#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1h66 s GLY 2 N 0.00 1.17 0.00 0.00 0.00 -1.26 -5.00 107.32 102.23 1h66 s GLY 2 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 44.72 43.64 1h66 s GLY 2 CO 0.00 -0.99 0.00 0.54 0.00 0.00 0.00 173.10 172.65 1h66 n ARG 3 N 1.93 3.52 -4.65 2.90 1.74 -1.26 -4.95 116.66 115.89 1h66 n ARG 3 Ca -0.17 0.00 -0.26 0.00 -0.77 0.00 0.00 57.85 56.66 1h66 n ARG 3 Cb 0.53 -0.27 -0.17 0.00 -1.02 0.00 0.00 32.46 31.53 1h66 n ARG 3 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1h66 s ARG 4 N -0.53 1.88 0.09 5.56 3.52 -1.26 -0.43 118.95 127.79 1h66 s ARG 4 Ca 0.00 -0.47 0.09 0.00 -0.13 0.00 0.00 55.73 55.21 1h66 s ARG 4 Cb 0.00 -1.53 -0.03 0.00 -1.56 0.00 0.00 34.95 31.82 1h66 s ARG 4 CO 0.00 0.04 -0.22 0.00 -0.81 0.00 0.00 175.30 174.30 1h66 s ALA 5 N 0.65 1.93 -0.09 6.12 0.00 0.21 -0.06 121.76 130.53 1h66 s ALA 5 Ca -0.15 -1.25 0.03 0.00 0.00 0.00 0.00 51.96 50.59 1h66 s ALA 5 Cb -0.16 -0.30 0.01 0.00 0.00 0.00 0.00 23.12 22.67 1h66 s ALA 5 CO 0.04 0.41 -0.17 -1.17 0.00 0.00 0.00 175.76 174.87 1h66 s LEU 6 N -1.76 1.81 -0.24 0.00 2.96 0.38 -1.06 118.68 120.77 1h66 s LEU 6 Ca 0.08 -0.42 -0.03 0.00 -0.22 0.00 0.00 54.13 53.54 1h66 s LEU 6 Cb -0.10 -1.10 0.01 0.00 0.50 0.00 0.00 46.19 45.51 1h66 s LEU 6 CO 0.04 0.07 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.47 1h66 s ILE 7 N 0.68 3.21 -0.35 6.68 1.01 -0.37 -0.65 121.20 131.41 1h66 s ILE 7 Ca -0.13 -0.75 -0.12 0.00 0.00 0.00 0.00 60.65 59.65 1h66 s ILE 7 Cb -0.16 -2.55 0.01 0.00 0.01 0.00 0.00 42.46 39.76 1h66 s ILE 7 CO 0.03 0.29 0.21 -0.69 0.00 0.00 0.00 174.94 174.78 1h66 s VAL 8 N 1.41 4.85 -0.13 2.92 1.01 0.12 -1.53 120.40 129.06 1h66 s VAL 8 Ca 0.03 -0.54 -0.04 0.00 0.00 0.00 0.00 61.98 61.43 1h66 s VAL 8 Cb -0.16 -3.59 -0.03 0.00 0.00 0.00 0.00 36.38 32.60 1h66 s VAL 8 CO -0.03 -0.10 0.00 -0.22 0.00 0.00 0.00 175.10 174.75 1h66 s LEU 9 N 1.63 3.54 -0.60 3.92 2.96 -0.57 -1.11 118.68 128.45 1h66 s LEU 9 Ca 0.04 0.06 0.05 0.00 -0.22 0.00 0.00 54.13 54.06 1h66 s LEU 9 Cb -0.18 -1.84 0.19 0.00 0.50 0.00 0.00 46.19 44.86 1h66 s LEU 9 CO 0.08 0.28 0.49 0.00 -1.32 0.00 0.00 176.35 175.88 1h66 n ALA 10 N 2.81 3.31 -3.57 5.97 0.00 -0.87 -1.99 120.51 126.17 1h66 n ALA 10 Ca -0.18 -4.13 -0.11 0.00 0.00 0.00 0.00 53.44 49.02 1h66 n ALA 10 Cb 0.53 -0.93 -0.08 0.00 0.00 0.00 0.00 19.45 18.97 1h66 n ALA 10 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1h66 s HIS 11 N -1.20 -0.75 0.04 0.00 5.04 -1.26 -4.45 115.29 112.71 1h66 s HIS 11 Ca 0.30 1.68 0.17 0.00 -1.54 0.00 0.00 55.06 55.67 1h66 s HIS 11 Cb 0.02 0.35 0.44 0.00 0.04 0.00 0.00 32.58 33.42 1h66 s HIS 11 CO -0.15 -0.38 1.61 0.66 -2.34 0.00 0.00 174.74 174.14 1h66 h SER 12 N 6.08 0.00 -3.46 9.88 4.64 -1.98 -3.43 113.55 125.29 1h66 h SER 12 Ca -0.30 0.00 -0.60 0.00 -0.47 0.00 0.00 61.79 60.41 1h66 h SER 12 Cb 1.19 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.16 1h66 h SER 12 CO 0.17 0.44 -0.30 -1.61 -0.87 0.00 0.00 176.83 174.67 1h66 s GLU 13 N -3.33 4.17 0.57 4.77 0.41 -1.26 -4.94 118.70 119.10 1h66 s GLU 13 Ca 0.02 0.08 0.35 0.00 -0.41 0.00 0.00 54.97 55.00 1h66 s GLU 13 Cb 0.10 -3.51 1.66 0.00 -1.78 0.00 0.00 34.13 30.60 1h66 s GLU 13 CO 0.71 0.05 2.10 0.00 -0.49 0.00 0.00 175.26 177.63 1h66 h ARG 14 N 7.23 0.00 -0.01 1.61 -0.00 -2.01 -2.45 114.38 118.75 1h66 h ARG 14 Ca -0.38 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.10 1h66 h ARG 14 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.13 1h66 h ARG 14 CO 0.71 0.03 -0.01 0.25 0.00 0.00 0.00 179.97 180.96 1h66 n THR 15 N -3.20 0.00 -1.81 2.04 -2.24 -1.26 -4.75 114.28 103.06 1h66 n THR 15 Ca -0.01 -0.24 -0.30 0.00 -2.27 0.00 0.00 64.05 61.23 1h66 n THR 15 Cb 0.23 0.46 0.05 0.00 -2.10 0.00 0.00 70.33 68.97 1h66 n THR 15 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1h66 s SER 16 N -2.02 5.41 0.31 3.42 1.04 -0.92 -4.96 113.70 115.99 1h66 s SER 16 Ca 0.38 1.24 0.08 0.00 0.48 0.00 0.00 55.95 58.12 1h66 s SER 16 Cb 0.21 -2.07 0.52 0.00 0.10 0.00 0.00 66.02 64.78 1h66 s SER 16 CO 0.34 -1.37 1.74 0.15 0.98 0.00 0.00 173.24 175.08 1h66 h PHE 17 N -0.68 0.23 -0.93 5.02 3.57 -1.93 -2.40 116.94 119.83 1h66 h PHE 17 Ca -0.45 -0.06 -0.00 0.00 3.53 0.00 0.00 57.97 60.99 1h66 h PHE 17 Cb 1.24 -0.05 -0.05 0.00 2.79 0.00 0.00 35.95 39.88 1h66 h PHE 17 CO 0.53 0.56 0.58 -0.91 -2.23 0.00 0.00 178.31 176.83 1h66 h ASN 18 N 0.17 1.10 -0.55 0.41 2.35 -1.92 0.11 115.58 117.25 1h66 h ASN 18 Ca 0.02 -0.05 -0.09 0.00 -0.55 0.00 0.00 56.30 55.62 1h66 h ASN 18 Cb 0.75 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.82 1h66 h ASN 18 CO 0.06 0.83 -0.01 0.22 -1.65 0.00 0.00 177.43 176.87 1h66 h TYR 19 N 1.27 1.10 -0.89 1.19 3.20 -1.68 -2.20 116.97 118.96 1h66 h TYR 19 Ca 0.34 -0.19 -0.02 0.00 3.14 0.00 0.00 58.73 62.00 1h66 h TYR 19 Cb -0.08 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 37.86 1h66 h TYR 19 CO 0.00 0.98 0.50 0.00 -1.64 0.00 0.00 178.16 178.00 1h66 h ALA 20 N 1.05 1.14 -0.22 1.82 0.00 -0.78 -1.49 119.26 120.78 1h66 h ALA 20 Ca 0.16 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1h66 h ALA 20 Cb 0.55 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1h66 h ALA 20 CO 0.03 0.65 -0.18 0.52 0.00 0.00 0.00 179.25 180.27 1h66 h MET 21 N 1.25 0.38 -0.30 0.00 2.86 -0.62 -1.24 114.93 117.26 1h66 h MET 21 Ca 0.32 -0.12 -0.15 0.00 -2.06 0.00 0.00 59.70 57.69 1h66 h MET 21 Cb 0.02 -0.04 -0.00 0.00 0.06 0.00 0.00 31.60 31.64 1h66 h MET 21 CO -0.05 0.56 -0.38 -0.22 1.06 0.00 0.00 176.91 177.87 1h66 h LYS 22 N 0.35 0.79 -0.58 1.72 3.11 -0.74 -1.91 116.57 119.31 1h66 h LYS 22 Ca 0.06 -0.45 -0.07 0.00 -2.81 0.00 0.00 60.65 57.38 1h66 h LYS 22 Cb 0.52 0.03 -0.02 0.00 -1.00 0.00 0.00 32.23 31.76 1h66 h LYS 22 CO 0.03 1.08 0.08 0.93 -2.81 0.00 0.00 179.45 178.76 1h66 h GLU 23 N 0.56 0.98 -0.14 1.90 5.08 -1.05 -2.00 114.58 119.91 1h66 h GLU 23 Ca 0.04 -0.27 0.01 0.00 -1.00 0.00 0.00 59.36 58.14 1h66 h GLU 23 Cb 0.97 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.10 1h66 h GLU 23 CO 0.09 0.93 0.06 0.00 -1.00 0.00 0.00 179.01 179.09 1h66 h ALA 24 N 1.00 0.16 -0.41 3.43 0.00 -1.16 -0.68 119.26 121.60 1h66 h ALA 24 Ca 0.17 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.10 1h66 h ALA 24 Cb 0.44 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1h66 h ALA 24 CO 0.01 -0.39 0.26 0.00 0.00 0.00 0.00 179.25 179.14 1h66 h ALA 25 N 1.08 0.52 -0.16 0.00 0.00 -1.24 -1.24 119.26 118.21 1h66 h ALA 25 Ca 0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1h66 h ALA 25 Cb 0.02 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1h66 h ALA 25 CO -0.05 -0.04 0.10 0.00 0.00 0.00 0.00 179.25 179.25 1h66 h ALA 26 N 1.16 0.20 0.05 0.00 0.00 -1.12 -1.44 119.26 118.11 1h66 h ALA 26 Ca 0.15 -0.00 0.01 0.00 0.00 0.00 0.00 54.91 55.07 1h66 h ALA 26 Cb -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1h66 h ALA 26 CO -0.05 -0.33 -0.07 0.00 0.00 0.00 0.00 179.25 178.80 1h66 h ALA 27 N 1.07 -0.12 -0.13 0.00 0.00 -0.94 -1.51 119.26 117.64 1h66 h ALA 27 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.97 1h66 h ALA 27 Cb -0.01 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1h66 h ALA 27 CO -0.03 -0.58 0.07 0.00 0.00 0.00 0.00 179.25 178.71 1h66 h ALA 28 N 0.79 0.16 -0.44 0.00 0.00 -1.14 -2.22 119.26 116.41 1h66 h ALA 28 Ca 0.01 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1h66 h ALA 28 Cb 0.16 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 1h66 h ALA 28 CO -0.04 -0.37 0.05 -0.07 0.00 0.00 0.00 179.25 178.82 1h66 h LEU 29 N 0.15 0.65 -0.50 0.00 4.07 -1.22 -2.85 115.31 115.61 1h66 h LEU 29 Ca 0.05 -0.13 -0.10 0.00 0.08 0.00 0.00 57.88 57.78 1h66 h LEU 29 Cb -0.01 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.55 1h66 h LEU 29 CO -0.02 0.69 -0.08 0.11 -1.08 0.00 0.00 178.44 178.06 1h66 h LYS 30 N 0.66 0.94 0.00 1.13 1.57 -1.08 -0.44 116.57 119.35 1h66 h LYS 30 Ca 0.14 -0.34 -0.01 0.00 -1.87 0.00 0.00 60.65 58.57 1h66 h LYS 30 Cb 0.34 -0.06 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1h66 h LYS 30 CO 0.01 1.00 -0.04 0.87 -0.57 0.00 0.00 179.45 180.72 1h66 h LYS 31 N 0.80 0.00 -0.01 3.15 1.57 -1.20 0.54 116.57 121.41 1h66 h LYS 31 Ca 0.13 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.91 1h66 h LYS 31 Cb 0.63 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.94 1h66 h LYS 31 CO 0.04 0.04 0.00 1.63 -0.57 0.00 0.00 179.45 180.59 1h66 n LYS 32 N -4.42 1.18 -0.40 3.15 4.01 -0.97 -4.90 118.16 115.81 1h66 n LYS 32 Ca -0.03 -0.26 0.00 0.00 -0.51 0.00 0.00 58.31 57.51 1h66 n LYS 32 Cb 0.12 -1.45 0.00 0.00 -0.51 0.00 0.00 35.03 33.19 1h66 n LYS 32 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 1h66 n GLY 33 N 1.01 0.74 3.81 0.72 0.00 0.18 -5.07 105.19 106.58 1h66 n GLY 33 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.90 1h66 n GLY 33 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1h66 s TRP 34 N -2.50 3.09 -0.18 1.61 0.52 -0.21 -4.99 118.94 116.27 1h66 s TRP 34 Ca 0.00 1.49 -0.09 0.00 0.02 0.00 0.00 56.10 57.52 1h66 s TRP 34 Cb 0.00 -2.95 -0.05 0.00 -1.15 0.00 0.00 33.47 29.32 1h66 s TRP 34 CO 0.00 -1.02 0.11 -1.21 0.02 0.00 0.00 176.95 174.85 1h66 s GLU 35 N -4.25 4.02 -0.09 4.98 2.02 0.43 -4.31 118.70 121.49 1h66 s GLU 35 Ca 0.62 -0.24 0.04 0.00 0.02 0.00 0.00 54.97 55.41 1h66 s GLU 35 Cb -0.15 -3.33 0.00 0.00 0.10 0.00 