#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jhd s ILE 2 N 0.00 2.45 0.78 3.17 2.07 -1.26 -4.96 121.20 123.45 1jhd s ILE 2 Ca 0.00 0.43 -0.11 0.00 -1.41 0.00 0.00 60.65 59.56 1jhd s ILE 2 Cb 0.00 -3.26 0.06 0.00 0.13 0.00 0.00 42.46 39.39 1jhd s ILE 2 CO 0.00 0.08 1.08 -1.59 -1.91 0.00 0.00 174.94 172.61 1jhd s LYS 3 N -2.10 2.20 0.95 3.50 -2.85 -1.26 -4.85 119.74 115.32 1jhd s LYS 3 Ca 0.54 1.00 -0.12 0.00 -1.00 0.00 0.00 55.97 56.39 1jhd s LYS 3 Cb -0.41 -1.90 0.16 0.00 -2.06 0.00 0.00 37.83 33.62 1jhd s LYS 3 CO 0.54 -1.63 1.10 -2.14 0.10 0.00 0.00 175.35 173.32 1jhd s PRO 4 N -4.97 0.83 -0.15 1.78 0.02 -1.25 -4.77 135.00 126.49 1jhd s PRO 4 Ca 0.61 0.52 -0.28 0.00 0.02 0.00 0.00 61.00 61.87 1jhd s PRO 4 Cb -0.16 -1.78 -0.01 0.00 0.02 0.00 0.00 34.50 32.56 1jhd s PRO 4 CO 0.56 -2.46 0.93 0.08 -0.33 0.00 0.00 177.00 175.78 1jhd s VAL 5 N -3.05 4.81 0.00 3.83 1.01 -1.26 -3.94 120.40 121.80 1jhd s VAL 5 Ca 0.64 1.86 0.00 0.00 0.00 0.00 0.00 61.98 64.48 1jhd s VAL 5 Cb -0.17 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 31.97 1jhd s VAL 5 CO 0.56 -0.02 0.00 0.61 0.00 0.00 0.00 175.10 176.26 1jhd n GLY 6 N 3.29 0.85 3.84 4.51 0.00 -1.26 -4.09 105.19 112.33 1jhd n GLY 6 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 1jhd n GLY 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jhd s SER 7 N -2.71 -0.20 0.05 1.61 1.04 -1.25 -4.89 113.70 107.34 1jhd s SER 7 Ca 0.00 -0.72 0.15 0.00 0.48 0.00 0.00 55.95 55.86 1jhd s SER 7 Cb 0.00 0.75 -0.15 0.00 0.10 0.00 0.00 66.02 66.71 1jhd s SER 7 CO 0.00 -1.41 0.84 0.44 0.98 0.00 0.00 173.24 174.10 1jhd h ASP 8 N 2.01 0.00 -4.37 7.02 3.32 -1.94 -3.31 116.42 119.16 1jhd h ASP 8 Ca -0.22 0.00 -0.47 0.00 0.02 0.00 0.00 57.03 56.37 1jhd h ASP 8 Cb 1.25 0.00 -0.22 0.00 0.22 0.00 0.00 39.33 40.58 1jhd h ASP 8 CO 0.27 0.72 -0.80 -1.61 -1.72 0.00 0.00 179.24 176.10 1jhd s GLU 9 N -2.82 0.94 0.60 3.56 2.02 -1.26 -4.47 118.70 117.27 1jhd s GLU 9 Ca -0.03 -1.02 -0.18 0.00 0.02 0.00 0.00 54.97 53.77 1jhd s GLU 9 Cb 0.08 -1.04 -0.03 0.00 0.10 0.00 0.00 34.13 33.24 1jhd s GLU 9 CO 0.81 0.24 1.16 -0.51 0.02 0.00 0.00 175.26 176.98 1jhd s LEU 10 N -1.76 3.61 -0.56 1.80 1.43 -1.26 -4.94 118.68 117.00 1jhd s LEU 10 Ca 0.01 2.24 0.06 0.00 -1.03 0.00 0.00 54.13 55.41 1jhd s LEU 10 Cb -0.10 -4.58 0.30 0.00 0.03 0.00 0.00 46.19 41.84 1jhd s LEU 10 CO 0.03 -1.53 0.83 0.29 0.23 0.00 0.00 176.35 176.19 1jhd n LYS 11 N -1.75 2.57 -1.90 1.70 5.02 -1.26 -5.09 118.16 117.44 1jhd n LYS 11 Ca 0.12 -4.52 -0.35 0.00 -2.02 0.00 0.00 58.31 51.54 1jhd n LYS 11 Cb 0.51 -2.11 0.04 0.00 -0.02 0.00 0.00 35.03 33.45 1jhd n LYS 11 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1jhd s PRO 12 N -2.86 2.84 0.00 1.97 0.04 -1.26 -4.84 135.00 130.89 1jhd s PRO 12 Ca 0.44 1.74 0.24 0.00 0.04 0.00 0.00 61.00 63.46 1jhd s PRO 12 Cb 0.24 -1.92 0.33 0.00 0.04 0.00 0.00 34.50 33.19 1jhd s PRO 12 CO -0.09 -1.29 1.30 1.28 0.04 0.00 0.00 177.00 178.25 1jhd n LEU 13 N -1.87 1.63 -4.78 -3.56 4.77 -0.77 -4.93 117.00 107.51 1jhd n LEU 13 Ca 0.13 -0.56 -0.41 0.00 -0.03 0.00 0.00 56.01 55.15 1jhd n LEU 13 Cb 0.50 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 1jhd n LEU 13 CO 0.45 0.30 1.11 0.12 -1.33 0.00 0.00 177.39 178.05 1jhd s PHE 14 N -2.47 2.57 -1.00 -1.77 5.36 -0.73 -1.02 117.98 118.93 1jhd s PHE 14 Ca 0.22 1.20 -0.20 0.00 -0.96 0.00 0.00 56.93 57.18 1jhd s PHE 14 Cb 0.19 -3.98 0.09 0.00 -0.34 0.00 0.00 43.02 38.98 1jhd s PHE 14 CO 0.54 -2.93 1.32 0.08 -1.46 0.00 0.00 175.22 172.77 1jhd s VAL 15 N -1.14 4.34 0.30 3.12 1.01 -0.88 -4.84 120.40 122.30 1jhd s VAL 15 Ca 0.55 -1.27 0.21 0.00 0.00 0.00 0.00 61.98 61.47 1jhd s VAL 15 Cb -0.45 -4.94 0.19 0.00 0.00 0.00 0.00 36.38 31.18 1jhd s VAL 15 CO 0.61 -1.74 1.89 1.88 0.00 0.00 0.00 175.10 177.74 1jhd h TYR 16 N 9.14 0.00 -3.09 5.22 -1.99 -1.91 -3.42 116.97 120.92 1jhd h TYR 16 Ca 0.20 0.00 -0.57 0.00 2.00 0.00 0.00 58.73 60.36 1jhd h TYR 16 Cb 1.00 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 39.68 1jhd h TYR 16 CO 1.23 0.26 0.90 0.34 -0.00 0.00 0.00 178.16 180.89 1jhd s ASP 17 N -6.42 6.87 0.27 3.88 2.15 -1.26 -4.89 116.67 117.26 1jhd s ASP 17 Ca -0.02 1.36 -0.01 0.00 0.43 0.00 0.00 52.55 54.32 1jhd s ASP 17 Cb 0.12 -2.54 0.46 0.00 -0.30 0.00 0.00 42.92 40.66 1jhd s ASP 17 CO 0.65 -0.88 1.86 -0.65 -0.17 0.00 0.00 175.17 175.98 1jhd h PRO 18 N 8.46 1.03 -0.27 4.34 0.11 -1.99 0.91 132.00 144.59 1jhd h PRO 18 Ca -0.24 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 65.79 1jhd h PRO 18 Cb 1.09 -0.23 -0.01 0.00 0.11 0.00 0.00 31.00 31.95 1jhd h PRO 18 CO 1.00 0.68 0.10 0.93 -0.21 0.00 0.00 178.00 180.50 1jhd h GLU 19 N 1.06 0.41 -0.24 1.05 4.39 -1.95 -0.01 114.58 119.29 1jhd h GLU 19 Ca 0.45 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.97 1jhd h GLU 19 Cb 0.31 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1jhd h GLU 19 CO -0.22 0.46 -0.29 1.49 -1.16 0.00 0.00 179.01 179.30 1jhd h GLU 20 N 0.28 0.48 -0.24 2.33 4.57 -1.84 -1.72 114.58 118.44 1jhd h GLU 20 Ca 0.09 -0.20 -0.00 0.00 -1.18 0.00 0.00 59.36 58.07 1jhd h GLU 20 Cb 0.21 -0.02 -0.01 0.00 -0.16 0.00 0.00 28.75 28.77 1jhd h GLU 20 CO -0.00 0.73 0.14 1.25 -1.18 0.00 0.00 179.01 179.95 1jhd h HIS 21 N 0.42 0.32 -0.61 0.92 2.76 -0.50 -0.70 115.15 117.75 1jhd h HIS 21 Ca 0.06 -0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.19 1jhd h HIS 21 Cb 0.72 -0.10 -0.03 0.00 1.55 0.00 0.00 27.41 29.55 1jhd h HIS 21 CO 0.02 0.24 0.25 0.45 -1.30 0.00 0.00 177.93 177.60 1jhd h HIS 22 N 0.30 0.93 -0.15 5.26 3.86 -0.83 0.13 115.15 124.65 1jhd h HIS 22 Ca 0.09 -0.07 0.03 0.00 -1.16 0.00 0.00 60.37 59.26 1jhd h HIS 22 Cb 0.02 -0.28 -0.03 0.00 1.06 0.00 0.00 27.41 28.18 1jhd h HIS 22 CO -0.05 0.73 -0.05 -0.22 0.86 0.00 0.00 177.93 179.20 1jhd h LYS 23 N 0.85 -0.03 -0.60 2.45 3.64 -1.08 -0.29 116.57 121.51 1jhd h LYS 23 Ca 0.21 0.00 -0.09 0.00 -1.27 0.00 0.00 60.65 59.50 1jhd h LYS 23 Cb 0.19 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 31.99 1jhd h LYS 23 CO -0.02 -0.02 0.02 -0.07 -2.27 0.00 0.00 179.45 177.10 1jhd h LEU 24 N -0.03 1.02 -0.88 5.20 3.38 -0.80 -0.47 115.31 122.73 1jhd h LEU 24 Ca 0.08 -0.30 0.01 0.00 0.09 0.00 0.00 57.88 57.76 1jhd h LEU 24 Cb 0.14 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 1jhd h LEU 24 CO -0.17 1.07 0.58 0.28 0.09 0.00 0.00 178.44 180.29 1jhd h SER 25 N 0.95 1.00 -0.14 -0.43 0.02 -0.76 0.25 113.55 114.44 1jhd h SER 25 Ca 0.17 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 61.07 1jhd h SER 25 Cb 0.53 -0.25 -0.00 0.00 0.14 0.00 0.00 62.40 62.82 1jhd h SER 25 CO 0.03 0.72 -0.01 -0.74 -1.14 0.00 0.00 176.83 175.69 1jhd h HIS 26 N 1.18 0.28 -0.67 3.45 -0.00 -0.71 -2.98 115.15 115.71 1jhd h HIS 26 Ca 0.33 -0.05 0.01 0.00 -0.00 0.00 0.00 60.37 60.66 1jhd h HIS 26 Cb -0.12 -0.07 -0.04 0.00 -0.00 0.00 0.00 27.41 27.18 1jhd h HIS 26 CO -0.01 0.50 0.43 1.49 -0.00 0.00 0.00 177.93 180.34 1jhd h GLU 27 N -0.01 0.85 -0.99 5.26 4.81 -0.83 -2.90 114.58 120.76 1jhd h GLU 27 Ca 0.04 -0.05 0.17 0.00 -0.13 0.00 0.00 59.36 59.39 1jhd h GLU 27 Cb 0.39 -0.19 -0.10 0.00 0.63 0.00 0.00 28.75 29.48 1jhd h GLU 27 CO 0.01 0.56 0.62 0.00 -0.73 0.00 0.00 179.01 179.47 1jhd h ALA 28 N 1.26 1.69 0.00 2.92 0.00 -0.36 -0.57 119.26 124.19 1jhd h ALA 28 Ca 0.25 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1jhd h ALA 28 Cb -0.06 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.61 1jhd h ALA 28 CO -0.07 -0.02 0.00 0.39 0.00 0.00 0.00 179.25 179.55 1jhd n GLU 29 N -4.70 0.18 