34.83 36.33 2hta s MET 255 CO 0.18 0.40 1.32 -2.14 -0.65 0.00 0.00 175.02 174.14 2hta s PRO 256 N -0.76 3.16 0.29 4.11 0.02 -1.26 -4.87 135.00 135.69 2hta s PRO 256 Ca 0.07 2.15 0.03 0.00 0.02 0.00 0.00 61.00 63.28 2hta s PRO 256 Cb -0.08 -2.23 0.63 0.00 0.02 0.00 0.00 34.50 32.84 2hta s PRO 256 CO 0.00 -1.15 1.81 -0.44 -0.33 0.00 0.00 177.00 176.90 2hta h ASP 257 N 1.43 0.87 -0.58 2.53 3.32 -1.90 0.11 116.42 122.19 2hta h ASP 257 Ca -0.51 0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.61 2hta h ASP 257 Cb 1.30 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 40.75 2hta h ASP 257 CO 0.57 0.40 0.00 0.47 -1.72 0.00 0.00 179.24 178.97 2hta n ASP 258 N -4.68 3.69 -0.36 6.45 8.00 -1.26 -3.92 116.55 124.47 2hta n ASP 258 Ca 0.21 -2.19 0.10 0.00 0.71 0.00 0.00 54.79 53.62 2hta n ASP 258 Cb 0.44 -0.47 0.28 0.00 -0.02 0.00 0.00 41.12 41.35 2hta n ASP 258 CO 0.00 0.00 0.00 1.23 -0.39 0.00 0.00 177.20 178.04 2hta h GLY 259 N 4.55 1.71 1.59 0.44 0.00 -1.30 -1.89 103.07 108.16 2hta h GLY 259 Ca 0.00 -0.40 0.03 0.00 0.00 0.00 0.00 47.33 46.96 2hta h GLY 259 CO 0.10 0.06 0.17 0.10 0.00 0.00 0.00 176.54 176.97 2hta h TYR 260 N 0.89 0.00 -0.14 5.60 -0.00 -1.81 -1.97 116.97 119.53 2hta h TYR 260 Ca 0.53 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 59.25 2hta h TYR 260 Cb 0.68 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 37.40 2hta h TYR 260 CO -0.00 0.00 0.04 0.87 -0.00 0.00 0.00 178.16 179.07 2hta h LYS 261 N 0.00 0.20 -0.03 0.10 1.57 -1.71 -3.29 116.57 113.41 2hta h LYS 261 Ca 0.05 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.81 2hta h LYS 261 Cb 0.40 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.66 2hta h LYS 261 CO -0.00 0.18 -0.03 0.25 -0.57 0.00 0.00 179.45 179.28 2hta n THR 262 N -4.46 1.95 -3.96 -0.16 -2.24 -0.74 -0.64 114.28 104.03 2hta n THR 262 Ca -0.01 -2.31 -0.08 0.00 -2.27 0.00 0.00 64.05 59.38 2hta n THR 262 Cb 0.12 -0.24 -0.09 0.00 -2.10 0.00 0.00 70.33 68.02 2hta n THR 262 CO 0.00 0.00 0.00 0.72 -0.57 0.00 0.00 175.07 175.22 2hta s PHE 263 N -2.90 0.30 -0.00 4.78 -0.12 -1.24 -0.77 117.98 118.01 2hta s PHE 263 Ca 0.33 -0.73 0.02 0.00 -0.05 0.00 0.00 56.93 56.50 2hta s PHE 263 Cb 0.29 -0.20 -0.01 0.00 -0.63 0.00 0.00 43.02 42.48 2hta s PHE 263 CO 0.03 -0.43 -0.06 0.54 -0.05 0.00 0.00 175.22 175.25 2hta s VAL 264 N -3.48 0.49 -0.16 -2.49 0.11 -0.73 -4.86 120.40 109.28 2hta s VAL 264 Ca 0.02 -0.28 -0.17 0.00 -2.93 0.00 0.00 61.98 58.63 2hta s VAL 264 Cb 0.04 -0.42 -0.04 0.00 -1.53 0.00 0.00 36.38 34.43 2hta s