0.00 34.13 30.75 1h66 s GLU 35 CO 0.39 0.37 -0.23 0.08 0.02 0.00 0.00 175.26 175.90 1h66 s VAL 36 N 0.15 1.94 0.14 2.63 1.01 -1.26 -0.62 120.40 124.38 1h66 s VAL 36 Ca 0.08 -0.95 0.11 0.00 0.00 0.00 0.00 61.98 61.21 1h66 s VAL 36 Cb -0.11 -1.68 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1h66 s VAL 36 CO -0.01 0.53 -0.24 -0.69 0.00 0.00 0.00 175.10 174.69 1h66 s VAL 37 N 0.36 2.41 0.13 2.92 1.01 -0.22 -4.99 120.40 122.01 1h66 s VAL 37 Ca -0.18 -1.76 0.08 0.00 0.00 0.00 0.00 61.98 60.13 1h66 s VAL 37 Cb -0.18 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 34.07 1h66 s VAL 37 CO 0.08 0.05 -0.20 -1.61 0.00 0.00 0.00 175.10 173.43 1h66 s GLU 38 N -2.20 1.17 -0.48 2.72 2.02 -1.26 -1.23 118.70 119.44 1h66 s GLU 38 Ca 0.16 -1.25 0.03 0.00 0.02 0.00 0.00 54.97 53.93 1h66 s GLU 38 Cb -0.10 -1.35 0.15 0.00 0.10 0.00 0.00 34.13 32.94 1h66 s GLU 38 CO 0.08 0.30 0.32 -1.12 0.02 0.00 0.00 175.26 174.85 1h66 s SER 39 N -2.20 3.22 -0.86 -0.19 0.01 -0.58 -4.94 113.70 108.16 1h66 s SER 39 Ca 0.10 -2.95 -0.20 0.00 1.31 0.00 0.00 55.95 54.20 1h66 s SER 39 Cb -0.08 -0.93 0.11 0.00 0.21 0.00 0.00 66.02 65.32 1h66 s SER 39 CO 0.05 -0.21 1.11 -0.62 0.41 0.00 0.00 173.24 173.98 1h66 s ASP 40 N -0.03 6.48 0.22 2.44 -1.08 -1.26 -1.51 116.67 121.93 1h66 s ASP 40 Ca 0.23 -1.67 -0.08 0.00 -0.52 0.00 0.00 52.55 50.51 1h66 s ASP 40 Cb -0.13 -2.42 0.35 0.00 -1.46 0.00 0.00 42.92 39.26 1h66 s ASP 40 CO -0.09 -1.22 1.69 -0.07 0.52 0.00 0.00 175.17 176.00 1h66 h LEU 41 N 10.91 -0.06 -0.31 -1.34 3.38 -1.77 -0.04 115.31 126.09 1h66 h LEU 41 Ca 0.03 0.13 -0.04 0.00 0.09 0.00 0.00 57.88 58.09 1h66 h LEU 41 Cb 1.04 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.97 1h66 h LEU 41 CO 1.16 -0.03 0.04 1.88 0.09 0.00 0.00 178.44 181.58 1h66 h TYR 42 N 0.23 0.55 -0.18 1.13 0.05 -1.83 -1.11 116.97 115.82 1h66 h TYR 42 Ca 0.35 -0.08 -0.05 0.00 0.05 0.00 0.00 58.73 59.00 1h66 h TYR 42 Cb 0.56 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 1h66 h TYR 42 CO -0.28 0.61 -0.10 0.00 -1.05 0.00 0.00 178.16 177.34 1h66 h ALA 43 N 0.87 1.51 -0.00 3.88 0.00 -1.74 -0.31 119.26 123.47 1h66 h ALA 43 Ca 0.09 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1h66 h ALA 43 Cb 0.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1h66 h ALA 43 CO 0.01 0.35 -0.03 -1.33 0.00 0.00 0.00 179.25 178.25 1h66 n MET 44 N -4.29 0.51 -3.87 0.00 2.81 -0.08 -4.90 117.12 107.30 1h66 n MET 44 Ca -0.00 -0.05 -0.26 0.00 -1.81 0.00 0.00 57.70 55.58 1h66 n MET 44 Cb 0.25 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.27 1h66 n MET 44 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77 1h66 n ASN 45 N -1.20 -1.71 -4.73 7.83 4.05 -0.13 -4.85 115.26 114.52 1h66 n ASN 45 Ca 0.15 -0.89 -0.42 0.00 0.45 0.00 0.00 54.58 53.87 1h66 n ASN 45 Cb 0.24 -3.57 -0.03 0.00 1.23 0.00 0.00 39.78 37.66 1h66 n ASN 45 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 177.26 174.33 1h66 s PHE 46 N -3.67 3.09 -0.35 1.20 5.36 -0.49 -4.97 117.98 118.15 1h66 s PHE 46 Ca 0.19 0.84 -0.28 0.00 -0.96 0.00 0.00 56.93 56.72 1h66 s PHE 46 Cb -0.10 -3.83 0.02 0.00 -0.34 0.00 0.00 43.02 38.77 1h66 s PHE 46 CO 0.85 -2.92 1.03 1.21 -1.46 0.00 0.00 175.22 173.93 1h66 s ASN 47 N 0.86 6.81 0.00 6.13 3.04 -1.26 -4.93 114.94 125.58 1h66 s ASN 47 Ca 0.65 0.83 0.26 0.00 0.04 0.00 0.00 52.86 54.64 1h66 s ASN 47 Cb -0.42 -2.51 0.85 0.00 -1.54 0.00 0.00 41.25 37.63 1h66 s ASN 47 CO 0.35 -0.90 1.63 -0.81 -3.04 0.00 0.00 177.10 174.32 1h66 n PRO 48 N 6.92 1.80 -3.63 0.43 -0.04 -1.26 -4.84 135.00 134.39 1h66 n PRO 48 Ca 0.10 -1.17 -0.37 0.00 -0.04 0.00 0.00 63.50 62.02 1h66 n PRO 48 Cb 0.48 -1.46 -0.10 0.00 -0.04 0.00 0.00 33.50 32.37 1h66 n PRO 48 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1h66 s ILE 49 N -1.94 5.32 0.36 0.52 1.01 -1.26 -4.21 121.20 121.00 1h66 s ILE 49 Ca 0.36 0.17 -0.27 0.00 0.00 0.00 0.00 60.65 60.90 1h66 s ILE 49 Cb 0.20 -3.51 -0.09 0.00 0.01 0.00 0.00 42.46 39.07 1h66 s ILE 49 CO 0.32 0.30 1.21 0.27 0.00 0.00 0.00 174.94 177.03 1h66 s ILE 50 N 1.43 3.02 0.31 2.92 -4.36 -1.26 -5.01 121.20 118.25 1h66 s ILE 50 Ca 0.07 0.94 -0.18 0.00 -0.26 0.00 0.00 60.65 61.22 1h66 s ILE 50 Cb -0.15 -3.57 0.03 0.00 1.25 0.00 0.00 42.46 40.02 1h66 s ILE 50 CO 0.08 0.16 0.72 -0.94 0.24 0.00 0.00 174.94 175.20 1h66 s SER 51 N -0.84 -0.14 0.00 4.36 1.04 -1.26 -5.00 113.70 111.86 1h66 s SER 51 Ca 0.52 -0.81 0.16 0.00 0.48 0.00 0.00 55.95 56.30 1h66 s SER 51 Cb -0.35 0.75 0.81 0.00 0.10 0.00 0.00 66.02 67.34 1h66 s SER 51 CO 0.45 -1.43 1.45 -2.11 0.98 0.00 0.00 173.24 172.57 1h66 n ARG 52 N -0.48 0.25 0.00 4.02 1.85 -1.26 -1.89 116.66 119.15 1h66 n ARG 52 Ca -0.05 0.13 0.14 0.00 -1.00 0.00 0.00 57.85 57.07 1h66 n ARG 52 Cb 0.60 -1.50 0.61 0.00 -1.05 0.00 0.00 32.46 31.11 1h66 n ARG 52 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 1h66 n LYS 53 N -1.26 0.56 0.00 2.89 4.76 -1.26 -3.09 118.16 120.75 1h66 n LYS 53 Ca 0.08 -0.17 0.12 0.00 -2.87 0.00 0.00 58.31 55.46 1h66 n LYS 53 Cb 0.12 -1.50 0.53 0.00 -1.84 0.00 0.00 35.03 32.35 1h66 n LYS 53 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 1h66 n ASP 54 N -1.07 0.00 -4.33 4.39 8.00 -0.79 -4.48 116.55 118.27 1h66 n ASP 54 Ca 0.13 0.34 -0.37 0.00 0.71 0.00 0.00 54.79 55.60 1h66 n ASP 54 Cb 0.28 -0.44 -0.13 0.00 -0.02 0.00 0.00 41.12 40.81 1h66 n ASP 54 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1h66 s ILE 55 N -2.88 3.84 -1.01 0.53 1.09 -1.18 -0.78 121.20 120.81 1h66 s ILE 55 Ca 0.15 -0.74 -0.06 0.00 -1.10 0.00 0.00 60.65 58.89 1h66 s ILE 55 Cb 0.16 -2.99 -0.01 0.00 -1.06 0.00 0.00 42.46 38.56 1h66 s ILE 55 CO 0.41 0.08 2.81 0.35 -0.10 0.00 0.00 174.94 178.50 1h66 n THR 56 N 4.84 4.26 -3.42 2.92 -2.24 0.74 -4.86 114.28 116.51 1h66 n THR 56 Ca -0.15 -3.16 0.00 0.00 -2.27 0.00 0.00 64.05 58.48 1h66 n THR 56 Cb 0.48 -2.10 0.00 0.00 -2.10 0.00 0.00 70.33 66.61 1h66 n THR 56 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1h66 n GLY 57 N 2.14 -0.97 3.77 3.38 0.00 -1.26 -4.96 105.19 107.29 1h66 n GLY 57 Ca 0.61 -0.91 -0.39 0.00 0.00 0.00 0.00 46.02 45.33 1h66 n GLY 57 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1h66 s LYS 58 N -0.85 4.07 0.24 1.61 2.20 -1.26 -5.02 119.74 120.72 1h66 s LYS 58 Ca 0.00 1.96 -0.14 0.00 -0.36 0.00 0.00 55.97 57.43 1h66 s LYS 58 Cb 0.00 -2.75 -0.08 0.00 -1.51 0.00 0.00 37.83 33.49 1h66 s LYS 58 CO 0.00 -0.34 0.64 -0.51 -0.36 0.00 0.00 175.35 174.78 1h66 s LEU 59 N -2.39 4.20 0.12 5.43 1.43 -1.26 -4.99 118.68 121.22 1h66 s LEU 59 Ca 0.56 1.16 -0.19 0.00 -1.03 0.00 0.00 54.13 54.62 1h66 s LEU 59 Cb -0.34 -3.70 -0.06 0.00 0.03 0.00 0.00 46.19 42.13 1h66 s LEU 59 CO 0.43 -0.06 1.76 0.50 0.23 0.00 0.00 176.35 179.21 1h66 h LYS 60 N 2.84 0.30 -2.55 1.70 3.64 -1.95 -3.37 116.57 117.17 1h66 h LYS 60 Ca -0.48 -0.02 -0.60 0.00 -1.27 0.00 0.00 60.65 58.28 1h66 h LYS 60 Cb 1.18 -0.07 -0.39 0.00 -0.41 0.00 0.00 32.23 32.54 1h66 h LYS 60 CO 0.66 0.22 -0.87 0.34 -2.27 0.00 0.00 179.45 177.54 1h66 s ASP 61 N -5.43 2.32 0.62 4.20 -1.08 -1.26 -4.96 116.67 111.07 1h66 s ASP 61 Ca -0.13 -3.24 0.39 0.00 -0.52 0.00 0.00 52.55 49.05 1h66 s ASP 61 Cb 0.09 -0.74 2.03 0.00 -1.46 0.00 0.00 42.92 42.84 1h66 s ASP 61 CO 0.70 -0.15 2.24 1.55 0.52 0.00 0.00 175.17 180.03 1h66 h PRO 62 N 5.62 0.00 -0.21 4.34 0.13 -2.00 -2.62 132.00 137.27 1h66 h PRO 62 Ca 0.23 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 65.22 1h66 h PRO 62 Cb 0.87 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 1h66 h PRO 62 CO 0.46 0.01 -0.47 0.00 -0.23 0.00 0.00 178.00 177.77 1h66 h ALA 63 N 1.99 0.80 -2.39 -0.56 0.00 -1.96 -3.36 119.26 113.78 1h66 h ALA 63 Ca -0.00 -0.47 -0.59 0.00 0.00 0.00 0.00 54.91 53.85 1h66 h ALA 63 Cb 0.16 -0.10 -0.39 0.00 0.00 0.00 0.00 17.79 17.46 1h66 h ALA 63 CO 0.00 0.66 -0.93 0.09 0.00 0.00 0.00 179.25 179.08 1h66 n ASN 64 N -3.99 0.32 -4.70 0.00 3.02 -1.00 -5.11 115.26 103.80 1h66 n ASN 64 Ca -0.02 -2.60 -0.42 0.00 -0.03 0.00 0.00 54.58 51.51 1h66 n ASN 64 Cb 0.55 -0.60 -0.03 0.00 -0.61 0.00 0.00 39.78 39.09 1h66 n ASN 64 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1h66 s PHE 65 N -0.51 2.86 -0.19 3.10 2.19 -1.17 -4.86 117.98 119.40 1h66 s PHE 65 Ca 0.33 0.64 -0.01 0.00 0.33 0.00 0.00 56.93 58.21 1h66 s PHE 65 Cb 0.06 -3.83 0.05 0.00 -1.31 0.00 0.00 43.02 37.99 1h66 s PHE 65 CO -0.17 -3.14 -0.00 -0.65 1.83 0.00 0.00 175.22 173.09 1h66 s GLN 66 N 1.86 1.02 0.18 10.12 -0.21 -1.26 -5.06 119.66 126.30 1h66 s GLN 66 Ca 0.69 -0.54 -0.14 0.00 0.02 0.00 0.00 55.36 55.39 1h66 s GLN 66 Cb -0.38 -2.13 0.17 0.00 1.00 0.00 0.00 33.01 31.66 1h66 s GLN 66 CO 0.30 -0.57 1.68 -0.92 -2.12 0.00 0.00 175.29 173.66 1h66 h TYR 67 N 8.16 -0.10 0.02 0.91 3.20 -1.98 -2.41 116.97 124.77 1h66 h TYR 67 Ca -0.18 0.04 0.03 0.00 3.14 0.00 0.00 58.73 61.76 1h66 h TYR 67 Cb 1.11 0.12 -0.05 0.00 1.54 0.00 0.00 36.73 39.45 1h66 h TYR 67 CO 0.38 -0.14 -0.30 -1.35 -1.64 0.00 0.00 178.16 175.10 1h66 h PRO 68 N 0.08 -0.45 -0.18 1.82 0.11 -1.99 0.12 132.00 131.52 1h66 h PRO 68 Ca 0.24 0.03 -0.01 0.00 0.11 0.00 0.00 66.00 66.37 1h66 h PRO 68 Cb 0.36 0.10 -0.01 0.00 0.11 0.00 0.00 31.00 31.57 1h66 h PRO 68 CO -0.43 -0.30 0.08 0.00 -0.21 0.00 0.00 178.00 177.14 1h66 h ALA 69 N 0.28 0.23 -0.82 -0.75 0.00 -1.99 -2.22 119.26 113.99 1h66 h ALA 69 Ca 0.06 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 1h66 h ALA 69 Cb 