0.00 0.00 -0.58 -1.09 -1.91 120.64 112.53 1jhd n GLU 29 Ca 0.22 0.53 0.10 0.00 -0.42 0.00 0.00 57.16 57.58 1jhd n GLU 29 Cb 0.52 -1.92 0.02 0.00 -0.57 0.00 0.00 31.44 29.50 1jhd n GLU 29 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 1jhd n SER 30 N -2.27 2.09 -4.88 1.62 7.64 -0.23 -5.01 113.62 112.57 1jhd n SER 30 Ca 0.00 -1.55 -0.30 0.00 1.01 0.00 0.00 58.87 58.04 1jhd n SER 30 Cb 0.14 0.32 -0.02 0.00 -1.01 0.00 0.00 64.21 63.64 1jhd n SER 30 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1jhd s LEU 31 N -2.05 3.75 0.58 -3.43 1.43 -0.80 -5.03 118.68 113.13 1jhd s LEU 31 Ca 0.18 1.11 -0.20 0.00 -1.03 0.00 0.00 54.13 54.19 1jhd s LEU 31 Cb 0.16 -4.02 -0.04 0.00 0.03 0.00 0.00 46.19 42.32 1jhd s LEU 31 CO 0.41 -0.47 1.25 -2.84 0.23 0.00 0.00 176.35 174.93 1jhd s PRO 32 N -4.12 3.00 0.16 1.29 0.02 -1.26 -4.66 135.00 129.42 1jhd s PRO 32 Ca 0.51 1.95 -0.03 0.00 0.02 0.00 0.00 61.00 63.45 1jhd s PRO 32 Cb -0.10 -2.02 -0.03 0.00 0.02 0.00 0.00 34.50 32.36 1jhd s PRO 32 CO 0.36 -1.22 0.12 -1.54 -0.33 0.00 0.00 177.00 174.39 1jhd s SER 33 N -1.41 0.22 -0.08 2.53 1.04 -1.26 -1.16 113.70 113.57 1jhd s SER 33 Ca 0.76 -1.19 -0.15 0.00 0.48 0.00 0.00 55.95 55.85 1jhd s SER 33 Cb -0.34 0.35 0.03 0.00 0.10 0.00 0.00 66.02 66.16 1jhd s SER 33 CO 0.37 -0.79 0.36 0.54 0.98 0.00 0.00 173.24 174.70 1jhd s VAL 34 N -4.06 0.02 -0.28 5.02 0.11 -0.89 -4.61 120.40 115.72 1jhd s VAL 34 Ca 0.27 -0.20 -0.23 0.00 -2.93 0.00 0.00 61.98 58.88 1jhd s VAL 34 Cb 0.06 -0.59 -0.01 0.00 -1.53 0.00 0.00 36.38 34.32 1jhd s VAL 34 CO 0.04 -0.11 0.76 -0.69 -3.33 0.00 0.00 175.10 171.77 1jhd s VAL 35 N -0.52 4.85 0.77 2.04 1.01 -1.26 -0.25 120.40 127.04 1jhd s VAL 35 Ca -0.06 1.28 -0.06 0.00 0.00 0.00 0.00 61.98 63.13 1jhd s VAL 35 Cb -0.04 -4.09 0.12 0.00 0.00 0.00 0.00 36.38 32.38 1jhd s VAL 35 CO 0.03 -0.14 1.07 0.27 0.00 0.00 0.00 175.10 176.33 1jhd s ILE 36 N 2.82 2.17 0.76 2.22 -4.36 -0.85 -4.93 121.20 119.03 1jhd s ILE 36 Ca 0.32 -0.35 -0.11 0.00 -0.26 0.00 0.00 60.65 60.25 1jhd s ILE 36 Cb -0.15 -2.82 0.04 0.00 1.25 0.00 0.00 42.46 40.79 1jhd s ILE 36 CO 0.10 0.00 1.08 -0.94 0.24 0.00 0.00 174.94 175.42 1jhd s SER 37 N -4.70 4.79 0.29 4.36 1.04 -1.26 -4.18 113.70 114.04 1jhd s SER 37 Ca 0.66 1.59 -0.00 0.00 0.48 0.00 0.00 55.95 58.68 1jhd s SER 37 Cb -0.07 -2.37 0.45 0.00 0.10 0.00 0.00 66.02 64.13 1jhd s SER 37 CO 0.46 -1.82 1.86 -1.28 0.98 0.00 0.00 173.24 173.44 1jhd h SER 38 N -0.98 0.75 -0.03 7.02 0.87 -1.97 -0.36 113.55 118.85 1jhd h SER 38 Ca -0.45 -0.11 0.00 0.00 -1.23 0.00 0.00 61.79 60.00 1jhd h SER 38 Cb 1.23 -0.19 -0.00 0.00 -0.44 0.00 0.00 62.40 63.00 1jhd h SER 38 CO 0.56 0.71 0.02 -0.61 -0.53 0.00 0.00 176.83 176.98 1jhd h GLN 39 N 0.80 0.04 -0.74 2.24 4.15 -1.97 -1.12 115.11 118.50 1jhd h GLN 39 Ca 0.18 -0.00 -0.02 0.00 0.77 0.00 0.00 58.65 59.58 1jhd h GLN 39 Cb 0.23 -0.01 -0.04 0.00 0.21 0.00 0.00 27.48 27.87 1jhd h GLN 39 CO -0.01 0.04 0.40 0.00 -1.93 0.00 0.00 178.83 177.33 1jhd h ALA 40 N 1.00 1.30 -0.42 3.38 0.00 -1.67 -0.08 119.26 122.78 1jhd h ALA 40 Ca 0.01 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.79 1jhd h ALA 40 Cb 0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 1jhd h ALA 40 CO -0.00 0.56 0.19 0.00 0.00 0.00 0.00 179.25 180.00 1jhd h ALA 41 N 1.40 0.54 -0.62 0.00 0.00 -0.76 -0.23 119.26 119.59 1jhd h ALA 41 Ca 0.26 -0.12 -0.08 0.00 0.00 0.00 0.00 54.91 54.98 1jhd h ALA 41 Cb 0.04 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.64 1jhd h ALA 41 CO -0.04 0.11 0.09 0.78 0.00 0.00 0.00 179.25 180.19 1jhd h GLY 42 N 0.53 1.10 1.00 0.00 0.00 -0.88 -0.67 103.07 104.16 1jhd h GLY 42 Ca 0.14 -0.73 0.00 0.00 0.00 0.00 0.00 47.33 46.75 1jhd h GLY 42 CO -0.02 0.67 0.35 3.43 0.00 0.00 0.00 176.54 180.98 1jhd h ASN 43 N 0.96 0.63 -0.64 0.19 2.35 -0.69 -0.75 115.58 117.64 1jhd h ASN 43 Ca 0.19 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.88 1jhd h ASN 43 Cb 0.43 -0.16 -0.03 0.00 0.05 0.00 0.00 38.32 38.61 1jhd h ASN 43 CO 0.01 0.48 0.27 0.00 -1.65 0.00 0.00 177.43 176.54 1jhd h ALA 44 N 1.19 0.84 -0.60 -0.83 0.00 -0.54 -0.36 119.26 118.95 1jhd h ALA 44 Ca 0.20 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 1jhd h ALA 44 Cb -0.06 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.45 1jhd h ALA 44 CO -0.04 0.44 0.30 0.28 0.00 0.00 0.00 179.25 180.23 1jhd h VAL 45 N 0.90 1.21 -0.71 0.00 2.07 -0.84 0.49 116.25 119.37 1jhd h VAL 45 Ca 0.22 -0.57 -0.04 0.00 0.82 0.00 0.00 66.70 67.12 1jhd h VAL 45 Cb 0.18 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 1jhd h VAL 45 CO -0.02 0.24 0.28 0.24 0.02 0.00 0.00 177.57 178.33 1jhd h MET 46 N 0.82 1.05 -0.27 1.57 2.07 -0.85 0.96 114.93 120.27 1jhd h MET 46 Ca 0.21 -0.18 -0.19 0.00 -2.07 0.00 0.00 59.70 57.47 1jhd h MET 46 Cb 0.10 -0.18 0.00 0.00 -1.87 0.00 0.00 31.60 29.66 1jhd h MET 46 CO -0.03 0.86 -0.56 0.52 1.07 0.00 0.00 176.91 178.76 1jhd h MET 47 N 1.03 0.84 -0.48 1.72 2.86 -0.71 -1.14 114.93 119.05 1jhd h MET 47 Ca 0.24 -0.54 -0.03 0.00 -2.06 0.00 0.00 59.70 57.31 1jhd h MET 47 Cb 0.20 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 31.90 1jhd h MET 47 CO -0.02 1.17 0.17 0.78 1.06 0.00 0.00 176.91 180.07 1jhd h GLY 48 N 0.73 0.74 0.37 8.32 0.00 0.51 -1.94 103.07 111.79 1jhd h GLY 48 Ca 0.01 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.97 1jhd h GLY 48 CO 0.12 0.35 -0.03 0.00 0.00 0.00 0.00 176.54 176.99 1jhd n ALA 49 N -2.46 2.67 -0.11 3.60 0.00 0.28 -1.77 120.51 122.72 1jhd n ALA 49 Ca 0.04 -0.32 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1jhd n ALA 49 Cb 0.17 -1.33 0.00 0.00 0.00 0.00 0.00 19.45 18.29 1jhd n ALA 49 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jhd n GLY 50 N 1.14 1.17 0.26 0.00 0.00 -0.97 -1.28 105.19 105.51 1jhd n GLY 50 Ca 0.20 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.21 1jhd n GLY 50 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 1jhd h TYR 51 N 0.00 0.52 -0.83 1.61 0.05 -1.47 -2.62 116.97 114.23 1jhd h TYR 51 Ca 0.00 -0.07 -0.31 0.00 0.05 0.00 0.00 58.73 58.40 1jhd h TYR 51 Cb 0.00 -0.14 -0.19 0.00 1.01 0.00 0.00 36.73 37.41 1jhd h TYR 51 CO 0.00 0.57 0.40 1.19 -1.05 0.00 0.00 178.16 179.27 1jhd n PHE 52 N -4.23 2.67 -1.72 4.88 3.72 -1.09 -4.32 117.46 117.37 1jhd n PHE 52 Ca 0.01 -1.40 -0.40 0.00 -0.05 0.00 0.00 57.45 55.60 1jhd n PHE 52 Cb 0.30 -0.78 0.02 0.00 -0.94 0.00 0.00 39.48 38.08 1jhd n PHE 52 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1jhd n SER 53 N -0.45 2.69 -2.01 4.37 2.88 -0.99 -1.39 113.62 118.72 1jhd n SER 53 Ca 0.47 1.08 -0.08 0.00 -1.33 0.00 0.00 58.87 59.01 1jhd n SER 53 Cb 1.48 -1.53 0.29 0.00 -0.75 0.00 0.00 64.21 63.70 1jhd n SER 53 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1jhd n PRO 54 N -0.17 3.48 -1.72 -1.46 -0.04 -1.26 -4.61 135.00 129.21 1jhd n PRO 54 Ca 0.07 -3.09 -0.42 0.00 -0.04 0.00 0.00 63.50 60.02 1jhd n PRO 54 Cb 0.41 -2.20 -0.01 0.00 -0.04 0.00 0.00 33.50 31.66 1jhd n PRO 54 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1jhd n LEU 55 N -0.32 3.90 -0.80 1.53 4.77 -0.49 -4.89 117.00 120.70 1jhd n LEU 55 Ca 0.43 1.19 0.11 0.00 -0.03 0.00 0.00 56.01 57.71 1jhd n LEU 55 Cb 1.42 -1.53 0.07 0.00 -2.33 0.00 0.00 43.42 41.06 1jhd n LEU 55 CO 0.45 -0.20 0.54 0.00 -1.33 0.00 0.00 177.39 176.85 1jhd n GLN 56 N 1.19 1.91 -3.82 3.23 1.13 -1.26 -4.90 117.38 114.86 1jhd n GLN 56 Ca 0.06 -1.64 0.00 0.00 -1.94 0.00 0.00 57.00 53.48 1jhd n GLN 56 Cb 0.36 -1.42 0.00 0.00 0.11 0.00 0.00 30.24 29.29 1jhd n GLN 56 