VAL 264 CO -0.09 0.13 0.42 0.00 -3.33 0.00 0.00 175.10 172.23 2hta s VAL 266 N 0.92 1.23 -0.08 0.00 1.01 -1.02 -1.23 120.40 121.23 2hta s VAL 266 Ca 0.22 -1.32 -0.01 0.00 0.00 0.00 0.00 61.98 60.87 2hta s VAL 266 Cb -0.15 -1.74 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 2hta s VAL 266 CO 0.08 -0.39 -0.02 -1.61 0.00 0.00 0.00 175.10 173.16 2hta s GLU 267 N 1.49 2.93 -0.19 2.72 2.02 0.20 -4.16 118.70 123.70 2hta s GLU 267 Ca 0.03 -0.45 -0.21 0.00 0.02 0.00 0.00 54.97 54.36 2hta s GLU 267 Cb -0.18 -2.74 -0.03 0.00 0.10 0.00 0.00 34.13 31.29 2hta s GLU 267 CO -0.13 0.68 0.62 0.99 0.02 0.00 0.00 175.26 177.44 2hta s THR 268 N -0.82 5.03 0.02 3.63 2.01 -0.79 -1.90 115.64 122.81 2hta s THR 268 Ca 0.13 1.18 0.02 0.00 0.31 0.00 0.00 61.69 63.33 2hta s THR 268 Cb -0.11 -3.94 -0.01 0.00 0.01 0.00 0.00 72.50 68.44 2hta s THR 268 CO 0.02 0.12 -0.08 -0.69 -0.69 0.00 0.00 174.62 173.30 2hta s VAL 269 N 1.85 0.57 -0.48 3.82 1.01 -0.65 -0.38 120.40 126.14 2hta s VAL 269 Ca 0.29 -0.62 0.03 0.00 0.00 0.00 0.00 61.98 61.67 2hta s VAL 269 Cb -0.16 -0.54 0.15 0.00 0.00 0.00 0.00 36.38 35.83 2hta s VAL 269 CO 0.10 -0.06 0.29 -0.47 0.00 0.00 0.00 175.10 174.97 2hta s TYR 270 N -0.65 2.11 0.00 5.22 5.04 0.26 -1.12 117.35 128.21 2hta s TYR 270 Ca -0.02 -2.55 0.00 0.00 -2.44 0.00 0.00 57.07 52.06 2hta s TYR 270 Cb -0.06 -1.88 0.00 0.00 0.35 0.00 0.00 41.96 40.37 2hta s TYR 270 CO 0.00 -0.75 0.00 0.00 -1.34 0.00 0.00 175.55 173.46 2hta n ALA 271 N 3.21 1.98 0.96 3.97 0.00 -1.26 -1.98 120.51 127.38 2hta n ALA 271 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.68 2hta n ALA 271 Cb 0.36 0.39 0.54 0.00 0.00 0.00 0.00 19.45 20.74 2hta n ALA 271 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2hta n THR 272 N -2.26 0.35 -3.80 0.00 -2.24 -1.26 -4.67 114.28 100.40 2hta n THR 272 Ca 0.00 0.09 -0.09 0.00 -2.27 0.00 0.00 64.05 61.77 2hta n THR 272 Cb 0.41 -0.71 -0.06 0.00 -2.10 0.00 0.00 70.33 67.87 2hta n THR 272 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hta s ALA 273 N -2.75 -0.42 0.32 6.98 0.00 -1.26 -5.16 121.76 119.47 2hta s ALA 273 Ca 0.17 -0.48 -0.15 0.00 0.00 0.00 0.00 51.96 51.51 2hta s ALA 273 Cb 0.15 0.62 -0.09 0.00 0.00 0.00 0.00 23.12 23.80 2hta s ALA 273 CO 0.37 -0.58 0.73 -1.25 0.00 0.00 0.00 175.76 175.03 2hta s PRO 274 N -3.86 3.98 -0.07 0.00 0.04 -1.26 -4.86 135.00 128.96 2hta s PRO 274 Ca 0.06 0.65 -0.13 0.00 0.04 0.00 0.00 61.00 61.62 2hta s PRO 274 Cb 0.03 -2.43 -0.05 0.00 0.04 0.00 0.00 34.50 32.09 2hta s PRO 274 CO -0.09 0.15 0.32 -1.14 0.04 0.00 0.00 177.00 176.28 2hta s GLN 275 N -3.02 3.91 0.02 4.56 0.74 0.39 -4.84 119.66 121.42 2hta s GLN 275 Ca 0.54 0.21 -0.25 0.00 0.05 0.00 0.00 55.36 55.90 2hta s GLN 275 Cb -0.10 -3.28 -0.05 0.00 1.10 0.00 0.00 33.01 30.68 2hta s GLN 275 CO 0.18 0.57 0.77 -0.65 -0.55 0.00 0.00 175.29 175.61 2hta s GLN 276 N -0.59 4.49 -0.07 1.67 -1.52 -1.26 -1.75 119.66 120.64 2hta s GLN 276 Ca 0.20 1.06 0.03 0.00 -1.95 0.00 0.00 55.36 54.70 2hta s GLN 276 Cb -0.15 -3.39 0.01 0.00 -0.22 0.00 0.00 33.01 29.26 2hta s GLN 276 CO 0.09 0.21 -0.17 0.00 -0.25 0.00 0.00 175.29 175.17 2hta s ALA 277 N 0.21 1.57 0.40 6.09 0.00 -0.52 -4.01 121.76 125.49 2hta s ALA 277 Ca 0.40 -0.63 0.04 0.00 0.00 0.00 0.00 51.96 51.76 2hta s ALA 277 Cb -0.20 -0.61 -0.03 0.00 0.00 0.00 0.00 23.12 22.28 2hta s ALA 277 CO 0.22 0.21 0.13 0.95 0.00 0.00 0.00 175.76 177.27 2hta s THR 278 N 0.40 0.63 0.00 0.00 -4.23 -0.91 -2.08 115.64 109.45 2hta s THR 278 Ca -0.13 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.38 2hta s THR 278 Cb -0.15 -2.38 0.00 0.00 1.34 0.00 0.00 72.50 71.31 2hta s THR 278 CO 0.05 0.00 0.00 -1.84 -0.54 0.00 0.00 174.62 172.29 2hta n GLU 279 N -0.89 0.00 -3.77 3.99 0.28 -1.23 -1.63 120.64 117.38 2hta n GLU 279 Ca -0.06 0.00 -0.30 0.00 -0.16 0.00 0.00 57.16 56.65 2hta n GLU 279 Cb 0.65 0.00 -0.15 0.00 1.43 0.00 0.00 31.44 33.37 2hta n GLU 279 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 2hta s GLU 280 N -0.26 0.83 -0.38 3.44 2.56 -1.26 -5.14 118.70 118.49 2hta s GLU 280 Ca 0.00 -1.03 0.01 0.00 0.00 0.00 0.00 54.97 53.95 2hta s GLU 280 Cb 0.00 -2.13 0.12 0.00 2.00 0.00 0.00 34.13 34.11 2hta s GLU 280 CO 0.00 -0.90 0.17 0.21 -0.56 0.00 0.00 175.26 174.17 2hta s LYS 281 N 1.58 1.10 0.82 4.30 2.47 -0.65 -5.15 119.74 124.22 2hta s LYS 281 Ca 0.07 -1.66 -0.12 0.00 -1.56 0.00 0.00 55.97 52.71 2hta s LYS 281 Cb -0.17 -2.31 0.09 0.00 -1.46 0.00 0.00 37.83 33.97 2hta s LYS 281 CO -0.20 -1.07 1.15 -1.25 0.16 0.00 0.00 175.35 174.13 2hta s PRO 282 N 0.87 1.70 0.53 4.03 0.04 -1.18 -2.14 135.00 138.84 2hta s PRO 282 Ca 0.14 1.51 -0.11 0.00 0.04 0.00 0.00 61.00 62.58 2hta s PRO 282 Cb -0.21 -1.81 -0.05 0.00 0.04 0.00 0.00 34.50 32.47 2hta s PRO 282 CO -0.10 -2.12 0.92 -1.54 0.04 0.00 0.00 177.00 174.20 2hta s SER 283 N -2.66 6.38 0.02 6.66 1.04 -0.66 -4.85 113.70 119.62 2hta s SER 283 Ca 0.67 1.29 -0.00 0.00 0.48 0.00 0.00 55.95 58.40 2hta s SER 283 Cb -0.23 -2.40 -0.02 0.00 0.10 0.00 0.00 66.02 63.47 2hta s SER 283 CO 0.53 -0.66 -0.02 -0.13 0.98 0.00 0.00 173.24 173.94 