0.54 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.23 1h66 h ALA 69 CO -0.25 -0.20 0.35 0.93 0.00 0.00 0.00 179.25 180.08 1h66 h GLU 70 N 0.14 1.21 -0.19 0.00 4.39 -1.30 -1.72 114.58 117.12 1h66 h GLU 70 Ca 0.06 -0.20 -0.16 0.00 0.34 0.00 0.00 59.36 59.39 1h66 h GLU 70 Cb 0.14 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.58 1h66 h GLU 70 CO -0.01 0.96 -0.55 0.66 -1.16 0.00 0.00 179.01 178.91 1h66 h SER 71 N 1.18 0.62 -0.48 1.42 4.64 -0.68 -1.65 113.55 118.60 1h66 h SER 71 Ca 0.28 -0.33 -0.09 0.00 -0.47 0.00 0.00 61.79 61.18 1h66 h SER 71 Cb 0.18 -0.18 -0.02 0.00 -0.31 0.00 0.00 62.40 62.08 1h66 h SER 71 CO -0.03 1.04 -0.04 0.58 -0.87 0.00 0.00 176.83 177.51 1h66 h VAL 72 N 0.43 1.27 -0.73 0.95 2.07 -1.26 -0.92 116.25 118.05 1h66 h VAL 72 Ca 0.01 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.38 1h66 h VAL 72 Cb 1.09 1.04 -0.03 0.00 -1.52 0.00 0.00 31.29 31.87 1h66 h VAL 72 CO 0.10 0.40 0.42 0.25 0.02 0.00 0.00 177.57 178.76 1h66 h LEU 73 N 0.73 0.89 -1.09 2.57 5.85 -1.20 -1.41 115.31 121.64 1h66 h LEU 73 Ca 0.13 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.70 1h66 h LEU 73 Cb 0.57 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.36 1h66 h LEU 73 CO 0.03 0.71 -0.11 0.00 -0.34 0.00 0.00 178.44 178.73 1h66 h ALA 74 N 1.22 1.24 -0.27 1.25 0.00 -1.04 -1.64 119.26 120.02 1h66 h ALA 74 Ca 0.26 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1h66 h ALA 74 Cb -0.00 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 1h66 h ALA 74 CO -0.05 0.50 0.05 -0.92 0.00 0.00 0.00 179.25 178.83 1h66 h TYR 75 N 0.48 0.48 -0.65 0.00 3.20 -0.49 0.64 116.97 120.62 1h66 h TYR 75 Ca 0.09 -0.07 -0.06 0.00 3.14 0.00 0.00 58.73 61.84 1h66 h TYR 75 Cb 0.48 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.59 1h66 h TYR 75 CO 0.02 0.55 0.19 0.87 -1.64 0.00 0.00 178.16 178.15 1h66 h LYS 76 N 0.27 1.02 -0.01 1.82 1.57 -1.02 -2.93 116.57 117.28 1h66 h LYS 76 Ca 0.08 -0.23 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 1h66 h LYS 76 Cb 0.33 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.50 1h66 h LYS 76 CO 0.00 0.90 -0.05 0.39 -0.57 0.00 0.00 179.45 180.13 1h66 n GLU 77 N -4.33 1.34 -2.08 3.15 1.02 -0.64 -4.95 120.64 114.15 1h66 n GLU 77 Ca 0.04 -0.68 -0.04 0.00 -0.02 0.00 0.00 57.16 56.46 1h66 n GLU 77 Cb 0.23 -1.49 -0.00 0.00 -0.02 0.00 0.00 31.44 30.16 1h66 n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1h66 n GLY 78 N 1.19 0.22 1.20 0.62 0.00 -0.22 -4.97 105.19 103.22 1h66 n GLY 78 Ca 0.18 -0.73 -0.03 0.00 0.00 0.00 0.00 46.02 45.44 1h66 n GLY 78 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1h66 n HIS 79 N -3.99 1.24 -3.01 1.61 8.25 0.21 -5.01 115.22 114.52 1h66 n HIS 79 Ca -0.04 -1.46 -0.36 0.00 -0.26 0.00 0.00 57.72 55.60 1h66 n HIS 79 Cb 0.53 -0.49 -0.06 0.00 1.12 0.00 0.00 29.99 31.09 1h66 n HIS 79 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1h66 s LEU 80 N -3.16 4.30 0.22 2.41 1.43 -1.22 -0.19 118.68 122.48 1h66 s LEU 80 Ca 0.45 1.52 -0.31 0.00 -1.03 0.00 0.00 54.13 54.77 1h66 s LEU 80 Cb 0.40 -3.77 -0.15 0.00 0.03 0.00 0.00 46.19 42.70 1h66 s LEU 80 CO 0.03 -0.03 1.10 -0.24 0.23 0.00 0.00 176.35 177.44 1h66 n SER 81 N 0.55 1.30 -0.31 2.29 2.88 0.04 -4.73 113.62 115.63 1h66 n SER 81 Ca -0.00 1.15 0.20 0.00 -1.33 0.00 0.00 58.87 58.89 1h66 n SER 81 Cb 0.51 -1.24 0.47 0.00 -0.75 0.00 0.00 64.21 63.20 1h66 n SER 81 CO 0.00 0.00 0.00 -0.65 -1.23 0.00 0.00 175.04 173.16 1h66 h PRO 82 N 2.83 0.46 -0.38 -1.46 0.11 -1.94 -1.00 132.00 130.63 1h66 h PRO 82 Ca -0.41 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.61 1h66 h PRO 82 Cb 1.34 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 1h66 h PRO 82 CO 0.66 0.31 -0.01 0.38 -0.21 0.00 0.00 178.00 179.13 1h66 h ASP 83 N 0.48 0.57 -0.10 -2.05 2.03 -2.00 -1.40 116.42 113.94 1h66 h ASP 83 Ca 0.55 -0.12 -0.03 0.00 -0.73 0.00 0.00 57.03 56.70 1h66 h ASP 83 Cb 1.27 -0.15 -0.00 0.00 -0.83 0.00 0.00 39.33 39.62 1h66 h ASP 83 CO -0.28 0.64 -0.06 0.40 -1.03 0.00 0.00 179.24 178.91 1h66 h ILE 84 N 0.57 1.34 -0.76 4.15 2.04 -1.54 -3.13 117.51 120.19 1h66 h ILE 84 Ca 0.12 -1.14 0.02 0.00 1.00 0.00 0.00 64.86 64.86 1h66 h ILE 84 Cb 0.38 1.88 -0.04 0.00 -0.74 0.00 0.00 36.82 38.30 1h66 h ILE 84 CO 0.01 0.32 0.50 0.58 0.00 0.00 0.00 178.15 179.57 1h66 h VAL 85 N -0.16 1.16 -0.70 1.67 2.07 -1.21 -1.28 116.25 117.80 1h66 h VAL 85 Ca 0.02 -0.34 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1h66 h VAL 85 Cb 0.54 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.37 1h66 h VAL 85 CO 0.02 0.18 0.29 0.00 0.02 0.00 0.00 177.57 178.08 1h66 h ALA 86 N 1.54 1.20 -0.26 1.67 0.00 -1.27 -0.84 119.26 121.29 1h66 h ALA 86 Ca 0.29 -0.17 -0.18 0.00 0.00 0.00 0.00 54.91 54.84 1h66 h ALA 86 Cb -0.05 -0.28 -0.00 0.00 0.00 0.00 0.00 17.79 17.46 1h66 h ALA 86 CO -0.07 0.59 -0.56 0.93 0.00 0.00 0.00 179.25 180.13 1h66 h GLU 87 N 1.00 0.81 -0.25 0.00 4.39 -1.32 -2.84 114.58 116.37 1h66 h GLU 87 Ca 0.24 -0.52 -0.05 0.00 0.34 0.00 0.00 59.36 59.36 1h66 h GLU 87 Cb 0.17 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1h66 h GLU 87 CO -0.02 1.15 -0.07 1.96 -1.16 0.00 0.00 179.01 180.87 1h66 h GLN 88 N 0.62 0.40 -0.61 2.33 4.20 -0.92 -2.09 115.11 119.04 1h66 h GLN 88 Ca 0.01 -0.09 -0.06 0.00 0.06 0.00 0.00 58.65 58.56 1h66 h GLN 88 Cb 1.16 -0.05 -0.03 0.00 0.30 0.00 0.00 27.48 28.86 1h66 h GLN 88 CO 0.12 0.49 0.12 0.87 -0.67 0.00 0.00 178.83 179.76 1h66 h LYS 89 N 0.38 0.96 -0.54 1.46 1.57 -0.96 -2.01 116.57 117.44 1h66 h LYS 89 Ca 0.08 -0.23 -0.09 0.00 -1.87 0.00 0.00 60.65 58.55 1h66 h LYS 89 Cb 0.37 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1h66 h LYS 89 CO 0.02 0.87 -0.01 0.87 -0.57 0.00 0.00 179.45 180.64 1h66 h LYS 90 N 0.91 0.92 -0.18 3.15 1.57 -1.18 -2.69 116.57 119.08 1h66 h LYS 90 Ca 0.19 -0.27 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1h66 h LYS 90 Cb 0.37 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.57 1h66 h LYS 90 CO 0.00 0.92 0.04 -0.07 -0.57 0.00 0.00 179.45 179.77 1h66 h LEU 91 N 0.85 0.28 -2.24 2.94 3.38 -1.05 -2.40 115.31 117.07 1h66 h LEU 91 Ca 0.16 -0.24 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1h66 h LEU 91 Cb 0.51 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 1h66 h LEU 91 CO 0.03 0.44 -0.05 -0.33 0.09 0.00 0.00 178.44 178.62 1h66 h GLU 92 N 0.10 0.00 0.00 1.13 5.08 -1.27 -2.48 114.58 117.14 1h66 h GLU 92 Ca 0.06 0.00 -0.24 0.00 -1.00 0.00 0.00 59.36 58.18 1h66 h GLU 92 Cb 0.28 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.49 1h66 h GLU 92 CO 0.00 0.05 -1.35 0.00 -1.00 0.00 0.00 179.01 176.71 1h66 h ALA 93 N 1.95 0.61 -2.67 3.43 0.00 -1.34 -3.47 119.26 117.77 1h66 h ALA 93 Ca -0.00 -1.13 -0.49 0.00 0.00 0.00 0.00 54.91 53.29 1h66 h ALA 93 Cb 0.14 0.21 0.01 0.00 0.00 0.00 0.00 17.79 18.15 1h66 h ALA 93 CO 0.01 1.32 0.43 0.00 0.00 0.00 0.00 179.25 181.01 1h66 s ALA 94 N -2.70 3.27 -0.21 0.00 0.00 -0.91 -4.78 121.76 116.42 1h66 s ALA 94 Ca -0.02 0.77 0.02 0.00 0.00 0.00 0.00 51.96 52.72 1h66 s ALA 94 Cb 0.09 -3.28 -0.20 0.00 0.00 0.00 0.00 23.12 19.72 1h66 s ALA 94 CO 0.82 -0.11 -0.01 -0.25 0.00 0.00 0.00 175.76 176.20 1h66 n ASP 95 N 0.72 1.80 -4.24 0.00 8.00 0.92 -4.88 116.55 118.88 1h66 n ASP 95 Ca 0.01 -0.01 -0.31 0.00 0.71 0.00 0.00 54.79 55.18 1h66 n ASP 95 Cb 0.47 -0.39 -0.17 0.00 -0.02 0.00 0.00 41.12 41.01 1h66 n ASP 95 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1h66 s LEU 96 N -6.55 2.06 -0.12 0.64 2.96 -0.87 -1.40 118.68 115.40 1h66 s LEU 96 Ca -0.28 -0.52 0.02 0.00 -0.22 0.00 0.00 54.13 53.12 1h66 s LEU 96 Cb 0.08 -1.36 0.01 0.00 0.50 0.00 0.00 46.19 45.42 1h66 s LEU 96 CO 0.67 0.20 -0.17 -0.69 -1.32 0.00 0.00 176.35 175.05 1h66 s VAL 97 N 0.07 1.64 -0.15 1.68 1.01 -0.64 -0.47 120.40 123.53 1h66 s VAL 97 Ca -0.10 -0.72 -0.01 0.00 0.00 0.00 0.00 61.98 61.15 1h66 s VAL 97 Cb -0.15 -1.48 -0.01 0.00 0.00 0.00 0.00 36.38 34.73 1h66 s VAL 97 CO 0.06 0.47 -0.11 -0.63 0.00 0.00 0.00 175.10 174.88 1h66 s ILE 98 N 0.99 3.13 -0.39 2.22 1.01 0.18 -1.82 121.20 126.52 1h66 s ILE 98 Ca -0.06 -0.62 -0.09 0.00 0.00 0.00 0.00 60.65 59.88 1h66 s ILE 98 Cb -0.15 -2.34 0.06 0.00 0.01 0.00 0.00 42.46 40.04 1h66 s ILE 98 CO -0.03 0.51 0.22 -0.36 0.00 0.00 0.00 174.94 175.28 1h66 s PHE 99 N 0.56 3.29 -0.33 3.97 0.08 -0.35 0.13 117.98 125.33 1h66 s PHE 99 Ca -0.07 -1.34 -0.11 0.00 0.12 0.00 0.00 56.93 55.53 1h66 s PHE 99 Cb -0.15 -2.68 -0.01 0.00 -0.57 0.00 0.00 43.02 39.61 1h66 s PHE 99 CO 0.03 -0.77 0.20 -1.14 -0.10 0.00 0.00 175.22 173.44 1h66 s GLN 100 N 1.46 3.34 0.04 0.44 2.00 -0.27 -0.19 119.66 126.48 1h66 s GLN 100 Ca 0.02 -0.74 -0.27 0.00 -2.00 0.00 0.00 55.36 52.37 1h66 s GLN 100 Cb -0.21 -3.69 0.08 0.00 0.80 0.00 0.00 33.01 29.99 1h66 s GLN 100 CO 0.04 -0.47 0.74 -0.59 -0.50 0.00 0.00 175.29 174.51 1h66 s PHE 101 N 1.65 -0.49 0.12 1.67 -0.71 -0.75 -2.04 117.98 117.44 1h66 s PHE 101 Ca 0.05 0.47 -0.24 0.00 -1.04 0.00 0.00 56.93 56.17 1h66 s PHE 101 Cb -0.17 0.52 -0.07 0.00 -1.21 0.00 0.00 43.02 42.08 1h66 s PHE 101 CO 0.08 -0.67 0.73 -1.25 -1.34 0.00 0.00 175.22 172.77 1h66 s PRO 102 N -2.86 4.48 0.12 1.99 0.04 -1.26 -2.42 135.00 135.10 1h66 s PRO 102 Ca -0.00 1.05 -0.31 0.00 0.04 0.00 0.00 61.00 61.78 1h66 s PRO 102 Cb -0.01 -3.28 -0.08 0.00 0.04 0.00 0.00 34.50 31.17 1h66 s PRO 102 CO -0.06 0.52 1.43 -1.17 0.04 0.00 0.00 177.00 177.77 