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1jhd n GLY 57 N 1.26 -0.69 3.75 1.08 0.00 -1.26 -2.11 105.19 107.21 1jhd n GLY 57 Ca 0.12 -1.05 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 1jhd n GLY 57 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1jhd s PHE 58 N -3.00 3.62 0.50 1.61 0.08 -0.50 -4.89 117.98 115.41 1jhd s PHE 58 Ca 0.00 1.66 -0.20 0.00 0.12 0.00 0.00 56.93 58.51 1jhd s PHE 58 Cb 0.00 -3.26 -0.08 0.00 -0.57 0.00 0.00 43.02 39.12 1jhd s PHE 58 CO 0.00 -0.51 1.06 -1.64 -0.10 0.00 0.00 175.22 174.03 1jhd s MET 59 N -0.80 3.68 0.80 0.44 -1.94 0.04 -1.93 119.30 119.59 1jhd s MET 59 Ca 0.47 1.41 -0.09 0.00 -1.71 0.00 0.00 55.69 55.78 1jhd s MET 59 Cb -0.30 -2.07 0.12 0.00 2.01 0.00 0.00 34.83 34.59 1jhd s MET 59 CO 0.37 -0.54 1.13 0.54 -0.01 0.00 0.00 175.02 176.50 1jhd s ASN 60 N -1.96 4.14 0.27 3.03 2.20 -1.26 -4.52 114.94 116.84 1jhd s ASN 60 Ca 0.68 0.25 -0.04 0.00 -0.94 0.00 0.00 52.86 52.81 1jhd s ASN 60 Cb -0.18 -0.63 0.34 0.00 -2.00 0.00 0.00 41.25 38.77 1jhd s ASN 60 CO 0.22 -2.05 1.93 0.58 -2.94 0.00 0.00 177.10 174.84 1jhd h VAL 61 N -0.97 1.24 -0.31 3.54 2.07 -1.97 -1.74 116.25 118.11 1jhd h VAL 61 Ca -0.43 -0.48 0.02 0.00 0.82 0.00 0.00 66.70 66.63 1jhd h VAL 61 Cb 1.28 -0.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1jhd h VAL 61 CO 0.49 0.24 0.16 0.00 0.02 0.00 0.00 177.57 178.49 1jhd h ALA 62 N 1.40 0.38 -0.65 1.67 0.00 -1.99 0.74 119.26 120.82 1jhd h ALA 62 Ca 0.32 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 55.16 1jhd h ALA 62 Cb -0.10 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.61 1jhd h ALA 62 CO -0.07 -0.21 0.10 -0.44 0.00 0.00 0.00 179.25 178.64 1jhd h ASP 63 N 0.34 1.03 -0.67 0.00 3.32 -1.89 -1.46 116.42 117.09 1jhd h ASP 63 Ca 0.13 -0.26 -0.06 0.00 0.02 0.00 0.00 57.03 56.85 1jhd h ASP 63 Cb 0.03 -0.27 -0.03 0.00 0.22 0.00 0.00 39.33 39.28 1jhd h ASP 63 CO -0.08 1.03 0.17 0.00 -1.72 0.00 0.00 179.24 178.65 1jhd h ALA 64 N 1.04 0.89 -0.50 3.45 0.00 -0.91 0.88 119.26 124.10 1jhd h ALA 64 Ca 0.20 -0.24 -0.06 0.00 0.00 0.00 0.00 54.91 54.81 1jhd h ALA 64 Cb 0.44 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1jhd h ALA 64 CO 0.01 0.60 0.07 0.52 0.00 0.00 0.00 179.25 180.45 1jhd h MET 65 N 1.00 0.80 -0.27 0.00 2.86 -0.77 -1.08 114.93 117.47 1jhd h MET 65 Ca 0.21 -0.18 -0.06 0.00 -2.06 0.00 0.00 59.70 57.61 1jhd h MET 65 Cb 0.35 -0.11 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 1jhd h MET 65 CO 0.00 0.76 -0.05 0.78 1.06 0.00 0.00 176.91 179.46 1jhd h GLY 66 N 0.96 0.55 0.81 8.32 0.00 -0.70 0.22 103.07 113.23 1jhd h GLY 66 Ca 0.16 -0.44 0.03 0.00 0.00 0.00 0.00 47.33 47.08 1jhd h GLY 66 CO 0.01 0.41 0.30 0.00 0.00 0.00 0.00 176.54 177.26 1jhd h ALA 67 N 0.78 0.69 0.04 3.60 0.00 -0.69 0.11 119.26 123.79 1jhd h ALA 67 Ca 0.07 0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1jhd h ALA 67 Cb 0.52 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1jhd h ALA 67 CO 0.02 -0.01 -0.02 0.00 0.00 0.00 0.00 179.25 179.25 1jhd h ALA 68 N 1.26 -0.05 -0.01 0.00 0.00 -0.95 -0.59 119.26 118.93 1jhd h ALA 68 Ca 0.23 -0.17 -0.22 0.00 0.00 0.00 0.00 54.91 54.75 1jhd h ALA 68 Cb 0.07 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1jhd h ALA 68 CO -0.12 -0.36 -0.92 0.93 0.00 0.00 0.00 179.25 178.78 1jhd h GLU 69 N -0.38 0.43 0.00 0.00 5.08 -0.52 -3.40 114.58 115.80 1jhd h GLU 69 Ca -0.00 -0.45 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1jhd h GLU 69 Cb 0.35 0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1jhd h GLU 69 CO 0.01 1.10 -0.12 1.63 -1.00 0.00 0.00 179.01 180.63 1jhd n LYS 70 N -3.77 0.38 -2.82 2.33 4.76 0.30 -4.97 118.16 114.36 1jhd n LYS 70 Ca -0.07 -0.81 -0.17 0.00 -2.87 0.00 0.00 58.31 54.40 1jhd n LYS 70 Cb 0.82 -0.60 -0.00 0.00 -1.84 0.00 0.00 35.03 33.41 1jhd n LYS 70 CO 0.00 0.00 0.00 -1.33 -1.37 0.00 0.00 177.40 174.70 1jhd n MET 71 N -0.11 -2.85 -3.99 1.97 2.81 -0.23 -4.86 117.12 109.86 1jhd n MET 71 Ca 0.01 0.55 -0.19 0.00 -1.81 0.00 0.00 57.70 56.25 1jhd n MET 71 Cb 0.53 -5.20 -0.16 0.00 -0.71 0.00 0.00 33.22 27.67 1jhd n MET 71 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 1jhd s THR 72 N -2.74 0.33 0.78 2.03 2.01 -0.72 -1.50 115.64 115.83 1jhd s THR 72 Ca 0.17 0.02 -0.09 0.00 0.31 0.00 0.00 61.69 62.10 1jhd s THR 72 Cb -0.09 -0.41 0.10 0.00 0.01 0.00 0.00 72.50 72.11 1jhd s THR 72 CO 0.21 0.19 1.11 -0.76 -0.69 0.00 0.00 174.62 174.68 1jhd s LEU 73 N 1.15 2.77 0.47 4.42 1.43 0.50 -3.27 118.68 126.15 1jhd s LEU 73 Ca -0.08 0.35 0.32 0.00 -1.03 0.00 0.00 54.13 53.69 1jhd s LEU 73 Cb -0.14 -2.80 1.70 0.00 0.03 0.00 0.00 46.19 44.99 1jhd s LEU 73 CO -0.02 -1.94 1.97 0.77 0.23 0.00 0.00 176.35 177.37 1jhd h SER 74 N -0.90 0.00 -0.41 2.29 4.64 -1.86 0.34 113.55 117.66 1jhd h SER 74 Ca -0.44 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.88 1jhd h SER 74 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1jhd h SER 74 CO 0.53 0.00 0.00 -0.90 -0.87 0.00 0.00 176.83 175.59 1jhd n ASP 75 N -2.62 3.01 0.00 4.97 5.75 -1.26 -4.93 116.55 121.47 1jhd n ASP 75 Ca -0.02 -1.94 0.00 0.00 -0.01 0.00 0.00 54.79 52.82 1jhd n ASP 75 Cb 0.06 -0.26 0.00 0.00 -1.03 0.00 0.00 41.12 39.89 1jhd n ASP 75 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1jhd n GLY 76 N 1.41 1.06 3.85 6.12 0.00 0.11 -5.05 105.19 112.69 1jhd n GLY 76 Ca 0.19 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1jhd n GLY 76 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jhd s SER 77 N -3.07 5.84 -0.07 1.61 1.04 -1.26 -4.69 113.70 113.11 1jhd s SER 77 Ca 0.00 1.51 -0.21 0.00 0.48 0.00 0.00 55.95 57.73 1jhd s SER 77 Cb 0.00 -2.48 -0.04 0.00 0.10 0.00 0.00 66.02 63.60 1jhd s SER 77 CO 0.00 -1.13 0.62 0.12 0.98 0.00 0.00 173.24 173.82 1jhd s PHE 78 N -3.11 3.58 -0.28 5.02 5.36 -1.26 -0.37 117.98 126.92 1jhd s PHE 78 Ca 0.56 1.14 -0.15 0.00 -0.96 0.00 0.00 56.93 57.53 1jhd s PHE 78 Cb -0.12 -2.69 0.09 0.00 -0.34 0.00 0.00 43.02 39.96 1jhd s PHE 78 CO 0.54 0.17 0.68 0.12 -1.46 0.00 0.00 175.22 175.27 1jhd s PHE 79 N 0.53 -1.14 -0.69 10.12 5.36 -0.56 -4.92 117.98 126.68 1jhd s PHE 79 Ca 0.33 2.19 0.26 0.00 -0.96 0.00 0.00 56.93 58.74 1jhd s PHE 79 Cb -0.17 0.68 0.70 0.00 -0.34 0.00 0.00 43.02 43.88 1jhd s PHE 79 CO 0.16 -0.56 1.69 -1.00 -1.46 0.00 0.00 175.22 174.04 1jhd h PRO 80 N 7.24 0.00 -4.10 10.12 0.13 -1.85 -3.35 132.00 140.20 1jhd h PRO 80 Ca -0.27 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.75 1jhd h PRO 80 Cb 1.20 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.18 1jhd h PRO 80 CO 0.15 0.00 -0.56 0.14 -0.23 0.00 0.00 178.00 177.49 1jhd s VAL 81 N -3.12 0.18 0.49 1.56 -7.23 -1.26 -4.62 120.40 106.40 1jhd s VAL 81 Ca 0.10 -1.60 -0.23 0.00 -1.81 0.00 0.00 61.98 58.44 1jhd s VAL 81 Cb 0.12 -1.52 -0.06 0.00 0.56 0.00 0.00 36.38 35.48 1jhd s VAL 81 CO 0.62 -0.82 1.27 -2.84 -0.31 0.00 0.00 175.10 173.02 1jhd s PRO 82 N -3.91 3.49 -0.45 4.82 0.02 -1.26 -4.84 135.00 132.87 1jhd s PRO 82 Ca 0.08 2.03 0.02 0.00 0.02 0.00 0.00 61.00 63.15 1jhd s PRO 82 Cb 0.07 -2.37 0.13 0.00 0.02 0.00 0.00 34.50 32.35 1jhd s PRO 82 CO -0.09 -0.84 0.23 0.08 -0.33 0.00 0.00 177.00 176.04 1jhd s VAL 83 N -1.40 1.72 0.27 3.83 1.01 -1.26 -5.11 120.40 119.45 1jhd s VAL 83 Ca 0.67 -2.67 0.09 0.00 0.00 0.00 0.00 61.98 60.06 1jhd s VAL 83 Cb -0.35 -2.21 -0.04 0.00 0.00 0.00 0.00 36.38 33.78 1jhd s VAL 83 CO 0.42 -0.84 0.07 -0.76 0.00 0.00 0.00 175.10 173.99 1jhd s LEU 84 N 0.29 3.39 -0.46 3.92 1.43 -1.26 -0.78 118.68 125.21 1jhd s LEU 84 Ca 0.17 -0.53 0.03 0.00 -1.03 0.00 