2hta s ARG 284 N -4.60 0.25 -0.07 4.02 0.52 -1.26 -1.39 118.95 116.42 2hta s ARG 284 Ca 0.53 -0.49 -0.05 0.00 -0.52 0.00 0.00 55.73 55.20 2hta s ARG 284 Cb -0.10 0.09 0.03 0.00 0.52 0.00 0.00 34.95 35.48 2hta s ARG 284 CO 0.43 -0.04 0.18 -1.17 0.02 0.00 0.00 175.30 174.72 2hta s LEU 285 N -1.17 0.99 0.01 2.53 2.96 -0.13 -4.76 118.68 119.10 2hta s LEU 285 Ca -0.13 0.38 -0.03 0.00 -0.22 0.00 0.00 54.13 54.13 2hta s LEU 285 Cb -0.08 0.57 -0.01 0.00 0.50 0.00 0.00 46.19 47.17 2hta s LEU 285 CO -0.01 -0.10 0.03 0.00 -1.32 0.00 0.00 176.35 174.95 2hta s ALA 286 N 0.60 -0.05 -0.02 5.97 0.00 -0.85 0.19 121.76 127.60 2hta s ALA 286 Ca -0.04 -0.36 0.01 0.00 0.00 0.00 0.00 51.96 51.57 2hta s ALA 286 Cb -0.06 0.11 0.01 0.00 0.00 0.00 0.00 23.12 23.18 2hta s ALA 286 CO -0.03 -0.16 -0.04 -1.14 0.00 0.00 0.00 175.76 174.39 2hta s GLN 287 N -1.26 0.47 -0.05 0.00 0.74 -0.32 -1.18 119.66 118.06 2hta s GLN 287 Ca -0.14 -0.10 0.07 0.00 0.05 0.00 0.00 55.36 55.24 2hta s GLN 287 Cb -0.08 -0.51 -0.01 0.00 1.10 0.00 0.00 33.01 33.51 2hta s GLN 287 CO -0.00 0.01 -0.25 0.99 -0.55 0.00 0.00 175.29 175.49 2hta s THR 288 N 0.37 2.08 -0.07 -0.34 2.01 -0.48 -0.19 115.64 119.03 2hta s THR 288 Ca -0.04 -1.07 0.05 0.00 0.31 0.00 0.00 61.69 60.94 2hta s THR 288 Cb -0.07 -1.74 -0.01 0.00 0.01 0.00 0.00 72.50 70.68 2hta s THR 288 CO -0.00 0.57 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.64 2hta s ILE 289 N -0.29 2.26 -0.01 1.82 1.01 0.35 -0.11 121.20 126.22 2hta s ILE 289 Ca 0.00 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.67 2hta s ILE 289 Cb -0.13 -1.84 0.01 0.00 0.01 0.00 0.00 42.46 40.51 2hta s ILE 289 CO 0.02 0.57 -0.02 0.00 0.00 0.00 0.00 174.94 175.51 2hta s VAL 291 N 0.37 4.30 0.02 0.00 1.01 -1.26 0.07 120.40 124.91 2hta s VAL 291 Ca -0.04 -0.25 0.02 0.00 0.00 0.00 0.00 61.98 61.72 2hta s VAL 291 Cb -0.06 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.49 2hta s VAL 291 CO -0.01 0.59 -0.07 0.00 0.00 0.00 0.00 175.10 175.62 2hta s ALA 292 N -0.76 0.55 0.76 5.51 0.00 -0.26 -5.00 121.76 122.57 2hta s ALA 292 Ca 0.12 -0.54 -0.13 0.00 0.00 0.00 0.00 51.96 51.40 2hta s ALA 292 Cb -0.12 -0.04 0.06 0.00 0.00 0.00 0.00 23.12 23.03 2hta s ALA 292 CO 0.02 0.05 1.16 0.15 0.00 0.00 0.00 175.76 177.15 2hta s LYS 293 N -0.93 2.01 0.00 0.00 3.01 -1.26 -0.05 119.74 122.52 2hta s LYS 293 Ca -0.04 1.58 0.00 0.00 -1.01 0.00 0.00 55.97 56.50 2hta s LYS 293 Cb -0.06 -1.84 0.00 0.00 -1.01 0.00 0.00 37.83 34.92 2hta s LYS 293 CO 0.00 -1.89 0.00 -2.13 0.51 0.00 0.00 175.35 171.84