1h66 s LEU 103 N -0.91 4.37 -0.10 -3.56 2.96 0.51 -4.45 118.68 117.49 1h66 s LEU 103 Ca 0.35 2.38 -0.01 0.00 -0.22 0.00 0.00 54.13 56.64 1h66 s LEU 103 Cb -0.22 -3.59 0.03 0.00 0.50 0.00 0.00 46.19 42.91 1h66 s LEU 103 CO 0.24 -0.70 -0.06 -1.10 -1.32 0.00 0.00 176.35 173.41 1h66 s GLN 104 N 1.19 1.36 -1.35 1.98 -0.21 -0.36 -4.80 119.66 117.47 1h66 s GLN 104 Ca 0.66 -0.19 -0.03 0.00 0.02 0.00 0.00 55.36 55.82 1h66 s GLN 104 Cb -0.38 -1.47 -0.00 0.00 1.00 0.00 0.00 33.01 32.16 1h66 s GLN 104 CO 0.30 -0.27 0.53 0.91 -2.12 0.00 0.00 175.29 174.64 1h66 n TRP 105 N 4.96 -1.74 -2.76 0.91 7.02 -1.26 -1.80 117.44 122.77 1h66 n TRP 105 Ca -0.12 0.73 -0.19 0.00 -1.02 0.00 0.00 57.50 56.91 1h66 n TRP 105 Cb 0.50 -3.87 0.00 0.00 -2.42 0.00 0.00 31.31 25.53 1h66 n TRP 105 CO 0.00 0.00 0.00 1.19 -2.02 0.00 0.00 177.69 176.86 1h66 n PHE 106 N -4.34 -1.54 -2.28 -5.99 3.01 -1.26 -4.89 117.46 100.17 1h66 n PHE 106 Ca -0.28 0.22 0.00 0.00 1.01 0.00 0.00 57.45 58.40 1h66 n PHE 106 Cb 0.67 -3.46 0.00 0.00 -0.01 0.00 0.00 39.48 36.68 1h66 n PHE 106 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1h66 n GLY 107 N -1.09 2.54 3.88 1.37 0.00 -0.75 -4.95 105.19 106.19 1h66 n GLY 107 Ca -0.13 -0.76 -0.30 0.00 0.00 0.00 0.00 46.02 44.82 1h66 n GLY 107 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1h66 s VAL 108 N -2.84 4.81 0.65 1.61 -7.23 -1.26 -1.22 120.40 114.92 1h66 s VAL 108 Ca 0.00 0.54 -0.18 0.00 -1.81 0.00 0.00 61.98 60.53 1h66 s VAL 108 Cb 0.00 -3.75 -0.01 0.00 0.56 0.00 0.00 36.38 33.18 1h66 s VAL 108 CO 0.00 -0.55 1.25 -2.65 -0.31 0.00 0.00 175.10 172.84 1h66 n PRO 109 N -1.40 1.04 -0.32 4.82 -0.02 -1.26 -4.71 135.00 133.15 1h66 n PRO 109 Ca 0.02 0.41 0.11 0.00 -2.02 0.00 0.00 63.50 62.02 1h66 n PRO 109 Cb 0.54 -2.48 0.33 0.00 -0.02 0.00 0.00 33.50 31.87 1h66 n PRO 109 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1h66 h ALA 110 N 0.44 1.73 -0.23 3.55 0.00 -1.96 -0.97 119.26 121.82 1h66 h ALA 110 Ca -0.50 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.41 1h66 h ALA 110 Cb 1.34 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1h66 h ALA 110 CO 0.52 -0.01 -0.01 0.97 0.00 0.00 0.00 179.25 180.72 1h66 h ILE 111 N 0.78 1.15 0.19 0.00 2.10 -1.95 -0.00 117.51 119.78 1h66 h ILE 111 Ca 0.50 -0.59 -0.31 0.00 1.08 0.00 0.00 64.86 65.54 1h66 h ILE 111 Cb 0.74 0.99 0.02 0.00 -1.09 0.00 0.00 36.82 37.48 1h66 h ILE 111 CO -0.27 0.20 -1.36 0.25 -1.08 0.00 0.00 178.15 175.89 1h66 h LEU 112 N 0.33 0.64 -0.87 2.19 5.85 -1.60 -2.51 115.31 119.35 1h66 h LEU 112 Ca 0.08 -0.68 0.01 0.00 0.84 0.00 0.00 57.88 58.13 1h66 h LEU 112 Cb 0.24 -0.21 -0.04 0.00 0.37 0.00 0.00 40.66 41.02 1h66 h LEU 112 CO 0.01 1.53 0.57 0.50 -0.34 0.00 0.00 178.44 180.71 1h66 h LYS 113 N 0.11 1.15 -0.17 1.25 1.63 -0.79 -1.43 116.57 118.31 1h66 h LYS 113 Ca -0.19 -0.07 -0.07 0.00 -0.85 0.00 0.00 60.65 59.46 1h66 h LYS 113 Cb 2.07 -0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 33.43 1h66 h LYS 113 CO 0.24 0.77 -0.20 0.78 -3.45 0.00 0.00 179.45 177.58 1h66 h GLY 114 N 1.18 0.32 0.87 5.01 0.00 -1.02 -1.52 103.07 107.91 1h66 h GLY 114 Ca 0.32 -0.23 -0.02 0.00 0.00 0.00 0.00 47.33 47.41 1h66 h GLY 114 CO -0.07 0.21 0.07 -0.25 0.00 0.00 0.00 176.54 176.50 1h66 h TRP 115 N 0.27 0.32 -0.12 5.60 7.01 -0.83 -0.63 115.95 127.58 1h66 h TRP 115 Ca 0.05 -0.03 0.01 0.00 2.11 0.00 0.00 58.89 61.02 1h66 h TRP 115 Cb 0.52 -0.09 -0.01 0.00 -2.10 0.00 0.00 29.16 27.47 1h66 h TRP 115 CO 0.01 0.39 0.06 0.74 -2.79 0.00 0.00 178.44 176.85 1h66 h PHE 116 N 0.16 0.11 -0.69 2.65 0.04 -1.07 0.31 116.94 118.46 1h66 h PHE 116 Ca 0.07 0.00 0.06 0.00 2.80 0.00 0.00 57.97 60.90 1h66 h PHE 116 Cb 0.22 -0.03 -0.06 0.00 2.20 0.00 0.00 35.95 38.28 1h66 h PHE 116 CO -0.00 0.07 0.39 0.93 -0.60 0.00 0.00 178.31 179.09 1h66 h GLU 117 N 0.13 0.70 0.00 1.51 5.08 -1.10 -0.48 114.58 120.42 1h66 h GLU 117 Ca 0.05 -0.04 -0.11 0.00 -1.00 0.00 0.00 59.36 58.25 1h66 h GLU 117 Cb 0.00 -0.16 -0.02 0.00 0.50 0.00 0.00 28.75 29.08 1h66 h GLU 117 CO -0.03 0.46 -1.12 0.00 -1.00 0.00 0.00 179.01 177.32 1h66 h ARG 118 N 0.72 0.00 0.07 2.33 3.08 -0.98 -3.41 114.38 116.19 1h66 h ARG 118 Ca 0.31 0.00 -0.36 0.00 0.07 0.00 0.00 59.98 60.00 1h66 h ARG 118 Cb 0.19 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.20 1h66 h ARG 118 CO -0.18 0.25 -2.03 0.28 -1.07 0.00 0.00 179.97 177.22 1h66 n VAL 119 N -2.91 1.67 -1.86 2.04 0.31 0.11 -4.56 118.33 113.13 1h66 n VAL 119 Ca -0.05 -0.52 -0.42 0.00 -0.01 0.00 0.00 64.34 63.33 1h66 n VAL 119 Cb 0.74 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.95 1h66 n VAL 119 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1h66 n PHE 120 N -3.63 3.68 -3.05 3.52 3.01 -0.20 -4.84 117.46 115.95 1h66 n PHE 120 Ca -0.37 -2.96 -0.35 0.00 1.01 0.00 0.00 57.45 54.79 1h66 n PHE 120 Cb 0.97 -2.55 -0.06 0.00 -0.01 0.00 0.00 39.48 37.82 1h66 n PHE 120 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1h66 s ILE 121 N 3.25 4.53 0.56 4.37 -1.09 -1.26 -4.81 121.20 126.75 1h66 s ILE 121 Ca 0.48 1.29 -0.19 0.00 -2.23 0.00 0.00 60.65 60.00 1h66 s ILE 121 Cb 0.13 -3.80 -0.07 0.00 -1.58 0.00 0.00 42.46 37.14 1h66 s ILE 121 CO -0.06 0.07 0.86 0.61 -1.23 0.00 0.00 174.94 175.19 1h66 n GLY 122 N 0.34 -0.59 4.05 6.18 0.00 -1.26 -1.10 105.19 112.81 1h66 n GLY 122 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1h66 n GLY 122 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1h66 n GLU 123 N -0.57 0.00 -0.06 1.61 -0.58 0.23 -4.57 120.64 116.70 1h66 n GLU 123 Ca 0.12 0.00 -0.14 0.00 -0.42 0.00 0.00 57.16 56.72 1h66 n GLU 123 Cb 0.46 0.00 -0.13 0.00 -0.57 0.00 0.00 31.44 31.20 1h66 n GLU 123 CO 0.00 0.00 0.00 0.35 -0.48 0.00 0.00 177.13 177.00 1h66 h PHE 124 N 0.00 0.01 0.00 -0.32 3.57 -1.85 -3.40 116.94 114.94 1h66 h PHE 124 Ca 0.00 -0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.43 1h66 h PHE 124 Cb 0.00 -0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.73 1h66 h PHE 124 CO 0.00 0.95 -1.95 0.00 -2.23 0.00 0.00 178.31 175.08 1h66 n ALA 125 N -2.58 2.51 -3.50 2.41 0.00 -0.26 -4.85 120.51 114.24 1h66 n ALA 125 Ca -0.10 -0.59 -0.09 0.00 0.00 0.00 0.00 53.44 52.66 1h66 n ALA 125 Cb 0.46 -0.57 -0.02 0.00 0.00 0.00 0.00 19.45 19.32 1h66 n ALA 125 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1h66 s TYR 126 N -3.19 -0.38 -0.03 0.00 1.13 -1.26 -4.43 117.35 109.19 1h66 s TYR 126 Ca -0.07 0.28 -0.08 0.00 -1.41 0.00 0.00 57.07 55.79 1h66 s TYR 126 Cb 0.11 0.53 0.01 0.00 -1.10 0.00 0.00 41.96 41.51 1h66 s TYR 126 CO 0.80 -0.56 0.19 0.95 -2.51 0.00 0.00 175.55 174.41 1h66 s THR 127 N -2.99 0.05 0.27 -3.49 -4.23 -1.26 0.75 115.64 104.74 1h66 s THR 127 Ca 0.04 -0.39 0.34 0.00 -1.18 0.00 0.00 61.69 60.50 1h66 s THR 127 Cb -0.01 -0.40 0.38 0.00 1.34 0.00 0.00 72.50 73.81 1h66 s THR 127 CO -0.08 -0.21 2.07 1.88 -0.54 0.00 0.00 174.62 177.73 1h66 h TYR 128 N 4.85 0.00 0.00 3.99 0.05 -2.00 -1.90 116.97 121.96 1h66 h TYR 128 Ca -0.28 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.50 1h66 h TYR 128 Cb 1.19 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.93 1h66 h TYR 128 CO 0.51 0.04 -0.04 0.00 -1.05 0.00 0.00 178.16 177.62 1h66 n ALA 129 N -2.13 2.38 -3.01 3.88 0.00 -1.26 -4.12 120.51 116.25 1h66 n ALA 129 Ca -0.01 -0.08 -0.15 0.00 0.00 0.00 0.00 53.44 53.20 1h66 n ALA 129 Cb 0.26 -1.45 0.01 0.00 0.00 0.00 0.00 19.45 18.27 1h66 n ALA 129 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1h66 n ALA 130 N -1.62 0.94 -1.71 0.00 0.00 -0.74 -5.09 120.51 112.28 1h66 n ALA 130 Ca 0.06 -2.66 -0.30 0.00 0.00 0.00 0.00 53.44 50.55 1h66 n ALA 130 Cb 0.38 -1.02 0.09 0.00 0.00 0.00 0.00 19.45 18.90 1h66 n ALA 130 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1h66 s MET 131 N -1.34 2.10 2.23 0.00 1.00 -1.06 -2.63 119.30 119.60 1h66 s MET 131 Ca 0.33 0.42 0.00 0.00 0.00 0.00 0.00 55.69 56.45 1h66 s MET 131 Cb 0.32 -1.94 0.00 0.00 0.00 0.00 0.00 34.83 33.21 1h66 s MET 131 CO -0.07 -1.56 0.00 0.66 0.00 0.00 0.00 175.02 174.04 1h66 n TYR 132 N -3.35 0.00 0.19 -0.03 4.01 -0.29 -2.22 117.16 115.46 1h66 n TYR 132 Ca 0.07 0.00 0.12 0.00 -0.16 0.00 0.00 57.90 57.93 1h66 n TYR 132 Cb 0.58 0.00 0.64 0.00 -0.31 0.00 0.00 39.34 40.25 1h66 n TYR 132 CO 0.00 0.00 0.00 0.38 -0.46 0.00 0.00 176.86 176.78 1h66 h ASP 133 N 0.00 0.00 -0.53 7.72 3.04 -1.88 0.11 116.42 124.88 1h66 h ASP 133 Ca 0.00 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.79 1h66 h ASP 133 Cb 0.00 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.29 1h66 h ASP 133 CO 0.00 0.00 0.00 0.29 -2.04 0.00 0.00 179.24 177.49 1h66 n LYS 134 N -2.33 2.49 -1.03 4.15 5.02 -0.94 -4.82 118.16 120.70 1h66 n LYS 134 Ca -0.01 -2.28 -0.30 0.00 -2.02 0.00 0.00 58.31 53.69 1h66 n LYS 134 Cb 0.04 -1.51 0.14 0.00 -0.02 0.00 0.00 35.03 33.68 1h66 n LYS 134 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1h66 s GLY 135 N -1.24 1.65 0.55 0.72 0.00 0.35 -4.71 107.32 104.64 1h66 s GLY 135 Ca 0.42 0.20 0.26 0.00 0.00 0.00 0.00 44.72 45.60 1h66 s GLY 135 CO 0.31 0.65 2.03 -2.55 0.00 0.00 0.00 173.10 173.54 1h66 h PRO 136 N -1.60 0.00 -0.68 2.90 0.11 -1.73 -2.50 132.00 128.50 1h66 h PRO 136 Ca -0.47 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.62 1h66 h PRO 136 Cb 1.27 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1h66 h PRO 136 CO 0.50 0.00 0.03 1.19 -0.21 0.00 0.00 178.00 179.51 1h66 n PHE 137 