0.00 54.13 52.76 1jhd s LEU 84 Cb -0.24 -1.91 0.13 0.00 0.03 0.00 0.00 46.19 44.20 1jhd s LEU 84 CO -0.02 -0.03 0.22 0.00 0.23 0.00 0.00 176.35 176.75 1jhd s LEU 86 N 0.18 4.36 0.20 0.00 1.43 -1.26 -1.42 118.68 122.16 1jhd s LEU 86 Ca 0.16 0.73 0.07 0.00 -1.03 0.00 0.00 54.13 54.05 1jhd s LEU 86 Cb -0.24 -2.46 -0.05 0.00 0.03 0.00 0.00 46.19 43.47 1jhd s LEU 86 CO -0.02 0.22 -0.12 -0.76 0.23 0.00 0.00 176.35 175.89 1jhd s LEU 87 N -0.32 2.53 0.13 1.79 1.43 0.52 -4.59 118.68 120.16 1jhd s LEU 87 Ca 0.20 -1.04 -0.10 0.00 -1.03 0.00 0.00 54.13 52.16 1jhd s LEU 87 Cb -0.15 -0.58 -0.08 0.00 0.03 0.00 0.00 46.19 45.42 1jhd s LEU 87 CO 0.09 -0.24 1.38 -0.33 0.23 0.00 0.00 176.35 177.48 1jhd h GLU 88 N 2.58 0.77 0.00 1.70 4.39 -1.86 -0.38 114.58 121.78 1jhd h GLU 88 Ca -0.38 -0.55 -0.01 0.00 0.34 0.00 0.00 59.36 58.76 1jhd h GLU 88 Cb 1.21 0.09 0.01 0.00 -0.10 0.00 0.00 28.75 29.96 1jhd h GLU 88 CO 0.63 1.17 0.32 0.27 -1.16 0.00 0.00 179.01 180.24 1jhd n ASN 89 N -3.96 -2.25 -1.01 1.42 6.94 -1.26 -4.64 115.26 110.51 1jhd n ASN 89 Ca -0.05 -2.52 -0.01 0.00 -0.02 0.00 0.00 54.58 51.98 1jhd n ASN 89 Cb 0.68 3.73 0.20 0.00 -2.36 0.00 0.00 39.78 42.04 1jhd n ASN 89 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1jhd n THR 90 N -0.56 2.45 -0.10 5.53 -2.24 -1.26 -4.73 114.28 113.38 1jhd n THR 90 Ca -0.08 -2.73 -0.06 0.00 -2.27 0.00 0.00 64.05 58.91 1jhd n THR 90 Cb 0.60 -0.30 0.01 0.00 -2.10 0.00 0.00 70.33 68.54 1jhd n THR 90 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 1jhd h ASP 91 N 1.03 -0.14 -0.27 3.42 3.32 -1.96 -1.04 116.42 120.78 1jhd h ASP 91 Ca 0.16 0.08 0.08 0.00 0.02 0.00 0.00 57.03 57.37 1jhd h ASP 91 Cb 1.52 0.14 -0.01 0.00 0.22 0.00 0.00 39.33 41.19 1jhd h ASP 91 CO 0.30 -0.03 0.28 0.00 -1.72 0.00 0.00 179.24 178.07 1jhd h ALA 92 N 1.30 1.96 -0.00 3.45 0.00 -1.89 -3.02 119.26 121.05 1jhd h ALA 92 Ca 0.16 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1jhd h ALA 92 Cb 0.22 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1jhd h ALA 92 CO -0.28 -0.42 -0.10 0.44 0.00 0.00 0.00 179.25 178.89 1jhd n ILE 93 N -3.84 0.00 0.00 0.00 -5.35 -0.86 -4.47 119.36 104.85 1jhd n ILE 93 Ca 0.04 -0.45 0.00 0.00 -0.27 0.00 0.00 62.75 62.07 1jhd n ILE 93 Cb 0.43 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 1jhd n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1jhd n GLY 94 N 0.92 3.15 0.97 3.28 0.00 -0.45 -1.42 105.19 111.64 1jhd n GLY 94 Ca 0.01 0.07 0.11 0.00 0.00 0.00 0.00 46.02 46.20 1jhd n GLY 94 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1jhd n ASP 95 N 3.94 2.86 -4.77 1.61 8.00 -1.26 -4.96 116.55 121.97 1jhd n ASP 95 Ca 0.00 -1.92 -0.40 0.00 0.71 0.00 0.00 54.79 53.17 1jhd n ASP 95 Cb 0.00 -0.25 -0.01 0.00 -0.02 0.00 0.00 41.12 40.84 1jhd n ASP 95 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1jhd s ALA 96 N -1.49 3.45 -1.04 2.24 0.00 -0.51 -4.92 121.76 119.49 1jhd s ALA 96 Ca 0.37 1.40 0.12 0.00 0.00 0.00 0.00 51.96 53.84 1jhd s ALA 96 Cb 0.20 -3.54 -0.02 0.00 0.00 0.00 0.00 23.12 19.77 1jhd s ALA 96 CO 0.28 -0.90 0.68 1.63 0.00 0.00 0.00 175.76 177.46 1jhd n LYS 97 N 0.42 2.08 -4.00 0.00 4.76 -1.26 -4.87 118.16 115.30 1jhd n LYS 97 Ca 0.02 -0.60 -0.31 0.00 -2.87 0.00 0.00 58.31 54.55 1jhd n LYS 97 Cb 0.41 -1.13 -0.16 0.00 -1.84 0.00 0.00 35.03 32.31 1jhd n LYS 97 CO 0.00 0.00 0.00 0.50 -1.37 0.00 0.00 177.40 176.53 1jhd s ARG 98 N -1.59 2.02 0.17 1.97 3.52 -1.26 0.77 118.95 124.57 1jhd s ARG 98 Ca 0.09 -0.93 0.01 0.00 -0.13 0.00 0.00 55.73 54.77 1jhd s ARG 98 Cb 0.10 -2.51 -0.05 0.00 -1.56 0.00 0.00 34.95 30.93 1jhd s ARG 98 CO 0.32 -0.47 0.02 0.96 -0.81 0.00 0.00 175.30 175.32 1jhd s ILE 99 N 1.35 0.57 -0.12 4.11 -4.36 -0.47 -4.46 121.20 117.83 1jhd s ILE 99 Ca -0.03 -1.97 -0.05 0.00 -0.26 0.00 0.00 60.65 58.34 1jhd s ILE 99 Cb -0.17 -2.15 -0.04 0.00 1.25 0.00 0.00 42.46 41.35 1jhd s ILE 99 CO -0.08 -0.43 0.08 0.00 0.24 0.00 0.00 174.94 174.76 1jhd s ALA 100 N -3.73 3.61 -0.25 2.27 0.00 -0.31 -0.64 121.76 122.72 1jhd s ALA 100 Ca 0.25 -0.71 -0.10 0.00 0.00 0.00 0.00 51.96 51.40 1jhd s ALA 100 Cb 0.06 -1.80 -0.05 0.00 0.00 0.00 0.00 23.12 21.34 1jhd s ALA 100 CO 0.04 0.54 0.16 -0.51 0.00 0.00 0.00 175.76 175.99 1jhd s LEU 101 N -0.77 4.04 0.05 0.00 1.43 0.16 -2.10 118.68 121.49 1jhd s LEU 101 Ca 0.13 0.07 -0.00 0.00 -1.03 0.00 0.00 54.13 53.29 1jhd s LEU 101 Cb -0.12 -2.09 -0.04 0.00 0.03 0.00 0.00 46.19 43.97 1jhd s LEU 101 CO 0.03 0.04 0.19 -0.13 0.23 0.00 0.00 176.35 176.71 1jhd s ARG 102 N 1.20 3.39 -0.26 1.70 0.52 0.65 -0.31 118.95 125.84 1jhd s ARG 102 Ca 0.07 -0.45 -0.27 0.00 -0.52 0.00 0.00 55.73 54.56 1jhd s ARG 102 Cb -0.14 -3.02 0.00 0.00 0.52 0.00 0.00 34.95 32.32 1jhd s ARG 102 CO 0.06 0.61 0.94 0.34 0.02 0.00 0.00 175.30 177.27 1jhd s ASP 103 N -2.43 6.93 0.16 0.23 -1.08 -0.02 -2.01 116.67 118.44 1jhd s ASP 103 Ca 0.34 1.12 0.23 0.00 -0.52 0.00 0.00 52.55 53.71 1jhd s ASP 103 Cb -0.13 -2.49 0.89 0.00 -1.46 0.00 0.00 42.92 39.73 1jhd s ASP 103 CO 0.26 -0.65 1.69 -0.81 0.52 0.00 0.00 175.17 176.19 1jhd n PRO 104 N 6.29 0.14 -0.23 4.34 -0.04 -1.26 -3.74 135.00 140.51 1jhd n PRO 104 Ca 0.09 0.30 0.10 0.00 -0.04 0.00 0.00 63.50 63.95 1jhd n PRO 104 Cb 0.47 -1.73 0.22 0.00 -0.04 0.00 0.00 33.50 32.42 1jhd n PRO 104 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1jhd n ASN 105 N -2.00 3.39 -4.02 3.54 5.03 -1.26 -4.86 115.26 115.09 1jhd n ASN 105 Ca 0.04 -1.95 -0.26 0.00 0.87 0.00 0.00 54.58 53.27 1jhd n ASN 105 Cb 0.27 -0.30 -0.17 0.00 -1.02 0.00 0.00 39.78 38.56 1jhd n ASN 105 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 1jhd s VAL 106 N -1.17 1.21 0.32 2.41 1.01 -1.24 -4.81 120.40 118.12 1jhd s VAL 106 Ca 0.37 -0.49 -0.29 0.00 0.00 0.00 0.00 61.98 61.56 1jhd s VAL 106 Cb 0.20 -1.12 -0.12 0.00 0.00 0.00 0.00 36.38 35.34 1jhd s VAL 106 CO 0.27 0.38 1.38 1.21 0.00 0.00 0.00 175.10 178.34 1jhd n GLU 107 N 4.04 2.26 0.00 2.72 2.13 -1.26 -0.65 120.64 129.88 1jhd n GLU 107 Ca -0.21 0.80 0.00 0.00 0.66 0.00 0.00 57.16 58.41 1jhd n GLU 107 Cb 0.51 -2.44 0.00 0.00 0.27 0.00 0.00 31.44 29.78 1jhd n GLU 107 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jhd n GLY 108 N 1.19 1.71 3.63 8.31 0.00 -1.26 -4.55 105.19 114.21 1jhd n GLY 108 Ca 0.06 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1jhd n GLY 108 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1jhd n ASN 109 N 0.00 -5.55 -4.68 1.61 3.02 0.18 -4.95 115.26 104.89 1jhd n ASN 109 Ca 0.00 -0.94 -0.30 0.00 -0.03 0.00 0.00 54.58 53.31 1jhd n ASN 109 Cb 0.00 -3.47 0.15 0.00 -0.61 0.00 0.00 39.78 35.85 1jhd n ASN 109 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1jhd s PRO 110 N -5.63 1.07 0.22 3.52 0.04 -1.26 -4.30 135.00 128.65 1jhd s PRO 110 Ca 0.41 1.18 -0.30 0.00 0.04 0.00 0.00 61.00 62.33 1jhd s PRO 110 Cb -0.14 -1.76 -0.09 0.00 0.04 0.00 0.00 34.50 32.55 1jhd s PRO 110 CO 0.85 -2.47 1.19 0.08 0.04 0.00 0.00 177.00 176.68 1jhd s VAL 111 N -2.75 3.48 -0.13 -0.36 1.01 -1.26 -0.84 120.40 119.54 1jhd s VAL 111 Ca 0.65 1.31 0.07 0.00 0.00 0.00 0.00 61.98 64.00 1jhd s VAL 111 Cb -0.21 -3.83 -0.12 0.00 0.00 0.00 0.00 36.38 32.22 1jhd s VAL 111 CO 0.58 0.24 -0.03 -0.11 0.00 0.00 0.00 175.10 175.79 1jhd n LEU 112 N 2.09 1.17 -3.69 3.92 7.94 0.58 -4.83 117.00 124.18 1jhd n LEU 112 Ca 0.03 -0.03 -0.10 0.00 -1.11 0.00 0.00 56.01 54.80 1jhd n LEU 112 Cb 0.44 -0.03 -0.03 0.00 0.53 0.00 0.00 43.42 44.34 1jhd n LEU 112 CO 0.56 0.46 0.35 0.00 -1.11 0.00 0.00 177.39 177.65 1jhd s ALA 113 N -2.28 -1.16 -0.03 1.96 0.00 -1.08 -0.91 121.76 118.25 1jhd s ALA 113 Ca -0.11 -0.07 0.05 0.00 0.00 0.00 0.00 51.96 51.83 1jhd s ALA 113 Cb 0.04 0.86 -0.03 0.00 0.00 0.00 0.00 23.12 24.00 1jhd s ALA 113 CO 0.42 -0.85 -0.17 0.08 0.00 0.00 0.00 175.76 175.24 1jhd s VAL 114 N -3.85 2.84 -0.01 0.00 1.01 -0.07 -0.67 120.40 119.65 1jhd s VAL 114 Ca 0.08 -0.87 0.03 0.00 0.00 0.00 0.00 61.98 61.22 1jhd s VAL 114 Cb -0.02 -2.11 -0.01 0.00 0.00 0.00 0.00 36.38 34.24 1jhd s VAL 114 CO -0.03 0.54 -0.11 -0.32 0.00 0.00 0.00 175.10 175.18 1jhd s MET 115 N -0.84 0.91 -0.35 2.72 1.75 0.19 -1.13 119.30 122.55 1jhd s MET 115 Ca 0.12 -0.41 -0.11 0.00 -1.25 0.00 0.00 55.69 54.04 1jhd s MET 115 Cb -0.10 -0.88 0.01 0.00 2.84 0.00 0.00 34.83 36.69 1jhd s MET 115 CO 0.01 0.24 0.20 -0.51 -0.65 0.00 0.00 175.02 174.31 1jhd s ASP 116 N -0.28 5.73 -0.04 1.11 1.01 -0.78 -1.37 116.67 122.04 1jhd s ASP 116 Ca 0.04 -0.79 -0.30 0.00 0.71 0.00 0.00 52.55 52.22 1jhd s ASP 116 Cb -0.04 -2.04 -0.04 0.00 1.01 0.00 0.00 42.92 41.81 1jhd s ASP 116 CO -0.00 -0.32 1.21 -0.63 0.21 0.00 0.00 175.17 175.64 1jhd s ILE 117 N 1.60 4.21 -0.05 0.77 1.01 0.23 -3.56 121.20 125.41 1jhd s ILE 117 Ca 0.03 1.55 0.16 0.00 0.00 0.00 0.00 60.65 62.39 1jhd s ILE 117 Cb -0.18 -3.99 -0.25 0.00 0.01 0.00 0.00 42.46 38.05 1jhd s ILE 117 CO 0.07 0.01 0.30 -0.62 0.00 0.00 0.00 174.94 174.70 1jhd n GLU 118 N 5.12 0.72 -3.51 2.79 1.02 0.59 -4.92 120.64 122.46 1jhd n GLU 118 Ca 0.11 -0.12 -0.14 0.00 -0.02 0.00 0.00 57.16 56.99 1jhd n GLU 118 Cb 0.46 -1.40 -0.05 0.00 -0.02 0.00 0.00 31.44 30.43 1jhd n GLU 118 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1jhd s ALA 119 N -3.00 -1.78 -0.13 0.62 0.00 -1.14 -5.02 121.76 111.32 1jhd s ALA 119 Ca -0.07 1.17 -0.01 0.00 0.00 0.00 0.00 51.96 53.06 1jhd s ALA 119 Cb 0.09 0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.33 1jhd s ALA 119 CO 0.69 -0.48 -0.04 0.42 0.00 0.00 0.00 175.76 176.36 1jhd s ILE 120 N -1.92 0.85 0.07 0.00 1.01 -1.26 -1.60 121.20 118.34 1jhd s ILE 120 Ca -0.05 -0.35 0.07 0.00 0.00 0.00 0.00 60.65 60.32 1jhd s ILE 120 Cb -0.00 -1.01 -0.03 0.00 0.01 0.00 0.00 42.46 41.43 1jhd s ILE 120 CO 0.01 0.19 -0.18 -1.61 0.00 0.00 0.00 174.94 173.35 1jhd s GLU 121 N 1.76 1.10 -0.25 2.79 2.02 -0.33 -4.97 118.70 120.82 1jhd s GLU 121 Ca 0.03 -0.97 -0.14 0.00 0.02 0.00 0.00 54.97 53.90 1jhd s GLU 121 Cb -0.14 -1.22 -0.04 0.00 0.10 0.00 0.00 34.13 32.83 1jhd s GLU 121 CO -0.07 0.30 0.35 -2.00 0.02 0.00 0.00 175.26 173.85 1jhd s GLU 122 N -1.50 4.05 -0.06 1.61 2.12 -1.26 -0.61 118.70 123.05 1jhd s GLU 122 Ca 0.04 0.02 -0.29 0.00 0.36 0.00 0.00 54.97 55.11 1jhd s GLU 122 Cb -0.09 -3.62 -0.02 0.00 0.26 0.00 0.00 34.13 30.66 1jhd s GLU 122 CO 0.03 -0.18 0.94 0.08 -0.54 0.00 0.00 175.26 175.58 1jhd s VAL 123 N 1.78 4.87 0.81 3.70 1.01 0.03 -4.99 120.40 127.61 1jhd s VAL 123 Ca 0.15 1.93 -0.12 0.00 0.00 0.00 0.00 61.98 63.94 1jhd s VAL 123 Cb -0.15 -4.26 0.08 0.00 0.00 0.00 0.00 36.38 32.04 1jhd s VAL 123 CO 0.09 0.11 1.12 -0.94 0.00 0.00 0.00 175.10 175.49 1jhd s SER 124 N 1.02 4.46 0.26 3.32 1.04 -1.26 -4.82 113.70 117.73 1jhd s SER 124 Ca 0.48 1.08 -0.02 0.00 0.48 0.00 0.00 55.95 57.96 1jhd s SER 124 Cb -0.19 -1.74 0.35 0.00 0.10 0.00 0.00 66.02 64.53 1jhd s SER 124 CO 0.22 -1.96 1.80 0.44 0.98 0.00 0.00 173.24 174.72 1jhd h ASP 125 N -1.09 0.82 -0.24 7.02 3.32 -1.99 -0.53 116.42 123.73 1jhd h ASP 125 Ca -0.47 -0.16 -0.01 0.00 0.02 0.00 0.00 57.03 56.41 1jhd h ASP 125 Cb 1.29 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.62 1jhd h ASP 125 CO 0.62 0.81 0.11 -0.08 -1.72 0.00 0.00 179.24 178.98 1jhd h GLU 126 N 0.84 0.36 -0.38 3.56 4.81 -1.98 0.54 114.58 122.33 1jhd h GLU 126 Ca 0.18 -0.06 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 1jhd h GLU 126 Cb 0.32 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.62 1jhd h GLU 126 CO 0.00 0.38 0.13 1.96 -0.73 0.00 0.00 179.01 180.75 1jhd h GLN 127 N 0.25 0.59 -0.87 1.92 4.20 -1.88 -0.73 115.11 118.60 1jhd h GLN 127 Ca 0.08 -0.12 0.01 0.00 0.06 0.00 0.00 58.65 58.68 1jhd h GLN 127 Cb 0.15 -0.09 -0.04 0.00 0.30 0.00 0.00 27.48 27.80 1jhd h GLN 127 CO -0.01 0.59 0.57 0.52 -0.67 0.00 0.00 178.83 179.84 1jhd h MET 128 N 0.47 1.14 -0.42 1.46 2.86 -0.94 -0.91 114.93 118.59 1jhd h MET 128 Ca 0.12 -0.07 -0.12 0.00 -2.06 0.00 0.00 59.70 57.57 1jhd h MET 128 Cb 0.24 -0.26 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 1jhd h MET 128 CO -0.01 0.76 -0.24 0.00 1.06 0.00 0.00 176.91 178.48 1jhd h ALA 129 N 1.46 0.79 -0.28 6.32 0.00 -0.51 -0.58 119.26 126.45 1jhd h ALA 129 Ca 0.32 -0.39 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1jhd h ALA 129 Cb -0.14 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 1jhd h ALA 129 CO -0.07 0.65 -0.15 0.28 0.00 0.00 0.00 179.25 179.96 1jhd h VAL 130 N 0.74 1.30 -0.21 0.00 2.07 -0.75 -0.16 116.25 119.23 1jhd h VAL 130 Ca 0.10 -1.25 -0.04 0.00 0.82 0.00 0.00 66.70 66.33 1jhd h VAL 130 Cb 0.78 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 32.04 1jhd h VAL 130 CO 0.06 0.40 -0.05 0.24 0.02 0.00 0.00 177.57 178.24 1jhd h MET 131 N 0.34 0.31 0.10 1.57 2.86 -1.02 0.36 114.93 119.45 1jhd h MET 131 Ca 0.06 -0.06 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1jhd h MET 131 Cb 0.67 -0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.28 1jhd h MET 131 CO 0.04 0.38 -0.05 1.15 1.06 0.00 0.00 176.91 179.50 1jhd h THR 132 N 0.30 0.88 -0.88 2.22 2.02 -0.98 -2.90 112.91 113.58 1jhd h THR 132 Ca 0.07 -1.36 -0.00 0.00 0.77 0.00 0.00 66.41 65.88 1jhd h THR 132 Cb 0.29 1.57 -0.04 0.00 -1.74 0.00 0.00 68.15 68.23 1jhd h THR 132 CO 0.01 0.26 0.53 -0.78 0.37 0.00 0.00 175.52 175.91 1jhd h ASP 133 N -0.92 1.05 0.01 4.18 3.58 -0.94 -0.44 116.42 122.94 1jhd h ASP 133 Ca -0.01 -0.07 -0.13 0.00 0.42 0.00 0.00 57.03 57.24 1jhd h ASP 133 Cb 0.53 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.30 1jhd h ASP 133 CO 0.02 0.81 -0.41 0.11 -2.88 0.00 0.00 179.24 176.89 1jhd h LYS 134 N 1.20 0.50 0.12 0.28 1.79 -1.03 -0.05 116.57 119.40 1jhd h LYS 134 Ca 0.31 -0.26 -0.22 0.00 -2.18 0.00 0.00 60.65 58.31 1jhd h LYS 134 Cb -0.05 0.00 0.01 0.00 -1.58 0.00 0.00 32.23 30.61 1jhd h LYS 134 CO -0.06 0.83 -1.08 0.28 -1.08 0.00 0.00 179.45 178.34 1jhd h VAL 135 N 0.41 1.28 -0.00 0.50 2.07 -1.32 -3.38 116.25 115.81 1jhd h VAL 135 Ca 0.04 -2.46 0.00 0.00 0.82 0.00 0.00 66.70 65.10 1jhd h VAL 135 Cb 0.90 2.95 0.00 0.00 -1.52 0.00 0.00 31.29 33.62 1jhd h VAL 135 CO 0.08 0.69 -0.72 -1.22 0.02 0.00 0.00 177.57 176.42 1jhd n TYR 136 N -4.06 0.00 -2.40 1.57 4.01 -0.19 -4.41 117.16 111.68 1jhd n TYR 136 Ca -0.19 0.00 -0.20 0.00 -0.16 0.00 0.00 57.90 57.34 1jhd n TYR 136 Cb 0.84 -0.08 -0.01 0.00 -0.31 0.00 0.00 39.34 39.79 1jhd n TYR 136 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 1jhd n ARG 137 N -1.20 -1.72 -3.57 -0.72 1.74 -0.03 -4.93 116.66 106.24 1jhd n ARG 137 Ca 0.06 0.99 -0.08 0.00 -0.77 0.00 0.00 57.85 58.05 1jhd n ARG 137 Cb 0.35 -5.65 -0.04 0.00 -1.02 0.00 0.00 32.46 26.10 1jhd n ARG 137 CO 0.00 0.00 0.00 -0.08 -1.52 0.00 0.00 177.63 176.03 1jhd s THR 138 N -3.02 0.00 -0.38 0.55 -1.32 -1.25 -5.03 115.64 105.19 1jhd s THR 138 Ca 0.00 0.00 0.06 0.00 -1.21 0.00 0.00 61.69 60.54 1jhd s THR 138 Cb 0.00 -1.00 0.15 0.00 -1.51 0.00 0.00 72.50 70.14 1jhd s THR 138 CO 0.00 0.00 1.12 0.35 -2.21 0.00 0.00 174.62 173.88 1jhd n THR 139 N 0.37 1.09 -1.77 5.08 -2.24 -1.26 -4.03 114.28 111.52 1jhd n THR 139 Ca -0.07 -1.09 -0.42 0.00 -2.27 0.00 0.00 64.05 60.20 1jhd n THR 139 Cb 0.59 0.44 -0.03 0.00 -2.10 0.00 0.00 