N -4.17 1.75 0.31 0.65 3.72 -0.63 -4.57 117.46 114.53 1h66 n PHE 137 Ca 0.06 -0.64 0.21 0.00 -0.05 0.00 0.00 57.45 57.02 1h66 n PHE 137 Cb 0.48 -0.46 1.08 0.00 -0.94 0.00 0.00 39.48 39.65 1h66 n PHE 137 CO 0.00 0.00 0.00 0.07 -0.05 0.00 0.00 176.76 176.78 1h66 h ARG 138 N 3.14 0.00 -0.03 -1.08 0.11 -1.28 -0.09 114.38 115.16 1h66 h ARG 138 Ca 0.03 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.11 1h66 h ARG 138 Cb 1.76 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.84 1h66 h ARG 138 CO 0.43 0.00 0.00 0.43 0.10 0.00 0.00 179.97 180.93 1h66 n SER 139 N -2.93 2.02 -4.74 0.08 7.64 -1.26 -4.70 113.62 109.73 1h66 n SER 139 Ca -0.03 -1.68 -0.22 0.00 1.01 0.00 0.00 58.87 57.95 1h66 n SER 139 Cb 0.08 -0.01 -0.06 0.00 -1.01 0.00 0.00 64.21 63.21 1h66 n SER 139 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1h66 s LYS 140 N -1.98 2.59 -0.00 1.43 1.02 -0.05 -4.96 119.74 117.79 1h66 s LYS 140 Ca 0.35 -1.27 0.07 0.00 0.02 0.00 0.00 55.97 55.13 1h66 s LYS 140 Cb 0.21 -2.35 -0.02 0.00 -0.52 0.00 0.00 37.83 35.15 1h66 s LYS 140 CO 0.32 0.34 -0.22 0.15 -0.92 0.00 0.00 175.35 175.02 1h66 s LYS 141 N -3.78 1.68 0.13 1.68 1.02 -0.49 -2.05 119.74 117.93 1h66 s LYS 141 Ca 0.33 -0.82 0.09 0.00 0.02 0.00 0.00 55.97 55.58 1h66 s LYS 141 Cb -0.07 -1.67 -0.04 0.00 -0.52 0.00 0.00 37.83 35.54 1h66 s LYS 141 CO 0.23 0.45 -0.20 0.00 -0.92 0.00 0.00 175.35 174.90 1h66 s ALA 142 N -0.58 1.93 -0.09 5.17 0.00 0.07 -1.63 121.76 126.64 1h66 s ALA 142 Ca 0.08 -1.36 -0.07 0.00 0.00 0.00 0.00 51.96 50.62 1h66 s ALA 142 Cb -0.08 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 22.83 1h66 s ALA 142 CO -0.00 0.33 0.22 0.08 0.00 0.00 0.00 175.76 176.39 1h66 s VAL 143 N -1.48 -0.01 -0.20 0.00 1.01 -0.76 -0.62 120.40 118.34 1h66 s VAL 143 Ca 0.10 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 1h66 s VAL 143 Cb -0.08 -0.32 -0.05 0.00 0.00 0.00 0.00 36.38 35.93 1h66 s VAL 143 CO 0.05 0.02 0.20 -0.76 0.00 0.00 0.00 175.10 174.61 1h66 s LEU 144 N 0.40 4.19 -0.34 3.92 1.43 -1.26 -1.21 118.68 125.80 1h66 s LEU 144 Ca -0.02 0.29 -0.01 0.00 -1.03 0.00 0.00 54.13 53.36 1h66 s LEU 144 Cb -0.04 -2.20 0.08 0.00 0.03 0.00 0.00 46.19 44.07 1h66 s LEU 144 CO -0.02 0.11 0.07 -0.55 0.23 0.00 0.00 176.35 176.19 1h66 s SER 145 N 0.62 4.97 0.00 2.29 0.15 0.73 -0.35 113.70 122.11 1h66 s SER 145 Ca 0.11 -1.69 0.05 0.00 0.70 0.00 0.00 55.95 55.11 1h66 s SER 145 Cb -0.12 -1.73 -0.03 0.00 -1.71 0.00 0.00 66.02 62.43 1h66 s SER 145 CO 0.02 -0.37 -0.13 -0.63 1.20 0.00 0.00 173.24 173.32 1h66 s ILE 146 N 1.14 3.15 0.09 6.45 1.01 -0.08 -1.80 121.20 131.16 1h66 s ILE 146 Ca 0.02 -0.93 0.09 0.00 0.00 0.00 0.00 60.65 59.83 1h66 s ILE 146 Cb -0.21 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 39.91 1h66 s ILE 146 CO -0.04 0.42 -0.22 0.42 0.00 0.00 0.00 174.94 175.52 1h66 s THR 147 N -0.90 2.52 0.17 2.92 -4.23 -1.01 -0.91 115.64 114.20 1h66 s THR 147 Ca 0.15 -1.46 0.01 0.00 -1.18 0.00 0.00 61.69 59.20 1h66 s THR 147 Cb -0.11 -2.09 -0.04 0.00 1.34 0.00 0.00 72.50 71.60 1h66 s THR 147 CO 0.05 0.22 0.04 0.42 -0.54 0.00 0.00 174.62 174.80 1h66 s THR 148 N -0.99 0.43 -0.11 3.99 -4.23 -0.96 -0.36 115.64 113.42 1h66 s THR 148 Ca 0.15 -1.96 -0.03 0.00 -1.18 0.00 0.00 61.69 58.66 1h66 s THR 148 Cb -0.10 -2.18 -0.26 0.00 1.34 0.00 0.00 72.50 71.30 1h66 s THR 148 CO 0.06 -0.39 0.41 0.61 -0.54 0.00 0.00 174.62 174.77 1h66 n GLY 149 N -0.22 -0.63 3.77 3.99 0.00 -1.26 -1.96 105.19 108.88 1h66 n GLY 149 Ca -0.05 -0.25 -0.38 0.00 0.00 0.00 0.00 46.02 45.35 1h66 n GLY 149 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1h66 s GLY 150 N -5.51 2.85 0.76 -0.02 0.00 -1.26 -4.05 107.32 100.09 1h66 s GLY 150 Ca -0.19 0.69 -0.11 0.00 0.00 0.00 0.00 44.72 45.10 1h66 s GLY 150 CO 0.78 1.17 1.08 -1.35 0.00 0.00 0.00 173.10 174.78 1h66 s SER 151 N -1.41 4.66 0.38 1.64 1.04 -1.26 -2.45 113.70 116.30 1h66 s SER 151 Ca 0.52 1.70 0.08 0.00 0.48 0.00 0.00 55.95 58.72 1h66 s SER 151 Cb -0.23 -2.45 0.80 0.00 0.10 0.00 0.00 66.02 64.24 1h66 s SER 151 CO 0.30 -1.91 1.97 1.23 0.98 0.00 0.00 173.24 175.80 1h66 h GLY 152 N -1.05 0.87 1.62 7.32 0.00 -1.96 -1.77 103.07 108.11 1h66 h GLY 152 Ca -0.44 -0.27 -0.08 0.00 0.00 0.00 0.00 47.33 46.53 1h66 h GLY 152 CO 0.54 0.20 -0.21 1.48 0.00 0.00 0.00 176.54 178.54 1h66 h SER 153 N 0.68 0.44 -0.12 0.19 4.64 -1.97 -2.11 113.55 115.30 1h66 h SER 153 Ca 0.30 -0.13 0.04 0.00 -0.47 0.00 0.00 61.79 61.52 1h66 h SER 153 Cb 0.31 -0.12 -0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1h66 h SER 153 CO -0.10 0.66 0.09 0.24 -0.87 0.00 0.00 176.83 176.86 1h66 h MET 154 N 0.40 0.00 -0.71 4.77 2.07 -1.68 -1.73 114.93 118.05 1h66 h MET 154 Ca 0.07 0.00 0.00 0.00 -2.07 0.00 0.00 59.70 57.70 1h66 h MET 154 Cb 0.59 0.00 0.00 0.00 -1.87 0.00 0.00 31.60 30.32 1h66 h MET 154 CO 0.04 0.00 0.00 0.66 1.07 0.00 0.00 176.91 178.68 1h66 n TYR 155 N -4.41 0.95 -2.08 -0.22 4.01 -0.82 -2.09 117.16 112.50 1h66 n TYR 155 Ca -0.00 -0.50 -0.28 0.00 -0.16 0.00 0.00 57.90 56.96 1h66 n TYR 155 Cb 0.21 -0.01 0.12 0.00 -0.31 0.00 0.00 39.34 39.35 1h66 n TYR 155 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1h66 s SER 156 N -1.00 4.12 0.51 7.72 1.04 -0.65 -1.63 113.70 123.81 1h66 s SER 156 Ca 0.47 0.38 0.22 0.00 0.48 0.00 0.00 55.95 57.49 1h66 s SER 156 Cb 0.25 -0.75 1.30 0.00 0.10 0.00 0.00 66.02 66.91 1h66 s SER 156 CO 0.32 -2.08 2.00 -0.07 0.98 0.00 0.00 173.24 174.39 1h66 h LEU 157 N -1.05 0.09 -1.95 2.42 3.38 -1.87 -1.30 115.31 115.02 1h66 h LEU 157 Ca -0.44 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 1h66 h LEU 157 Cb 1.29 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 42.02 1h66 h LEU 157 CO 0.52 0.05 0.00 0.00 0.09 0.00 0.00 178.44 179.10 1h66 n GLN 158 N -4.42 2.04 -2.03 1.13 3.00 -1.26 -4.62 117.38 111.21 1h66 n GLN 158 Ca 0.09 -1.87 -0.33 0.00 -0.01 0.00 0.00 57.00 54.88 1h66 n GLN 158 Cb 0.51 -1.42 0.01 0.00 0.00 0.00 0.00 30.24 29.34 1h66 n GLN 158 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1h66 s GLY 159 N -1.64 2.14 0.52 1.08 0.00 -0.49 -4.96 107.32 103.96 1h66 s GLY 159 Ca 0.27 0.41 0.16 0.00 0.00 0.00 0.00 44.72 45.57 1h66 s GLY 159 CO 0.27 0.73 2.14 1.19 0.00 0.00 0.00 173.10 177.44 1h66 h ILE 160 N 0.43 0.99 0.00 0.90 2.10 -1.81 -1.49 117.51 118.64 1h66 h ILE 160 Ca -0.47 -0.00 -0.07 0.00 1.08 0.00 0.00 64.86 65.40 1h66 h ILE 160 Cb 1.22 0.98 -0.01 0.00 -1.09 0.00 0.00 36.82 37.93 1h66 h ILE 160 CO 0.57 0.00 -0.32 0.45 -1.08 0.00 0.00 178.15 177.77 1h66 h HIS 161 N 0.01 0.00 0.00 2.19 3.86 -1.77 -3.50 115.15 115.94 1h66 h HIS 161 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1h66 h HIS 161 Cb 0.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.50 1h66 h HIS 161 CO -0.00 0.32 0.00 0.41 0.86 0.00 0.00 177.93 179.52 1h66 n GLY 162 N 1.18 0.25 3.69 2.45 0.00 -0.56 -4.96 105.19 107.24 1h66 n GLY 162 Ca 0.03 -1.87 -0.53 0.00 0.00 0.00 0.00 46.02 43.65 1h66 n GLY 162 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1h66 n ASP 163 N -0.67 2.84 0.26 1.61 2.03 -1.24 -4.28 116.55 117.10 1h66 n ASP 163 Ca 0.00 1.03 0.10 0.00 0.52 0.00 0.00 54.79 56.44 1h66 n ASP 163 Cb 0.00 -1.26 0.69 0.00 -0.72 0.00 0.00 41.12 39.83 1h66 n ASP 163 CO 0.00 0.00 0.00 -0.03 -1.92 0.00 0.00 177.20 175.25 1h66 h MET 164 N 7.86 0.00 0.00 -0.67 1.85 -1.60 -2.20 114.93 120.16 1h66 h MET 164 Ca -0.47 0.00 -0.01 0.00 -0.61 0.00 0.00 59.70 58.61 1h66 h MET 164 Cb 1.30 0.00 -0.00 0.00 0.43 0.00 0.00 31.60 33.32 1h66 h MET 164 CO 0.94 0.07 -0.05 -0.91 -0.40 0.00 0.00 176.91 176.57 1h66 h ASN 165 N 0.00 0.00 0.33 1.39 2.35 -1.90 -1.10 115.58 116.65 1h66 h ASN 165 Ca -0.00 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.49 1h66 h ASN 165 Cb 0.15 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.53 1h66 h ASN 165 CO 0.01 0.05 -1.12 0.58 -1.65 0.00 0.00 177.43 175.29 1h66 h VAL 166 N 0.00 1.38 -0.45 2.81 2.07 -1.78 -2.85 116.25 117.43 1h66 h VAL 166 Ca -0.00 -2.59 -0.06 0.00 0.82 0.00 0.00 66.70 64.86 1h66 h VAL 166 Cb 0.09 2.64 -0.02 0.00 -1.52 0.00 0.00 31.29 32.49 1h66 h VAL 166 CO 0.01 0.78 0.03 0.40 0.02 0.00 0.00 177.57 178.80 1h66 h ILE 167 N 0.21 1.26 0.00 4.57 2.04 -1.39 -3.10 117.51 121.10 1h66 h ILE 167 Ca -0.13 -0.99 -0.08 0.00 1.00 0.00 0.00 64.86 64.66 1h66 h ILE 167 Cb 1.79 1.02 -0.01 0.00 -0.74 0.00 0.00 36.82 38.88 1h66 h ILE 167 CO 0.20 0.34 -0.39 -0.07 0.00 0.00 0.00 178.15 178.24 1h66 h LEU 168 N 0.62 0.00 -0.29 1.44 3.38 -1.30 -3.36 115.31 115.80 1h66 h LEU 168 Ca 0.13 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.16 1h66 h LEU 168 Cb 0.45 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.12 1h66 h LEU 168 CO 0.02 0.39 -0.41 -0.25 0.09 0.00 0.00 178.44 178.28 1h66 h TRP 169 N 0.00 -1.17 -0.90 1.13 2.91 -1.42 -0.20 115.95 116.29 1h66 h TRP 169 Ca -0.00 0.06 0.17 0.00 1.13 0.00 0.00 58.89 60.24 1h66 h TRP 169 Cb 0.83 0.56 -0.07 0.00 -0.51 0.00 0.00 29.16 29.96 1h66 h TRP 169 CO 0.00 -0.44 0.58 -1.35 -1.03 0.00 0.00 178.44 176.20 1h66 h PRO 170 N -0.38 0.59 0.01 2.65 0.11 -1.74 0.55 132.00 133.78 1h66 h PRO 170 Ca 0.12 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.19 1h66 h PRO 170 Cb 0.59 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.57 1h66 h PRO 170 CO -0.50 0.39 -0.01 0.82 -0.21 0.00 0.00 178.00 178.50 1h66 h ILE 171 N 0.61 0.65 -0.39 4.15 2.04 -1.64 -2.76 117.51 120.16 1h66 h ILE 