70.33 69.23 1jhd n THR 139 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1jhd s ASP 140 N -1.12 6.26 0.00 3.42 2.15 -1.26 -4.88 116.67 121.24 1jhd s ASP 140 Ca 0.12 2.29 0.16 0.00 0.43 0.00 0.00 52.55 55.56 1jhd s ASP 140 Cb 0.07 -2.53 0.85 0.00 -0.30 0.00 0.00 42.92 41.02 1jhd s ASP 140 CO 0.07 -1.26 1.45 0.23 -0.17 0.00 0.00 175.17 175.49 1jhd n MET 141 N 7.76 0.29 0.05 4.34 2.81 -1.26 -1.39 117.12 129.72 1jhd n MET 141 Ca 0.21 0.11 0.13 0.00 -1.81 0.00 0.00 57.70 56.34 1jhd n MET 141 Cb 0.43 -1.50 0.46 0.00 -0.71 0.00 0.00 33.22 31.90 1jhd n MET 141 CO 0.00 0.00 0.00 -0.25 1.51 0.00 0.00 175.97 177.23 1jhd n ASP 142 N -1.23 0.46 -4.66 7.83 8.00 -1.26 -4.36 116.55 121.33 1jhd n ASP 142 Ca 0.09 0.45 -0.43 0.00 0.71 0.00 0.00 54.79 55.61 1jhd n ASP 142 Cb 0.11 -0.52 -0.02 0.00 -0.02 0.00 0.00 41.12 40.67 1jhd n ASP 142 CO 0.00 0.00 0.00 -2.28 -0.39 0.00 0.00 177.20 174.53 1jhd s HIS 143 N -3.06 3.21 0.40 1.24 2.46 -0.49 -4.93 115.29 114.13 1jhd s HIS 143 Ca 0.12 1.34 0.06 0.00 0.47 0.00 0.00 55.06 57.05 1jhd s HIS 143 Cb 0.15 -3.37 0.83 0.00 -0.13 0.00 0.00 32.58 30.06 1jhd s HIS 143 CO 0.59 -0.78 2.05 -0.84 -2.47 0.00 0.00 174.74 173.29 1jhd h ILE 144 N 5.50 1.11 -0.33 0.89 3.07 -1.87 -1.33 117.51 124.55 1jhd h ILE 144 Ca -0.21 -0.22 -0.17 0.00 1.55 0.00 0.00 64.86 65.81 1jhd h ILE 144 Cb 1.07 0.48 -0.00 0.00 -0.27 0.00 0.00 36.82 38.09 1jhd h ILE 144 CO 0.98 0.11 -0.47 1.23 -1.05 0.00 0.00 178.15 178.96 1jhd h GLY 145 N 0.60 0.96 0.99 0.16 0.00 -1.88 -0.93 103.07 102.98 1jhd h GLY 145 Ca 0.16 -1.05 0.00 0.00 0.00 0.00 0.00 47.33 46.44 1jhd h GLY 145 CO -0.03 0.95 0.24 -2.08 0.00 0.00 0.00 176.54 175.61 1jhd h VAL 146 N 0.70 1.11 -0.26 4.60 2.07 -1.63 -0.50 116.25 122.34 1jhd h VAL 146 Ca 0.04 -0.23 -0.00 0.00 0.82 0.00 0.00 66.70 67.33 1jhd h VAL 146 Cb 1.06 0.58 -0.01 0.00 -1.52 0.00 0.00 31.29 31.40 1jhd h VAL 146 CO 0.11 0.11 0.15 0.50 0.02 0.00 0.00 177.57 178.45 1jhd h LYS 147 N 0.51 0.36 -0.28 1.57 1.63 -1.14 -1.57 116.57 117.64 1jhd h LYS 147 Ca 0.14 -0.04 0.03 0.00 -0.85 0.00 0.00 60.65 59.93 1jhd h LYS 147 Cb -0.03 -0.07 -0.03 0.00 -0.60 0.00 0.00 32.23 31.50 1jhd h LYS 147 CO -0.03 0.30 0.11 1.15 -3.45 0.00 0.00 179.45 177.53 1jhd h THR 148 N 0.31 0.94 -0.94 1.00 2.02 -0.98 -1.65 112.91 113.62 1jhd h THR 148 Ca 0.09 -0.08 0.06 0.00 0.77 0.00 0.00 66.41 67.25 1jhd h THR 148 Cb 0.05 0.68 -0.06 0.00 -1.74 0.00 0.00 68.15 67.07 1jhd h THR 148 CO -0.02 0.04 0.60 0.15 0.37 0.00 0.00 175.52 176.67 1jhd h PHE 149 N 0.24 1.12 -0.35 3.16 3.57 -0.89 -2.51 116.94 121.28 1jhd h PHE 149 Ca 0.12 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.65 1jhd h PHE 149 Cb 0.08 -0.37 0.00 0.00 2.79 0.00 0.00 35.95 38.45 1jhd h PHE 149 CO -0.12 0.59 0.00 0.09 -2.23 0.00 0.00 178.31 176.64 1jhd n ASN 150 N -4.54 2.15 -0.59 0.41 4.13 -0.61 -4.10 115.26 112.11 1jhd n ASN 150 Ca 0.14 -2.07 0.05 0.00 1.68 0.00 0.00 54.58 54.38 1jhd n ASN 150 Cb 0.16 -0.29 0.20 0.00 -1.54 0.00 0.00 39.78 38.30 1jhd n ASN 150 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1jhd n SER 151 N 0.53 2.02 -0.27 6.41 7.64 -0.66 -4.64 113.62 124.64 1jhd n SER 151 Ca 0.12 -3.70 0.03 0.00 1.01 0.00 0.00 58.87 56.33 1jhd n SER 151 Cb 0.37 -0.53 0.04 0.00 -1.01 0.00 0.00 64.21 63.08 1jhd n SER 151 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1jhd n GLN 152 N -1.16 0.48 0.00 1.43 6.02 -1.26 -5.04 117.38 117.85 1jhd n GLN 152 Ca 0.21 -1.06 0.00 0.00 -0.01 0.00 0.00 57.00 56.14 1jhd n GLN 152 Cb 0.74 -1.12 0.00 0.00 1.02 0.00 0.00 30.24 30.87 1jhd n GLN 152 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jhd n GLY 153 N 0.29 0.53 0.00 1.08 0.00 -1.26 -3.32 105.19 102.50 1jhd n GLY 153 Ca 0.04 -2.09 0.00 0.00 0.00 0.00 0.00 46.02 43.97 1jhd n GLY 153 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jhd n ARG 154 N 0.29 1.97 -3.28 1.61 5.12 -1.02 -4.67 116.66 116.67 1jhd n ARG 154 Ca 0.00 -1.18 -0.42 0.00 -1.93 0.00 0.00 57.85 54.32 1jhd n ARG 154 Cb 0.00 -0.90 -0.08 0.00 -1.16 0.00 0.00 32.46 30.32 1jhd n ARG 154 CO 0.00 0.00 0.00 0.08 -1.93 0.00 0.00 177.63 175.78 1jhd s VAL 155 N -0.69 5.04 -0.32 1.55 1.01 -0.18 -0.79 120.40 126.02 1jhd s VAL 155 Ca 0.00 -0.05 -0.20 0.00 0.00 0.00 0.00 61.98 61.73 1jhd s VAL 155 Cb 0.00 -4.01 -0.01 0.00 0.00 0.00 0.00 36.38 32.36 1jhd s VAL 155 CO 0.00 -0.35 0.62 0.00 0.00 0.00 0.00 175.10 175.37 1jhd s ALA 156 N 2.29 3.51 -0.25 5.51 0.00 0.21 -0.36 121.76 132.67 1jhd s ALA 156 Ca 0.15 -0.73 -0.09 0.00 0.00 0.00 0.00 51.96 51.30 1jhd s ALA 156 Cb -0.16 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.82 1jhd s ALA 156 CO 0.14 -1.13 0.13 0.08 0.00 0.00 0.00 175.76 174.97 1jhd s VAL 157 N 2.60 4.86 0.15 0.00 1.01 -0.51 -1.18 120.40 127.33 1jhd s VAL 157 Ca 0.24 0.01 0.10 0.00 0.00 0.00 0.00 61.98 62.33 1jhd s VAL 157 Cb -0.15 -3.28 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 1jhd s VAL 157 CO 0.13 0.32 -0.23 -0.94 0.00 0.00 0.00 175.10 174.37 1jhd s SER 158 N 1.49 3.03 0.00 3.32 1.04 -0.63 -4.21 113.70 117.75 1jhd s SER 158 Ca 0.06 -0.79 0.00 0.00 0.48 0.00 0.00 55.95 55.70 1jhd s SER 158 Cb -0.15 -0.20 0.00 0.00 0.10 0.00 0.00 66.02 65.77 1jhd s SER 158 CO 0.06 0.09 0.00 0.61 0.98 0.00 0.00 173.24 174.98 1jhd n GLY 159 N 0.63 2.70 3.78 7.32 0.00 -0.81 -0.30 105.19 118.50 1jhd n GLY 159 Ca -0.16 -1.43 -0.36 0.00 0.00 0.00 0.00 46.02 44.07 1jhd n GLY 159 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jhd s PRO 160 N -2.01 3.69 0.12 1.61 0.04 -1.23 -1.40 135.00 135.81 1jhd s PRO 160 Ca 0.00 1.64 0.05 0.00 0.04 0.00 0.00 61.00 62.73 1jhd s PRO 160 Cb 0.00 -2.26 -0.04 0.00 0.04 0.00 0.00 34.50 32.24 1jhd s PRO 160 CO 0.00 -0.58 -0.11 0.96 0.04 0.00 0.00 177.00 177.31 1jhd s ILE 161 N -1.68 1.12 -0.07 0.56 -4.36 -0.89 -1.86 121.20 114.02 1jhd s ILE 161 Ca 0.66 -1.75 0.05 0.00 -0.26 0.00 0.00 60.65 59.35 1jhd s ILE 161 Cb -0.25 -1.52 -0.01 0.00 1.25 0.00 0.00 42.46 41.94 1jhd s ILE 161 CO 0.30 -0.55 -0.24 -1.10 0.24 0.00 0.00 174.94 173.58 1jhd s GLN 162 N -2.95 2.60 -0.18 0.37 -0.21 -0.28 -4.84 119.66 114.16 1jhd s GLN 162 Ca 0.09 -0.87 -0.08 0.00 0.02 0.00 0.00 55.36 54.52 1jhd s GLN 162 Cb -0.02 -2.14 -0.04 0.00 1.00 0.00 0.00 33.01 31.81 1jhd s GLN 162 CO 0.01 0.31 0.08 0.08 -2.12 0.00 0.00 175.29 173.66 1jhd s VAL 163 N -0.00 4.98 -0.40 1.09 1.01 -0.19 -0.89 120.40 126.00 1jhd s VAL 163 Ca -0.08 0.03 0.22 0.00 0.00 0.00 0.00 61.98 62.16 1jhd s VAL 163 Cb -0.15 -3.25 -0.16 0.00 0.00 0.00 0.00 36.38 32.83 1jhd s VAL 163 CO 0.05 0.47 0.88 0.18 0.00 0.00 0.00 175.10 176.67 1jhd n LEU 164 N 3.42 0.52 -3.81 3.92 4.77 -0.09 -2.08 117.00 123.66 1jhd n LEU 164 Ca -0.17 0.03 -0.03 0.00 -0.03 0.00 0.00 56.01 55.81 1jhd n LEU 164 Cb 0.52 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 1jhd n LEU 164 CO 0.35 -0.00 0.76 0.54 -1.33 0.00 0.00 177.39 177.71 1jhd s ASN 165 N -4.32 -0.08 -0.44 -1.43 2.20 -1.25 -4.95 114.94 104.68 1jhd s ASN 165 Ca -0.00 -0.56 0.04 0.00 -0.94 0.00 0.00 52.86 51.40 1jhd s ASN 165 Cb 0.13 0.51 0.50 0.00 -2.00 0.00 0.00 41.25 40.39 1jhd s ASN 165 CO 0.83 -0.98 1.64 0.49 -2.94 0.00 0.00 177.10 176.15 1jhd n PHE 166 N -0.57 2.47 -3.29 1.54 3.72 -1.26 -4.88 117.46 115.19 1jhd n PHE 166 Ca -0.05 -2.26 0.00 0.00 -0.05 0.00 0.00 57.45 55.09 1jhd n PHE 166 Cb 0.60 -0.83 0.00 0.00 -0.94 0.00 0.00 39.48 38.31 1jhd n PHE 166 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1jhd n SER 167 N -0.96 -0.04 0.03 4.37 2.88 -1.26 -2.37 113.62 116.27 1jhd n SER 167 Ca 0.49 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 58.15 1jhd n SER 167 Cb 0.98 0.00 0.50 0.00 -0.75 0.00 0.00 64.21 64.95 1jhd n SER 167 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1jhd n TYR 168 N 0.00 0.23 -0.25 0.66 4.11 -1.26 -2.86 117.16 117.79 1jhd n TYR 168 Ca 0.00 0.07 -0.07 0.00 -0.00 0.00 0.00 57.90 57.91 1jhd n TYR 168 Cb 0.00 -0.62 0.05 0.00 -0.00 0.00 0.00 39.34 38.76 1jhd n TYR 168 CO 0.00 0.00 0.00 0.74 -0.00 0.00 0.00 176.86 177.60 1jhd h PHE 169 N 0.00 1.11 0.10 -3.48 0.04 -1.88 0.09 116.94 112.92 1jhd h PHE 169 Ca 0.00 -0.11 -0.32 0.00 2.80 0.00 0.00 57.97 60.34 1jhd h PHE 169 Cb 0.48 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 1jhd h PHE 169 CO 0.00 0.88 -1.71 0.37 -0.60 0.00 0.00 178.31 177.25 1jhd h GLN 170 N 1.02 0.22 -0.75 1.51 4.15 -1.52 -3.16 115.11 116.57 1jhd h GLN 170 Ca 0.23 -0.37 -0.03 0.00 0.77 0.00 0.00 58.65 59.24 1jhd h GLN 170 Cb 0.28 0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.07 1jhd h GLN 170 CO -0.01 1.04 0.34 0.00 -1.93 0.00 0.00 178.83 178.27 1jhd h ALA 171 N 0.44 1.17 0.00 3.38 0.00 -1.37 -2.33 119.26 120.55 1jhd h ALA 171 Ca -0.31 -0.16 -0.04 0.00 0.00 0.00 0.00 54.91 54.40 1jhd h ALA 171 Cb 2.03 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 19.51 1jhd h ALA 171 CO 0.13 0.62 -0.72 -0.44 0.00 0.00 0.00 179.25 178.84 1jhd h ASP 172 N 1.08 0.00 -2.09 0.00 3.32 -1.15 -3.39 116.42 114.19 1jhd h ASP 172 Ca 0.26 0.00 -0.54 0.00 0.02 0.00 0.00 57.03 56.77 1jhd h ASP 172 Cb 0.15 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.29 1jhd h ASP 172 CO -0.03 0.14 -0.98 0.49 -1.72 0.00 0.00 179.24 177.14 1jhd n PHE 173 N -2.89 1.33 0.32 4.55 3.72 -1.09 -4.96 117.46 118.44 1jhd n PHE 173 Ca -0.00 -3.84 0.18 0.00 -0.05 0.00 0.00 57.45 53.74 1jhd n PHE 173 Cb 0.61 -0.44 1.05 0.00 -0.94 0.00 0.00 39.48 39.76 1jhd n PHE 173 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1jhd h PRO 174 N 3.37 0.00 0.00 -1.08 0.13 -1.64 -1.57 132.00 131.21 1jhd h PRO 174 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1jhd h PRO 174 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1jhd h PRO 174 CO 0.60 0.00 -1.34 -0.25 -0.23 0.00 0.00 178.00 176.78 1jhd n ASP 175 N -3.53 0.49 -0.10 1.44 8.00 -1.26 -4.53 116.55 117.06 1jhd n ASP 175 Ca -0.03 -0.17 -0.16 0.00 0.71 0.00 0.00 54.79 55.15 1jhd n ASP 175 Cb 0.08 1.17 -0.09 0.00 -0.02 0.00 0.00 41.12 42.25 1jhd n ASP 175 CO 0.00 0.00 0.00 0.41 -0.39 0.00 0.00 177.20 177.22 1jhd n THR 176 N -2.10 1.17 -1.75 -3.53 -1.04 -0.99 -4.99 114.28 101.06 1jhd n THR 176 Ca -0.00 -0.42 -0.42 0.00 -2.04 0.00 0.00 64.05 61.17 1jhd n THR 176 Cb 0.48 -1.32 -0.01 0.00 -1.82 0.00 0.00 70.33 67.66 1jhd n THR 176 CO 0.00 0.00 0.00 0.33 -0.64 0.00 0.00 175.07 174.76 1jhd n PHE 177 N -3.25 2.86 -3.94 -1.42 7.35 -0.63 -0.50 117.46 117.93 1jhd n PHE 177 Ca -0.37 0.30 -0.10 0.00 -0.76 0.00 0.00 57.45 56.52 1jhd n PHE 177 Cb 0.87 -2.58 -0.11 0.00 0.35 0.00 0.00 39.48 38.02 1jhd n PHE 177 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 1jhd s ARG 178 N -0.85 0.37 0.63 -4.13 1.81 -0.51 -4.82 118.95 111.45 1jhd s ARG 178 Ca 0.62 -0.52 -0.07 0.00 -1.72 0.00 0.00 55.73 54.04 1jhd s ARG 178 Cb -0.50 0.14 0.01 0.00 -0.45 0.00 0.00 34.95 34.16 1jhd s ARG 178 CO 0.52 -0.07 0.96 0.95 -0.68 0.00 0.00 175.30 176.98 1jhd s THR 179 N -1.40 3.52 0.33 0.02 -4.23 -1.26 -4.69 115.64 107.92 1jhd s THR 179 Ca -0.15 0.11 0.04 0.00 -1.18 0.00 0.00 61.69 60.51 1jhd s THR 179 Cb -0.09 -3.43 0.13 0.00 1.34 0.00 0.00 72.50 70.45 1jhd s THR 179 CO -0.00 -0.48 1.84 0.00 -0.54 0.00 0.00 174.62 175.44 1jhd h ALA 180 N -0.33 1.31 -0.24 3.99 0.00 -1.51 -1.94 119.26 120.54 1jhd h ALA 180 Ca -0.45 -0.24 0.03 0.00 0.00 0.00 0.00 54.91 54.25 1jhd h ALA 180 Cb 1.26 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1jhd h ALA 180 CO 0.62 0.46 0.04 0.28 0.00 0.00 0.00 179.25 180.65 1jhd h VAL 181 N 0.45 0.89 -0.00 0.00 2.07 -1.86 -1.57 116.25 116.22 1jhd h VAL 181 Ca 0.09 -0.05 -0.17 0.00 0.82 0.00 0.00 66.70 67.40 1jhd h VAL 181 Cb 0.43 0.74 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1jhd h VAL 181 CO 0.02 0.03 -0.78 -0.08 0.02 0.00 0.00 177.57 176.77 1jhd h GLU 182 N 0.14 0.04 -0.64 1.57 4.57 -1.84 -1.86 114.58 116.56 1jhd h GLU 182 Ca 0.11 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.17 1jhd h GLU 182 Cb 0.11 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.69 1jhd h GLU 182 CO -0.15 0.80 0.08 0.82 -1.18 0.00 0.00 179.01 179.39 1jhd h ILE 183 N 0.03 1.26 -0.69 2.32 2.04 -1.22 0.64 117.51 121.88 1jhd h ILE 183 Ca -0.01 -1.04 0.00 0.00 1.00 0.00 0.00 64.86 64.80 1jhd h ILE 183 Cb 1.38 0.68 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 1jhd h ILE 183 CO 0.11 0.39 0.44 0.03 0.00 0.00 0.00 178.15 179.12 1jhd h ARG 184 N 0.99 0.93 -0.68 2.37 3.08 -1.03 0.49 114.38 120.53 1jhd h ARG 184 Ca 0.19 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.18 1jhd h ARG 184 Cb 0.45 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 1jhd h ARG 184 CO 0.02 0.63 0.43 -0.91 -1.07 0.00 0.00 179.97 179.07 1jhd h ASN 185 N 0.94 0.80 -0.37 7.04 2.35 -0.66 -2.33 115.58 123.36 1jhd h ASN 185 Ca 0.25 -0.04 -0.13 0.00 -0.55 0.00 0.00 56.30 55.83 1jhd h ASN 185 Cb -0.08 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.08 1jhd h ASN 185 CO -0.05 0.60 -0.24 -0.33 -1.65 0.00 0.00 177.43 175.76 1jhd h GLU 186 N 0.92 0.87 -0.46 0.81 5.08 -0.52 -0.38 114.58 120.91 1jhd h GLU 186 Ca 0.25 -0.37 0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1jhd h GLU 186 Cb -0.07 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 1jhd h GLU 186 CO -0.05 1.01 0.22 0.82 -1.00 0.00 0.00 179.01 180.02 1jhd h ILE 187 N 0.75 0.95 -0.69 3.13 2.04 -0.72 -0.50 117.51 122.48 1jhd h ILE 187 Ca 0.10 -0.15 -0.03 0.00 1.00 0.00 0.00 64.86 65.77 1jhd h ILE 187 Cb 0.78 0.47 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 1jhd h ILE 187 CO 0.06 0.08 0.31 0.11 0.00 0.00 0.00 178.15 178.72 1jhd h LYS 188 N 0.44 1.00 -0.22 2.37 1.57 -1.17 -2.39 116.57 118.18 1jhd h LYS 188 Ca 0.20 -0.16 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 1jhd h LYS 188 Cb 0.12 -0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.24 1jhd h LYS 188 CO -0.15 0.81 0.15 0.93 -0.57 0.00 0.00 179.45 180.62 1jhd h GLU 189 N 0.96 0.28 0.00 3.15 5.08 -0.14 0.23 114.58 124.14 1jhd h GLU 189 Ca 0.23 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 1jhd h GLU 189 Cb 0.15 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1jhd h GLU 189 CO -0.03 0.18 0.00 0.72 -1.00 0.00 0.00 179.01 178.89 1jhd n HIS 190 N -4.50 0.50 -1.08 4.33 8.25 -0.28 -4.90 115.22 117.54 1jhd n HIS 190 Ca 0.00 0.16 -0.03 0.00 -0.26 0.00 0.00 57.72 57.60 1jhd n HIS 190 Cb 0.08 -0.76 -0.01 0.00 1.12 0.00 0.00 29.99 30.43 1jhd n HIS 190 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1jhd n GLY 191 N 1.05 0.59 3.85 -1.41 0.00 0.07 -5.02 105.19 104.32 1jhd n GLY 191 Ca 0.05 -0.88 -0.33 0.00 0.00 0.00 0.00 46.02 44.86 1jhd n GLY 191 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1jhd s TRP 192 N -2.09 3.44 0.00 1.61 0.51 -0.97 -5.01 118.94 116.43 1jhd s TRP 192 Ca 0.00 1.18 0.00 0.00 -2.12 0.00 0.00 56.10 55.16 1jhd s TRP 192 Cb 0.00 -2.49 0.00 0.00 -0.81 0.00 0.00 33.47 30.17 1jhd s TRP 192 CO 0.00 0.19 0.00 0.43 -0.51 0.00 0.00 176.95 177.06 1jhd n SER 193 N -0.06 0.00 -4.72 2.95 7.64 -1.26 -4.62 113.62 113.55 1jhd n SER 193 Ca 0.01 0.00 -0.41 0.00 1.01 0.00 0.00 58.87 59.48 1jhd n SER 193 Cb 0.53 -0.11 -0.04 0.00 -1.01 0.00 0.00 64.21 63.58 1jhd n SER 193 