171 Ca 0.47 -1.46 -0.10 0.00 1.00 0.00 0.00 64.86 64.76 1h66 h ILE 171 Cb 0.88 1.22 -0.02 0.00 -0.74 0.00 0.00 36.82 38.17 1h66 h ILE 171 CO -0.22 0.22 -0.18 1.56 0.00 0.00 0.00 178.15 179.54 1h66 h GLN 172 N -1.00 0.74 0.00 2.37 4.20 -0.97 -1.81 115.11 118.65 1h66 h GLN 172 Ca -0.00 -0.27 -0.03 0.00 0.06 0.00 0.00 58.65 58.40 1h66 h GLN 172 Cb 0.37 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.10 1h66 h GLN 172 CO 0.00 0.87 -0.70 0.45 -0.67 0.00 0.00 178.83 178.78 1h66 n SER 173 N -4.14 1.84 0.03 1.46 2.88 0.18 -1.38 113.62 114.48 1h66 n SER 173 Ca 0.01 0.56 0.10 0.00 -1.33 0.00 0.00 58.87 58.21 1h66 n SER 173 Cb 0.40 -0.86 0.53 0.00 -0.75 0.00 0.00 64.21 63.53 1h66 n SER 173 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 1h66 h GLY 174 N -1.00 0.39 0.00 0.46 0.00 -1.43 -1.17 103.07 100.31 1h66 h GLY 174 Ca -0.05 -0.13 -0.02 0.00 0.00 0.00 0.00 47.33 47.14 1h66 h GLY 174 CO -0.03 0.10 -0.70 1.39 0.00 0.00 0.00 176.54 177.30 1h66 n ILE 175 N -4.48 1.38 0.28 2.60 5.41 -0.75 -4.49 119.36 119.31 1h66 n ILE 175 Ca 0.05 0.22 -0.13 0.00 1.00 0.00 0.00 62.75 63.88 1h66 n ILE 175 Cb 0.24 -2.05 -0.07 0.00 -0.71 0.00 0.00 39.64 37.06 1h66 n ILE 175 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 176.55 176.48 1h66 h LEU 176 N -0.63 -0.63 -1.14 1.39 3.38 -1.49 -3.17 115.31 113.02 1h66 h LEU 176 Ca -0.02 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.85 1h66 h LEU 176 Cb 0.67 0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.56 1h66 h LEU 176 CO -0.01 -0.24 -0.12 -0.74 0.09 0.00 0.00 178.44 177.41 1h66 h HIS 177 N -1.12 0.48 -0.54 1.13 2.76 -1.22 -2.31 115.15 114.34 1h66 h HIS 177 Ca -0.08 -0.07 0.07 0.00 -2.20 0.00 0.00 60.37 58.09 1h66 h HIS 177 Cb 0.62 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 29.42 1h66 h HIS 177 CO 0.01 0.57 0.36 0.35 -1.30 0.00 0.00 177.93 177.91 1h66 h PHE 178 N 0.42 0.44 -0.02 5.26 3.04 -1.30 0.51 116.94 125.31 1h66 h PHE 178 Ca 0.08 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.04 1h66 h PHE 178 Cb 0.47 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.83 1h66 h PHE 178 CO 0.01 0.23 0.00 0.00 -2.02 0.00 0.00 178.31 176.54 1h66 n GLY 180 N 1.13 1.50 3.70 0.00 0.00 0.17 -1.60 105.19 110.09 1h66 n GLY 180 Ca 0.20 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.81 1h66 n GLY 180 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1h66 n PHE 181 N -1.26 2.21 -3.08 1.61 3.72 -1.03 -2.82 117.46 116.82 1h66 n PHE 181 Ca 0.00 0.51 -0.41 0.00 -0.05 0.00 0.00 57.45 57.51 1h66 n PHE 181 Cb 0.00 -2.39 -0.06 0.00 -0.94 0.00 0.00 39.48 36.09 1h66 n PHE 181 CO 0.00 0.00 0.00 -0.65 -0.05 0.00 0.00 176.76 176.06 1h66 s GLN 182 N -2.12 4.16 -0.20 -1.08 -0.21 -0.87 -4.32 119.66 115.03 1h66 s GLN 182 Ca 0.59 0.64 -0.14 0.00 0.02 0.00 0.00 55.36 56.47 1h66 s GLN 182 Cb -0.52 -3.62 -0.04 0.00 1.00 0.00 0.00 33.01 29.82 1h66 s GLN 182 CO 0.59 -0.36 0.31 0.08 -2.12 0.00 0.00 175.29 173.79 1h66 s VAL 183 N 2.33 5.27 0.55 1.09 1.01 -1.26 -0.75 120.40 128.63 1h66 s VAL 183 Ca 0.29 0.53 -0.02 0.00 0.00 0.00 0.00 61.98 62.77 1h66 s VAL 183 Cb -0.16 -3.64 0.02 0.00 0.00 0.00 0.00 36.38 32.60 1h66 s VAL 183 CO 0.09 0.32 0.81 -0.76 0.00 0.00 0.00 175.10 175.55 1h66 s LEU 184 N 0.98 3.34 0.21 3.92 1.43 0.21 -0.26 118.68 128.51 1h66 s LEU 184 Ca 0.15 0.38 -0.32 0.00 -1.03 0.00 0.00 54.13 53.31 1h66 s LEU 184 Cb -0.14 -3.22 -0.13 0.00 0.03 0.00 0.00 46.19 42.73 1h66 s LEU 184 CO 0.06 -1.01 1.57 -0.62 0.23 0.00 0.00 176.35 176.58 1h66 n GLU 185 N -2.39 2.35 -2.09 1.70 1.02 -1.26 -4.68 120.64 115.29 1h66 n GLU 185 Ca 0.04 0.84 -0.34 0.00 -0.02 0.00 0.00 57.16 57.69 1h66 n GLU 185 Cb 0.58 -2.61 0.01 0.00 -0.02 0.00 0.00 31.44 29.41 1h66 n GLU 185 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1h66 s PRO 186 N 0.42 3.22 -0.53 3.49 0.04 -1.26 -4.74 135.00 135.65 1h66 s PRO 186 Ca 0.73 1.44 -0.19 0.00 0.04 0.00 0.00 61.00 63.02 1h66 s PRO 186 Cb -0.60 -2.00 0.07 0.00 0.04 0.00 0.00 34.50 32.01 1h66 s PRO 186 CO 0.41 -0.92 0.62 -1.14 0.04 0.00 0.00 177.00 176.01 1h66 s GLN 187 N -3.68 3.08 -0.34 4.56 2.00 0.52 -4.99 119.66 120.82 1h66 s GLN 187 Ca 0.69 -1.07 -0.09 0.00 -2.00 0.00 0.00 55.36 52.88 1h66 s GLN 187 Cb -0.20 -4.15 0.02 0.00 0.80 0.00 0.00 33.01 29.47 1h66 s GLN 187 CO 0.32 -1.29 0.16 -0.51 -0.50 0.00 0.00 175.29 173.48 1h66 s LEU 188 N 2.51 4.36 -0.46 3.68 1.43 -1.26 -0.90 118.68 128.04 1h66 s LEU 188 Ca 0.13 -0.84 -0.02 0.00 -1.03 0.00 0.00 54.13 52.37 1h66 s LEU 188 Cb -0.21 -1.98 0.12 0.00 0.03 0.00 0.00 46.19 44.15 1h66 s LEU 188 CO 0.10 -0.29 0.24 0.42 0.23 0.00 0.00 176.35 177.05 1h66 s THR 189 N 1.54 3.25 0.56 5.49 -4.23 -0.09 -5.01 115.64 117.15 1h66 s THR 189 Ca 0.02 -2.35 -0.18 0.00 -1.18 0.00 0.00 61.69 58.01 1h66 s THR 189 Cb -0.18 -3.22 -0.05 0.00 1.34 0.00 0.00 72.50 70.39 1h66 s THR 189 CO 0.05 -0.73 1.08 -0.31 -0.54 0.00 0.00 174.62 174.17 1h66 s TYR 190 N 0.78 2.85 -0.79 3.99 2.02 -1.26 -2.25 117.35 122.68 1h66 s TYR 190 Ca 0.11 1.54 -0.14 0.00 -0.37 0.00 0.00 57.07 58.22 1h66 s TYR 190 Cb -0.22 -3.12 0.02 0.00 -0.40 0.00 0.00 41.96 38.24 1h66 s TYR 190 CO -0.04 -1.24 0.26 -1.13 -1.57 0.00 0.00 175.55 171.82 1h66 n SER 191 N -1.60 -1.33 0.32 2.29 3.41 -0.83 -4.78 113.62 111.11 1h66 n SER 191 Ca 0.10 -0.77 0.21 0.00 -0.26 0.00 0.00 58.87 58.15 1h66 n SER 191 Cb 0.52 -0.94 1.09 0.00 -0.26 0.00 0.00 64.21 64.62 1h66 n SER 191 CO 0.00 0.00 0.00 -0.29 -0.16 0.00 0.00 175.04 174.59 1h66 h ILE 192 N -0.44 0.02 0.00 -1.33 6.09 -1.63 -0.99 117.51 119.24 1h66 h ILE 192 Ca -0.41 -0.13 0.00 0.00 -1.37 0.00 0.00 64.86 62.94 1h66 h ILE 192 Cb 0.83 1.13 0.00 0.00 0.47 0.00 0.00 36.82 39.25 1h66 h ILE 192 CO 0.35 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 176.04 1h66 n GLY 193 N -0.81 -1.23 0.60 8.18 0.00 -1.26 -3.28 105.19 107.38 1h66 n GLY 193 Ca -0.02 -0.14 0.06 0.00 0.00 0.00 0.00 46.02 45.92 1h66 n GLY 193 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1h66 n HIS 194 N -1.27 0.00 -3.91 1.61 8.25 -0.38 -5.03 115.22 114.49 1h66 n HIS 194 Ca 0.14 -0.98 -0.36 0.00 -0.26 0.00 0.00 57.72 56.26 1h66 n HIS 194 Cb 0.22 -0.18 -0.12 0.00 1.12 0.00 0.00 29.99 31.04 1h66 n HIS 194 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1h66 s THR 195 N -2.13 4.22 0.54 1.59 2.01 -1.21 -5.08 115.64 115.57 1h66 s THR 195 Ca 0.31 -0.21 -0.20 0.00 0.31 0.00 0.00 61.69 61.90 1h66 s THR 195 Cb 0.30 -2.94 -0.09 0.00 0.01 0.00 0.00 72.50 69.79 1h66 s THR 195 CO -0.05 0.39 0.68 -2.65 -0.69 0.00 0.00 174.62 172.30 1h66 n PRO 196 N 4.48 0.71 -0.15 4.92 -0.02 -1.26 -4.69 135.00 138.99 1h66 n PRO 196 Ca -0.17 0.27 0.07 0.00 -2.02 0.00 0.00 63.50 61.66 1h66 n PRO 196 Cb 0.52 -1.81 0.38 0.00 -0.02 0.00 0.00 33.50 32.57 1h66 n PRO 196 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1h66 h ALA 197 N 0.54 1.76 -0.58 3.55 0.00 -1.99 -1.41 119.26 121.13 1h66 h ALA 197 Ca -0.45 -0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.38 1h66 h ALA 197 Cb 1.38 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.98 1h66 h ALA 197 CO 0.50 0.13 0.13 0.38 0.00 0.00 0.00 179.25 180.38 1h66 h ASP 198 N 0.68 0.89 -0.31 0.00 2.03 -2.00 -2.27 116.42 115.44 1h66 h ASP 198 Ca 0.30 -0.24 -0.09 0.00 -0.73 0.00 0.00 57.03 56.27 1h66 h ASP 198 Cb 0.29 -0.24 -0.02 0.00 -0.83 0.00 0.00 39.33 38.53 1h66 h ASP 198 CO -0.09 0.90 -0.10 0.00 -1.03 0.00 0.00 179.24 178.92 1h66 h ALA 199 N 1.02 1.05 -0.20 4.15 0.00 -1.66 -2.55 119.26 121.08 1h66 h ALA 199 Ca 0.18 -0.30 -0.07 0.00 0.00 0.00 0.00 54.91 54.71 1h66 h ALA 199 Cb 0.37 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1h66 h ALA 199 CO 0.00 0.58 -0.20 0.00 0.00 0.00 0.00 179.25 179.64 1h66 h ARG 200 N 0.66 0.36 -0.53 0.00 3.08 -0.98 0.28 114.38 117.24 1h66 h ARG 200 Ca 0.12 -0.11 -0.12 0.00 0.07 0.00 0.00 59.98 59.94 1h66 h ARG 200 Cb 0.56 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.56 1h66 h ARG 200 CO 0.03 0.55 -0.12 0.82 -1.07 0.00 0.00 179.97 180.18 1h66 h ILE 201 N 0.33 1.27 -0.04 2.04 2.04 -1.08 -2.68 117.51 119.39 1h66 h ILE 201 Ca 0.06 -1.28 -0.12 0.00 1.00 0.00 0.00 64.86 64.51 1h66 h ILE 201 Cb 0.54 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1h66 h ILE 201 CO 0.04 0.45 -0.55 -0.61 0.00 0.00 0.00 178.15 177.48 1h66 h GLN 202 N 0.90 0.11 -0.39 2.37 5.75 -1.02 -2.52 115.11 120.30 1h66 h GLN 202 Ca 0.14 -0.06 -0.04 0.00 -0.15 0.00 0.00 58.65 58.53 1h66 h GLN 202 Cb 0.69 0.01 -0.02 0.00 1.07 0.00 0.00 27.48 29.23 1h66 h GLN 202 CO 0.05 0.62 0.10 0.82 -2.65 0.00 0.00 178.83 177.77 1h66 h ILE 203 N 0.08 1.23 -0.75 2.39 2.04 -0.77 -0.08 117.51 121.66 1h66 h ILE 203 Ca -0.00 -0.78 -0.04 0.00 1.00 0.00 0.00 64.86 65.04 1h66 h ILE 203 Cb 0.99 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 38.02 1h66 h ILE 203 CO 0.08 0.27 0.32 -0.07 0.00 0.00 0.00 178.15 178.75 1h66 h LEU 204 N 0.49 0.99 -0.48 1.44 3.38 -1.36 -2.24 115.31 117.54 1h66 h LEU 204 Ca 0.12 -0.13 -0.17 0.00 0.09 0.00 0.00 57.88 57.79 1h66 h LEU 204 Cb 0.31 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1h66 h LEU 204 CO 0.00 0.87 -0.59 -0.33 0.09 0.00 0.00 178.44 178.48 1h66 h GLU 205 N 1.07 0.55 -0.05 1.13 4.39 -1.16 -2.13 114.58 118.38 1h66 h GLU 205 Ca 0.25 -0.37 -0.07 0.00 0.34 0.00 0.00 59.36 59.51 1h66 h GLU 205 Cb 0.16 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 1h66 h GLU 205 CO -0.03 0.98 -0.31 0.78 -1.16 0.00 0.00 179.01 179.27 1h66 h GLY 206 N 1.07 0.09 0.92 -3.84 0.00 -0.80 -0.95 103.07 99.56 1h66 h GLY 206 Ca -0.00 -0.07 -0.16 0.00 0.00 0.00 0.00 47.33 47.09 1h66 h GLY 206 CO 0.11 0.07 -0.57 -0.25 0.00 0.00 0.00 176.54 175.89 1h66 h TRP 207 N 0.08 0.76 -0.65 5.60 -0.00 -1.29 -2.17 115.95 118.28 1h66 h TRP 207 Ca 0.01 -0.35 -0.03 0.00 -0.00 0.00 0.00 58.89 58.52 1h66 h TRP 207 Cb 0.59 -0.11 -0.03 0.00 -0.00 0.00 0.00 29.16 29.61 1h66 h TRP 207 CO 0.00 1.14 0.27 0.87 -0.00 0.00 0.00 178.44 180.73 1h66 h LYS 208 N 0.16 0.96 -0.37 2.65 1.57 -1.08 -2.37 116.57 118.09 1h66 h LYS 208 Ca -0.05 -0.16 -0.07 0.00 -1.87 0.00 0.00 60.65 58.50 1h66 h LYS 208 Cb 1.22 -0.16 -0.02 0.00 0.08 0.00 0.00 32.23 33.36 1h66 h LYS 208 CO 0.12 0.79 -0.07 -0.22 -0.57 0.00 0.00 179.45 179.50 1h66 h LYS 209 N 0.91 0.62 -0.47 3.15 3.64 -1.19 -2.82 116.57 120.40 1h66 h LYS 209 Ca 0.22 -0.17 -0.09 0.00 -1.27 0.00 0.00 60.65 59.34 1h66 h LYS 209 Cb 0.18 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.91 1h66 h LYS 209 CO -0.02 0.70 -0.07 -0.09 -2.27 0.00 0.00 179.45 177.70 1h66 h ARG 210 N 0.58 0.82 0.00 1.90 2.43 -1.03 -2.84 114.38 116.24 1h66 h ARG 210 Ca 0.11 -0.26 0.00 0.00 -0.81 0.00 0.00 59.98 59.02 1h66 h ARG 210 Cb 0.47 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.95 1h66 h ARG 210 CO 0.03 0.87 0.00 -0.07 -1.51 0.00 0.00 179.97 179.28 1h66 h LEU 211 N 0.75 0.00 -1.42 3.80 3.38 -1.18 -2.58 115.31 118.05 1h66 h LEU 211 Ca 0.13 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.07 1h66 h LEU 211 Cb 0.55 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.29 1h66 h LEU 211 CO 0.03 0.00 0.05 -0.33 0.09 0.00 0.00 178.44 178.28 1h66 h GLU 212 N 0.00 0.43 0.00 1.13 5.08 -1.41 -3.11 114.58 116.70 1h66 h GLU 212 Ca 0.00 -0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 1h66 h GLU 212 Cb 0.40 -0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.49 1h66 h GLU 212 CO 0.00 0.42 -0.50 0.09 -1.00 0.00 0.00 179.01 178.02 1h66 n ASN 213 N -4.35 1.56 -0.27 1.42 3.02 -1.11 -4.86 115.26 110.67 1h66 n ASN 213 Ca 0.01 -3.20 0.03 0.00 -0.03 0.00 0.00 54.58 51.40 1h66 n ASN 213 Cb 0.19 -0.44 0.17 0.00 -0.61 0.00 0.00 39.78 39.09 1h66 n ASN 213 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 1h66 h ILE 214 N 2.47 0.82 0.00 2.41 6.09 -1.39 -2.15 117.51 125.77 1h66 h ILE 214 Ca -0.05 -0.22 0.00 0.00 -1.37 0.00 0.00 64.86 63.23 1h66 h ILE 214 Cb 1.21 0.13 0.00 0.00 0.47 0.00 0.00 36.82 38.63 1h66 h ILE 214 CO 0.02 0.12 0.00 1.87 -3.07 0.00 0.00 178.15 177.09 1h66 n TRP 215 N -4.85 0.79 0.42 2.19 -0.00 -1.26 -1.95 117.44 112.79 1h66 n TRP 215 Ca 0.13 0.35 0.12 0.00 -0.00 0.00 0.00 57.50 58.10 1h66 n TRP 215 Cb 0.32 -1.06 0.14 0.00 -0.00 0.00 0.00 31.31 30.71 1h66 n TRP 215 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 177.69 177.25 1h66 h ASP 216 N 0.00 0.00 -3.91 5.87 3.32 -1.78 -3.48 116.42 116.44 1h66 h ASP 216 Ca 0.00 -0.13 -0.56 0.00 0.02 0.00 0.00 57.03 56.36 1h66 h ASP 216 Cb 0.24 0.00 0.14 0.00 0.22 0.00 0.00 39.33 39.93 1h66 h ASP 216 CO 0.00 0.06 0.52 -0.62 -1.72 0.00 0.00 179.24 177.48 1h66 n GLU 217 N -2.35 1.58 -3.04 3.56 1.02 -0.82 -4.99 120.64 115.59 1h66 n GLU 217 Ca 0.03 0.58 -0.40 0.00 -0.02 0.00 0.00 57.16 57.35 1h66 n GLU 217 Cb 0.48 -2.50 -0.05 0.00 -0.02 0.00 0.00 31.44 29.35 1h66 n GLU 217 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1h66 s THR 218 N -1.31 4.97 0.79 2.62 -1.32 -1.26 -5.06 115.64 115.08 1h66 s THR 218 Ca 0.72 1.48 -0.11 0.00 -1.21 0.00 0.00 61.69 62.56 1h66 s THR 218 Cb -0.43 -4.05 0.07 0.00 -1.51 0.00 0.00 72.50 66.58 1h66 s THR 218 CO 0.49 0.28 1.09 -2.16 -2.21 0.00 0.00 174.62 172.12 1h66 s PRO 219 N 0.57 2.14 0.89 7.08 0.04 -1.26 -4.63 135.00 139.82 1h66 s PRO 219 Ca 0.38 0.73 -0.11 0.00 0.04 0.00 0.00 61.00 62.04 1h66 s PRO 219 Cb -0.18 -1.92 0.13 0.00 0.04 0.00 0.00 34.50 32.57 1h66 s PRO 219 CO 0.19 -1.61 1.11 -0.51 0.04 0.00 0.00 177.00 176.22 1h66 s LEU 220 N -5.80 2.61 -0.24 -3.56 1.43 0.64 -4.24 118.68 109.52 1h66 s LEU 220 Ca 0.61 1.90 -0.10 0.00 -1.03 0.00 0.00 54.13 55.50 1h66 s LEU 220 Cb -0.15 -4.34 -0.05 0.00 0.03 0.00 0.00 46.19 41.68 1h66 s LEU 220 CO 0.55 -2.81 0.15 -0.47 0.23 0.00 0.00 176.35 174.00 1h66 s TYR 221 N -2.76 3.30 0.05 0.29 5.04 -1.26 -4.82 117.35 117.19 1h66 s TYR 221 Ca 0.65 0.18 0.08 0.00 -2.44 0.00 0.00 57.07 55.54 1h66 s TYR 221 Cb -0.20 -2.27 -0.03 0.00 0.35 0.00 0.00 41.96 39.81 1h66 s TYR 221 CO 0.58 0.04 -0.22 -0.06 -1.34 0.00 0.00 175.55 174.55 1h66 s PHE 222 N 1.10 1.89 0.22 4.97 0.08 -1.26 -4.89 117.98 120.08 1h66 s PHE 222 Ca 0.07 -0.38 -0.32 0.00 0.12 0.00 0.00 56.93 56.42 1h66 s PHE 222 Cb -0.14 -1.12 -0.12 0.00 -0.57 0.00 0.00 43.02 41.07 1h66 s PHE 222 CO 0.05 0.10 1.71 0.00 -0.10 0.00 0.00 175.22 176.98 1h66 s ALA 223 N -0.81 3.92 0.47 5.36 0.00 -1.26 -4.93 121.76 124.50 1h66 s ALA 223 Ca 0.08 1.59 -0.24 0.00 0.00 0.00 0.00 51.96 53.39 1h66 s ALA 223 Cb -0.09 -3.69 -0.07 0.00 0.00 0.00 0.00 23.12 19.27 1h66 s ALA 223 CO 0.02 -0.93 1.30 -2.14 0.00 0.00 0.00 175.76 174.00 1h66 s PRO 224 N 1.00 3.63 0.59 0.00 0.02 -1.26 -4.91 135.00 134.07 1h66 s PRO 224 Ca 0.74 2.11 0.37 0.00 0.02 0.00 0.00 61.00 64.24 1h66 s PRO 224 Cb -0.50 -2.50 1.81 0.00 0.02 0.00 0.00 34.50 33.33 1h66 s PRO 224 CO 0.34 -0.76 2.15 0.66 -0.33 0.00 0.00 177.00 179.06 1h66 h SER 225 N 2.11 0.00 0.18 2.53 4.64 -1.94 -2.06 113.55 119.00 1h66 h SER 225 Ca -0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.82 1h66 h SER 225 Cb 1.27 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.36 1h66 h SER 225 CO 0.60 0.02 0.00 -1.54 -0.87 0.00 0.00 176.83 175.04 1h66 n SER 226 N -3.17 0.00 -0.44 4.97 3.41 -1.26 -1.71 113.62 115.43 1h66 n SER 226 Ca -0.01 0.15 0.13 0.00 -0.26 0.00 0.00 58.87 58.88 1h66 n SER 226 Cb 0.20 -0.29 0.37 0.00 -0.26 0.00 0.00 64.21 64.23 1h66 n SER 226 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1h66 n LEU 227 N -1.29 1.52 -4.45 1.04 4.77 -0.78 -4.93 117.00 112.88 1h66 n LEU 227 Ca 0.04 -0.48 -0.23 0.00 -0.03 0.00 0.00 56.01 55.31 1h66 n LEU 227 Cb 0.08 -0.05 -0.10 0.00 -2.33 0.00 0.00 43.42 41.02 1h66 n LEU 227 CO 0.07 0.27 -0.48 -0.36 -1.33 0.00 0.00 177.39 175.56 1h66 s PHE 228 N -2.25 2.22 -0.84 -1.77 0.40 -0.69 -1.29 117.98 113.75 1h66 s PHE 228 Ca 0.29 -0.36 -0.19 0.00 -0.60 0.00 0.00 56.93 56.08 1h66 s PHE 228 Cb 0.20 -0.97 0.13 0.00 0.51 0.00 0.00 43.02 42.89 1h66 s PHE 228 CO 0.43 0.67 1.01 -0.51 0.70 0.00 0.00 175.22 177.52 1h66 s ASP 229 N -3.47 6.53 -0.18 1.36 1.01 0.21 -4.75 116.67 117.38 1h66 s ASP 229 Ca 0.29 -1.91 -0.04 0.00 0.71 0.00 0.00 52.55 51.59 1h66 s ASP 229 Cb -0.05 -2.36 -0.15 0.00 1.01 0.00 0.00 42.92 41.37 1h66 s ASP 229 CO 0.14 -1.06 2.41 0.18 0.21 0.00 0.00 175.17 177.06 1h66 n LEU 230 N 6.34 3.67 -4.08 1.23 4.77 -1.26 -2.89 117.00 124.77 1h66 n LEU 230 Ca 0.15 -2.34 -0.12 0.00 -0.03 0.00 0.00 56.01 53.67 1h66 n LEU 230 Cb 0.47 -0.94 -0.11 0.00 -2.33 0.00 0.00 43.42 40.52 1h66 n LEU 230 CO 0.51 0.87 -0.39 0.54 -1.33 0.00 0.00 177.39 177.58 1h66 s ASN 231 N 2.53 0.87 0.46 -1.43 2.20 -1.26 -4.98 114.94 113.34 1h66 s ASN 231 Ca 0.42 -0.67 0.18 0.00 -0.94 0.00 0.00 52.86 51.85 1h66 s ASN 231 Cb 0.18 0.06 1.12 0.00 -2.00 0.00 0.00 41.25 40.61 1h66 s ASN 231 CO -0.01 -0.29 2.01 -0.26 -2.94 0.00 0.00 177.10 175.61 1h66 h PHE 232 N 4.08 0.00 0.15 1.54 0.04 -1.96 -2.28 116.94 118.51 1h66 h PHE 232 Ca -0.35 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.41 1h66 h PHE 232 Cb 1.19 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.34 1h66 h PHE 232 CO 0.63 0.17 -0.07 0.37 -0.60 0.00 0.00 178.31 178.81 1h66 h GLN 233 N 0.00 -0.19 0.00 1.51 5.75 -1.96 -2.71 115.11 117.51 1h66 h GLN 233 Ca -0.00 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1h66 h GLN 233 Cb 0.33 0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.93 1h66 h GLN 233 CO 0.02 0.04 0.00 0.00 -2.65 0.00 0.00 178.83 176.24 1h66 n ALA 234 N -2.29 1.76 -1.49 3.38 0.00 -1.12 -4.88 120.51 115.87 1h66 n ALA 234 Ca -0.09 -0.02 -0.09 0.00 0.00 0.00 0.00 53.44 53.25 1h66 n ALA 234 Cb 0.18 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.29 1h66 n ALA 234 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1h66 n GLY 235 N 0.20 0.80 3.92 0.00 0.00 -0.88 -3.38 105.19 105.86 1h66 n GLY 235 Ca 0.04 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 1h66 n GLY 235 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1h66 n PHE 236 N -3.06 -2.29 -3.24 1.61 3.01 -1.09 -4.98 117.46 107.43 1h66 n PHE 236 Ca -0.09 0.90 -0.26 0.00 1.01 0.00 0.00 57.45 59.02 1h66 n PHE 236 Cb 0.37 -3.97 -0.01 0.00 -0.01 0.00 0.00 39.48 35.86 1h66 n PHE 236 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 1h66 s LEU 237 N -7.28 3.95 0.54 4.37 1.43 -1.22 -4.70 118.68 115.78 1h66 s LEU 237 Ca 0.65 0.59 -0.22 0.00 -1.03 0.00 0.00 54.13 54.13 1h66 s LEU 237 Cb -0.33 -3.46 -0.06 0.00 0.03 0.00 0.00 46.19 42.37 1h66 s LEU 237 CO 0.83 -0.32 1.21 0.23 0.23 0.00 0.00 176.35 178.53 1h66 n MET 238 N -1.68 1.47 -2.08 1.70 2.81 -1.26 -0.61 117.12 117.46 1h66 n MET 238 Ca -0.03 0.54 -0.39 0.00 -1.81 0.00 0.00 57.70 56.01 1h66 n MET 238 Cb 0.55 -2.40 -0.01 0.00 -0.71 0.00 0.00 33.22 30.66 1h66 n MET 238 CO 0.00 0.00 0.00 0.15 1.51 0.00 0.00 175.97 177.63 1h66 s LYS 239 N -2.70 3.95 0.19 0.03 1.02 -0.42 -4.69 119.74 117.12 1h66 s LYS 239 Ca 0.71 2.10 -0.14 0.00 0.02 0.00 0.00 55.97 58.67 1h66 s LYS 239 Cb -0.44 -2.72 0.20 0.00 -0.52 0.00 0.00 37.83 34.35 1h66 s LYS 239 CO 0.50 -0.49 1.66 0.87 -0.92 0.00 0.00 175.35 176.96 1h66 h LYS 240 N 2.61 0.05 -0.58 1.68 6.56 -1.91 0.68 116.57 125.66 1h66 h LYS 240 Ca -0.49 -0.00 0.02 0.00 -1.06 0.00 0.00 60.65 59.11 1h66 h LYS 240 Cb 1.25 -0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 32.86 1h66 h LYS 240 CO 0.62 0.03 0.36 0.93 -2.06 0.00 0.00 179.45 179.34 1h66 h GLU 241 N 0.05 0.70 -0.43 3.15 3.07 -1.98 -1.47 114.58 117.67 1h66 h GLU 241 Ca 0.27 -0.04 0.02 0.00 -0.50 0.00 0.00 59.36 59.10 1h66 h GLU 241 Cb 0.41 -0.16 -0.03 0.00 -0.84 0.00 0.00 28.75 28.14 1h66 h GLU 241 CO -0.51 0.46 0.25 0.28 -1.40 0.00 0.00 179.01 178.10 1h66 h VAL 242 N 0.72 1.05 0.16 3.13 2.07 -1.57 -1.17 116.25 120.64 1h66 h VAL 242 Ca 0.23 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.58 1h66 h VAL 242 Cb -0.01 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.23 1h66 h VAL 242 CO -0.08 0.09 -0.21 1.56 0.02 0.00 0.00 177.57 178.95 1h66 h GLN 243 N 0.51 -0.41 -0.93 1.57 4.20 -0.39 -0.65 115.11 119.03 1h66 h GLN 243 Ca 0.17 0.03 0.03 0.00 0.06 0.00 0.00 58.65 58.94 1h66 h GLN 243 Cb 0.01 0.09 -0.05 0.00 0.30 0.00 0.00 27.48 27.82 1h66 h GLN 243 CO -0.08 -0.27 0.60 -0.44 -0.67 0.00 0.00 178.83 177.98 1h66 h ASP 244 N -0.42 1.01 -0.21 1.46 3.32 -1.07 -1.25 116.42 119.26 1h66 h ASP 244 Ca 0.01 -0.01 -0.10 0.00 0.02 0.00 0.00 57.03 56.95 1h66 h ASP 244 Cb 0.42 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.72 1h66 h ASP 244 CO -0.08 0.70 -0.19 -0.33 -1.72 0.00 0.00 179.24 177.61 1h66 h GLU 245 N 1.18 0.65 0.00 3.56 5.08 -1.05 -2.66 114.58 121.34 1h66 h GLU 245 Ca 0.37 -0.24 -0.04 0.00 -1.00 0.00 0.00 59.36 58.45 1h66 h GLU 245 Cb -0.01 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 1h66 h GLU 245 CO -0.12 0.80 -0.21 1.49 -1.00 0.00 0.00 179.01 179.98 1h66 h GLU 246 N 0.58 0.00 0.00 2.33 4.57 -0.27 -2.81 114.58 118.98 1h66 h GLU 246 Ca 0.09 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1h66 h GLU 246 Cb 0.65 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.24 1h66 h GLU 246 CO 0.05 0.21 0.00 0.87 -1.18 0.00 0.00 179.01 178.95 1h66 h LYS 247 N 0.00 0.00 -0.36 1.92 1.57 -0.88 -0.63 116.57 118.19 1h66 h LYS 247 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1h66 h LYS 247 Cb 0.59 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.90 1h66 h LYS 247 CO 0.03 0.00 0.00 0.09 -0.57 0.00 0.00 179.45 179.00 1h66 n ASN 248 N -2.86 3.19 -4.78 0.86 3.02 -1.06 -4.92 115.26 108.71 1h66 n ASN 248 Ca -0.02 -1.96 -0.37 0.00 -0.03 0.00 0.00 54.58 52.21 1h66 n ASN 248 Cb 0.12 -0.23 -0.07 0.00 -0.61 0.00 0.00 39.78 38.99 1h66 n ASN 248 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1h66 s LYS 249 N -1.54 4.03 0.21 3.52 -0.14 -0.25 -5.00 119.74 120.57 1h66 s LYS 249 Ca 0.38 0.09 -0.07 0.00 -1.36 0.00 0.00 55.97 55.01 1h66 s LYS 249 Cb 0.22 -3.34 0.16 0.00 -1.68 0.00 0.00 37.83 33.19 1h66 s LYS 249 CO 0.31 0.43 1.68 -0.22 -0.76 0.00 0.00 175.35 176.79 1h66 h LYS 250 N 5.97 0.97 -6.28 1.68 3.64 -1.91 -3.45 116.57 117.19 1h66 h LYS 250 Ca -0.46 -0.30 -0.60 0.00 -1.27 0.00 0.00 60.65 58.02 1h66 h LYS 250 Cb 1.19 -0.09 -0.09 0.00 -0.41 0.00 0.00 32.23 32.82 1h66 h LYS 250 CO 0.70 0.97 -0.62 -0.06 -2.27 0.00 0.00 179.45 178.16 1h66 s PHE 251 N -4.99 2.99 0.87 1.91 0.08 -1.26 -4.13 117.98 113.45 1h66 s PHE 251 Ca -0.11 -0.07 -0.12 0.00 0.12 0.00 0.00 56.93 56.75 1h66 s PHE 251 Cb 0.14 -1.45 0.11 0.00 -0.57 0.00 0.00 43.02 41.25 1h66 s PHE 251 CO 0.84 0.52 1.15 0.20 -0.10 0.00 0.00 175.22 177.82 1h66 s GLY 252 N -2.93 1.58 0.12 4.36 0.00 0.11 -4.92 107.32 105.64 1h66 s GLY 252 Ca 0.29 -0.54 -0.12 0.00 0.00 0.00 0.00 44.72 44.35 1h66 s GLY 252 CO 0.21 -0.01 1.38 1.41 0.00 0.00 0.00 173.10 176.09 1h66 h LEU 253 N -1.33 0.97 0.00 0.66 3.38 -1.22 -3.38 115.31 114.40 1h66 h LEU 253 Ca -0.49 -0.55 0.00 0.00 0.09 0.00 0.00 57.88 56.93 1h66 h LEU 253 Cb 1.33 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 41.80 1h66 h LEU 253 CO 0.63 1.34 0.00 -1.54 0.09 0.00 0.00 178.44 178.96 1h66 n SER 254 N -4.01 0.00 0.06 -0.43 3.41 -1.11 -4.76 113.62 106.78 1h66 n SER 254 Ca -0.05 -0.90 -0.13 0.00 -0.26 0.00 0.00 58.87 57.53 1h66 n SER 254 Cb 0.65 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.52 1h66 n SER 254 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 1h66 h VAL 255 N 0.90 1.03 -0.02 -3.33 2.07 -1.93 -2.05 116.25 112.92 1h66 h VAL 255 Ca 0.00 -0.37 -0.14 0.00 0.82 0.00 0.00 66.70 67.01 1h66 h VAL 255 Cb 0.00 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.02 1h66 h VAL 255 CO 0.00 0.09 -0.63 1.23 0.02 0.00 0.00 177.57 178.28 1h66 h GLY 256 N -0.28 0.08 -5.32 2.17 0.00 -1.97 -3.25 103.07 94.52 1h66 h GLY 256 Ca -0.01 -0.11 -0.70 0.00 0.00 0.00 0.00 47.33 46.51 1h66 h GLY 256 CO 0.02 0.10 0.27 1.42 0.00 0.00 0.00 176.54 178.34 1h66 n HIS 257 N -3.81 3.27 0.53 5.60 -0.00 -1.16 -4.68 115.22 114.96 1h66 n HIS 257 Ca -0.02 -2.96 0.13 0.00 -0.00 0.00 0.00 57.72 54.87 1h66 n HIS 257 Cb 0.63 -0.79 0.44 0.00 -0.00 0.00 0.00 29.99 30.27 1h66 n HIS 257 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 1h66 n HIS 258 N -0.32 0.91 -1.12 4.41 1.44 -0.78 -0.74 115.22 119.02 1h66 n HIS 258 Ca 0.43 0.30 -0.08 0.00 -2.01 0.00 0.00 57.72 56.36 1h66 n HIS 258 Cb 0.37 -0.99 -0.04 0.00 0.12 0.00 0.00 29.99 29.46 1h66 n HIS 258 CO 0.00 0.00 0.00 1.28 -2.81 0.00 0.00 176.34 174.81 1h66 n LEU 259 N -2.27 -0.47 0.00 2.39 4.77 -1.26 -0.04 117.00 120.11 1h66 n LEU 259 Ca 0.04 0.20 0.00 0.00 -0.03 0.00 0.00 56.01 56.22 1h66 n LEU 259 Cb 0.35 -1.69 0.00 0.00 -2.33 0.00 0.00 43.42 39.75 1h66 n LEU 259 CO 0.26 -0.56 0.00 0.61 -1.33 0.00 0.00 177.39 176.37 1h66 n GLY 260 N -0.02 0.75 0.00 -0.72 0.00 -1.26 -5.04 105.19 98.89 1h66 n GLY 260 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1h66 n GLY 260 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1h66 n LYS 261 N -2.16 1.77 -2.40 1.61 5.02 0.94 -5.09 118.16 117.86 1h66 n LYS 261 Ca 0.00 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.88 1h66 n LYS 261 Cb 0.00 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 34.98 1h66 n LYS 261 CO 0.00 0.00 0.00 -1.12 -0.52 0.00 0.00 177.40 175.76 1h66 s SER 262 N -0.86 7.11 -0.02 4.39 0.01 -1.26 -4.70 113.70 118.38 1h66 s SER 262 Ca 0.00 2.20 -0.30 0.00 1.31 0.00 0.00 55.95 59.16 1h66 s SER 262 Cb 0.00 -2.60 -0.03 0.00 0.21 0.00 0.00 66.02 63.60 1h66 s SER 262 CO 0.00 -0.36 1.03 -0.63 0.41 0.00 0.00 173.24 173.69 1h66 s ILE 263 N -0.01 4.70 0.29 1.44 1.01 -1.26 -0.72 121.20 126.66 1h66 s ILE 263 Ca 0.53 1.95 -0.30 0.00 0.00 0.00 0.00 60.65 62.83 1h66 s ILE 263 Cb -0.32 -4.25 -0.12 0.00 0.01 0.00 0.00 42.46 37.78 1h66 s ILE 263 CO 0.36 0.11 1.49 -0.81 0.00 0.00 0.00 174.94 176.09 1h66 n PRO 264 N 4.22 2.41 -1.61 2.79 -0.04 -1.26 -4.83 135.00 136.68 1h66 n PRO 264 Ca 0.07 0.85 -0.47 0.00 -0.04 0.00 0.00 63.50 63.91 1h66 n PRO 264 Cb 0.50 -2.57 -0.03 0.00 -0.04 0.00 0.00 33.50 31.36 1h66 n PRO 264 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1h66 n THR 265 N 1.69 0.97 -4.28 0.52 -1.04 -1.26 -2.42 114.28 108.45 1h66 n THR 265 Ca 0.08 -0.24 -0.34 0.00 -2.04 0.00 0.00 64.05 61.52 1h66 n THR 265 Cb 0.35 -1.07 -0.07 0.00 -1.82 0.00 0.00 70.33 67.73 1h66 n THR 265 CO 0.00 0.00 0.00 0.47 -0.64 0.00 0.00 175.07 174.90 1h66 n ASP 266 N 2.02 -0.70 -0.06 8.00 8.00 -1.26 -4.82 116.55 127.72 1h66 n ASP 266 Ca 0.14 -1.17 0.08 0.00 0.71 0.00 0.00 54.79 54.55 1h66 n ASP 266 Cb 0.27 -2.09 0.46 0.00 -0.02 0.00 0.00 41.12 39.74 1h66 n ASP 266 CO 0.00 0.00 0.00 -1.13 -0.39 0.00 0.00 177.20 175.68 1h66 h ASN 267 N -1.53 0.44 -0.26 -2.24 -1.24 -1.72 0.41 115.58 109.44 1h66 h ASN 267 Ca -0.63 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.38 1h66 h ASN 267 Cb 1.39 -0.09 0.00 0.00 0.73 0.00 0.00 38.32 40.35 1h66 h ASN 267 CO 0.75 0.29 0.00 0.00 -1.29 0.00 0.00 177.43 177.18 1h66 n GLN 268 N -4.47 2.10 -0.03 6.67 1.13 -1.26 -4.34 117.38 117.18 1h66 n GLN 268 Ca 0.07 -1.96 -0.04 0.00 -1.94 0.00 0.00 57.00 53.13 1h66 n GLN 268 Cb 0.24 -1.40 -0.03 0.00 0.11 0.00 0.00 30.24 29.15 1h66 n GLN 268 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1h66 n ILE 269 N 1.13 0.36 -5.11 5.09 5.41 -0.86 -4.57 119.36 120.81 1h66 n ILE 269 Ca 0.15 -0.17 -0.30 0.00 1.00 0.00 0.00 62.75 63.43 1h66 n ILE 269 Cb 0.50 -0.78 -0.15 0.00 -0.71 0.00 0.00 39.64 38.50 1h66 n ILE 269 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 176.55 176.01 1h66 s LYS 270 N -2.13 1.89 0.78 0.38 -0.14 0.08 -4.27 119.74 116.33 1h66 s LYS 270 Ca -0.06 -0.93 -0.10 0.00 -1.36 0.00 0.00 55.97 53.51 1h66 s LYS 270 Cb 0.02 -1.90 0.09 0.00 -1.68 0.00 0.00 37.83 34.36 1h66 s LYS 270 CO 0.17 0.51 1.12 0.00 -0.76 0.00 0.00 175.35 176.39 1h66 s ALA 271 N -0.64 2.85 0.00 5.17 0.00 -1.26 -4.57 121.76 123.30 1h66 s ALA 271 Ca 0.10 -0.85 0.00 0.00 0.00 0.00 0.00 51.96 51.21 1h66 s ALA 271 Cb -0.09 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.26 1h66 s ALA 271 CO -0.00 -1.60 0.00 0.54 0.00 0.00 0.00 175.76 174.70 1h66 n ARG 272 N -3.19 0.00 0.00 0.00 1.74 -1.26 -5.00 116.66 108.95 1h66 n ARG 272 Ca 0.09 0.19 0.00 0.00 -0.77 0.00 0.00 57.85 57.36 1h66 n ARG 272 Cb 0.61 -0.38 0.00 0.00 -1.02 0.00 0.00 32.46 31.67 1h66 n ARG 272 CO 0.00 0.00 0.00 1.63 -1.52 0.00 0.00 177.63 177.74