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1jhd s LYS 194 N -0.59 4.61 -0.03 1.43 1.02 -1.26 -4.78 119.74 120.14 1jhd s LYS 194 Ca 0.00 1.50 -0.01 0.00 0.02 0.00 0.00 55.97 57.48 1jhd s LYS 194 Cb 0.00 -3.39 0.03 0.00 -0.52 0.00 0.00 37.83 33.95 1jhd s LYS 194 CO 0.00 0.06 0.06 0.08 -0.92 0.00 0.00 175.35 174.63 1jhd s VAL 195 N 0.44 -0.05 -0.13 3.17 1.01 -1.26 -0.25 120.40 123.32 1jhd s VAL 195 Ca 0.50 0.19 -0.04 0.00 0.00 0.00 0.00 61.98 62.64 1jhd s VAL 195 Cb -0.24 -0.12 -0.03 0.00 0.00 0.00 0.00 36.38 35.99 1jhd s VAL 195 CO 0.30 0.08 0.01 0.54 0.00 0.00 0.00 175.10 176.03 1jhd s VAL 196 N 1.03 4.35 0.02 2.92 0.11 -0.59 -1.12 120.40 127.12 1jhd s VAL 196 Ca -0.08 -0.21 0.01 0.00 -2.93 0.00 0.00 61.98 58.76 1jhd s VAL 196 Cb -0.12 -2.89 -0.04 0.00 -1.53 0.00 0.00 36.38 31.81 1jhd s VAL 196 CO -0.04 0.54 0.07 0.00 -3.33 0.00 0.00 175.10 172.34 1jhd s ALA 197 N -0.21 3.55 -0.04 1.54 0.00 -0.08 -1.01 121.76 125.51 1jhd s ALA 197 Ca 0.06 -0.92 -0.00 0.00 0.00 0.00 0.00 51.96 51.09 1jhd s ALA 197 Cb -0.12 -1.51 0.03 0.00 0.00 0.00 0.00 23.12 21.52 1jhd s ALA 197 CO 0.02 0.71 0.01 0.12 0.00 0.00 0.00 175.76 176.62 1jhd s PHE 198 N -1.24 0.33 -0.00 0.00 5.36 -0.68 -2.08 117.98 119.66 1jhd s PHE 198 Ca 0.25 0.02 -0.12 0.00 -0.96 0.00 0.00 56.93 56.12 1jhd s PHE 198 Cb -0.12 -0.50 -0.05 0.00 -0.34 0.00 0.00 43.02 42.00 1jhd s PHE 198 CO 0.16 -0.18 0.35 -1.14 -1.46 0.00 0.00 175.22 172.95 1jhd s GLN 199 N 1.46 3.78 0.06 10.12 0.74 -1.26 -1.12 119.66 133.43 1jhd s GLN 199 Ca -0.04 0.23 -0.19 0.00 0.05 0.00 0.00 55.36 55.41 1jhd s GLN 199 Cb -0.13 -3.15 0.04 0.00 1.10 0.00 0.00 33.01 30.87 1jhd s GLN 199 CO -0.03 0.67 0.45 -0.08 -0.55 0.00 0.00 175.29 175.76 1jhd s THR 200 N -1.16 0.05 -0.02 -0.34 -1.32 -1.24 -4.96 115.64 106.64 1jhd s THR 200 Ca 0.25 -0.40 0.01 0.00 -1.21 0.00 0.00 61.69 60.34 1jhd s THR 200 Cb -0.15 -0.99 -0.02 0.00 -1.51 0.00 0.00 72.50 69.83 1jhd s THR 200 CO 0.13 -0.22 -0.00 0.54 -2.21 0.00 0.00 174.62 172.86 1jhd n ARG 201 N 0.36 2.61 -1.69 7.08 1.74 -1.26 -2.85 116.66 122.65 1jhd n ARG 201 Ca -0.18 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.60 1jhd n ARG 201 Cb 0.61 -1.05 0.04 0.00 -1.02 0.00 0.00 32.46 31.04 1jhd n ARG 201 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1jhd s ASN 202 N -3.52 5.49 0.78 0.55 0.02 -1.26 -5.00 114.94 112.00 1jhd s ASN 202 Ca -0.02 1.46 -0.11 0.00 -1.02 0.00 0.00 52.86 53.17 1jhd s ASN 202 Cb 0.01 -2.35 0.07 0.00 0.02 0.00 0.00 41.25 38.99 1jhd s ASN 202 CO 0.07 -1.35 1.11 -2.16 0.02 0.00 0.00 177.10 174.79 1jhd s PRO 203 N -5.14 2.08 -0.35 -0.60 0.04 -1.26 -4.96 135.00 124.81 1jhd s PRO 203 Ca 0.58 1.31 -0.14 0.00 0.04 0.00 0.00 61.00 62.78 1jhd s PRO 203 Cb -0.13 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 1jhd s PRO 203 CO 0.54 -1.79 0.31 -1.64 0.04 0.00 0.00 177.00 174.46 1jhd s MET 204 N -4.69 3.43 0.30 4.56 -1.94 -1.26 -5.06 119.30 114.65 1jhd s MET 204 Ca 0.64 -0.60 -0.05 0.00 -1.71 0.00 0.00 55.69 53.97 1jhd s MET 204 Cb -0.19 -3.84 0.07 0.00 2.01 0.00 0.00 34.83 32.88 1jhd s MET 204 CO 0.54 -0.54 0.41 0.72 -0.01 0.00 0.00 175.02 176.14 1jhd n HIS 205 N 5.26 -3.93 0.21 -0.03 8.25 -1.26 -4.74 115.22 118.98 1jhd n HIS 205 Ca -0.11 -0.39 0.05 0.00 -0.26 0.00 0.00 57.72 57.01 1jhd n HIS 205 Cb 0.49 -0.32 0.47 0.00 1.12 0.00 0.00 29.99 31.75 1jhd n HIS 205 CO 0.00 0.00 0.00 -0.09 0.64 0.00 0.00 176.34 176.89 1jhd h ARG 206 N 0.00 0.00 -0.01 -0.41 2.43 -1.78 -2.08 114.38 112.53 1jhd h ARG 206 Ca -0.13 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.05 1jhd h ARG 206 Cb 0.38 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.90 1jhd h ARG 206 CO 0.10 0.25 -0.09 0.00 -1.51 0.00 0.00 179.97 178.72 1jhd h ALA 207 N 1.75 -0.09 0.00 2.80 0.00 -1.84 0.22 119.26 122.10 1jhd h ALA 207 Ca -0.00 0.01 -0.11 0.00 0.00 0.00 0.00 54.91 54.81 1jhd h ALA 207 Cb 0.45 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 1jhd h ALA 207 CO 0.03 -0.58 -0.53 0.45 0.00 0.00 0.00 179.25 178.63 1jhd h HIS 208 N -0.15 0.00 -0.04 0.00 3.86 -1.82 -1.27 115.15 115.73 1jhd h HIS 208 Ca 0.04 0.00 0.01 0.00 -1.16 0.00 0.00 60.37 59.26 1jhd h HIS 208 Cb 0.20 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.65 1jhd h HIS 208 CO -0.16 0.53 -0.03 1.49 0.86 0.00 0.00 177.93 180.62 1jhd h GLU 209 N 0.00 -0.03 -0.27 2.45 4.81 -1.05 -1.88 114.58 118.61 1jhd h GLU 209 Ca -0.01 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 1jhd h GLU 209 Cb 1.29 0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.66 1jhd h GLU 209 CO 0.07 -0.02 -0.15 0.93 -0.73 0.00 0.00 179.01 179.10 1jhd h GLU 210 N -0.04 0.47 -0.36 1.92 4.39 -0.36 -1.37 114.58 119.23 1jhd h GLU 210 Ca 0.03 -0.14 -0.00 0.00 0.34 0.00 0.00 59.36 59.59 1jhd h GLU 210 Cb 0.08 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 28.66 1jhd h GLU 210 CO -0.07 0.61 0.22 1.25 -1.16 0.00 0.00 179.01 179.87 1jhd h LEU 211 N 0.43 0.43 -0.61 1.33 5.85 -1.03 0.32 115.31 122.03 1jhd h LEU 211 Ca 0.08 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.72 1jhd h LEU 211 Cb 0.52 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.41 1jhd h LEU 211 CO 0.03 0.36 0.30 0.00 -0.34 0.00 0.00 178.44 178.79 1jhd h ARG 213 N 0.84 0.77 -0.37 0.00 2.43 -0.89 -0.42 114.38 116.73 1jhd h ARG 213 Ca 0.21 -0.24 0.02 0.00 -0.81 0.00 0.00 59.98 59.16 1jhd h ARG 213 Cb 0.11 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.56 1jhd h ARG 213 CO -0.03 0.83 0.21 0.52 -1.51 0.00 0.00 179.97 179.99 1jhd h MET 214 N 0.61 0.41 -0.75 0.20 2.86 -0.10 -0.56 114.93 117.59 1jhd h MET 214 Ca 0.13 -0.02 -0.05 0.00 -2.06 0.00 0.00 59.70 57.69 1jhd h MET 214 Cb 0.47 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 32.01 1jhd h MET 214 CO 0.02 0.27 0.27 0.00 1.06 0.00 0.00 176.91 178.53 1jhd h ALA 215 N 1.17 0.98 -0.67 6.32 0.00 -0.99 0.27 119.26 126.34 1jhd h ALA 215 Ca 0.15 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 1jhd h ALA 215 Cb 0.02 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 1jhd h ALA 215 CO -0.08 0.64 0.19 1.98 0.00 0.00 0.00 179.25 181.97 1jhd h MET 216 N 1.10 1.06 -0.21 0.00 -1.53 -0.68 -0.57 114.93 114.10 1jhd h MET 216 Ca 0.25 -0.24 -0.04 0.00 -3.44 0.00 0.00 59.70 56.23 1jhd h MET 216 Cb 0.26 -0.15 -0.01 0.00 -0.55 0.00 0.00 31.60 31.16 1jhd h MET 216 CO -0.01 0.93 -0.02 1.49 0.14 0.00 0.00 176.91 179.44 1jhd h GLU 217 N 0.99 0.39 0.00 0.39 4.81 -0.78 -0.06 114.58 120.32 1jhd h GLU 217 Ca 0.21 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 59.22 1jhd h GLU 217 Cb 0.33 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1jhd h GLU 217 CO -0.00 0.60 -0.43 0.66 -0.73 0.00 0.00 179.01 179.11 1jhd h SER 218 N 0.14 0.00 0.43 1.04 4.64 -0.80 -2.34 113.55 116.66 1jhd h SER 218 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1jhd h SER 218 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 1jhd h SER 218 CO 0.01 0.43 -0.38 0.18 -0.87 0.00 0.00 176.83 176.20 1jhd n LEU 219 N -3.63 0.64 -3.74 5.97 4.77 -0.24 -4.93 117.00 115.84 1jhd n LEU 219 Ca -0.01 -0.06 -0.26 0.00 -0.03 0.00 0.00 56.01 55.66 1jhd n LEU 219 Cb 0.53 -0.22 0.05 0.00 -2.33 0.00 0.00 43.42 41.45 1jhd n LEU 219 CO 0.38 0.14 0.15 -0.67 -1.33 0.00 0.00 177.39 176.06 1jhd n ASP 220 N -1.21 -4.93 -4.82 -1.43 2.03 -0.41 -4.96 116.55 100.81 1jhd n ASP 220 Ca 0.08 -0.68 -0.33 0.00 0.52 0.00 0.00 54.79 54.39 1jhd n ASP 220 Cb 0.34 -4.44 -0.03 0.00 -0.72 0.00 0.00 41.12 36.27 1jhd n ASP 220 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1jhd s ALA 221 N -3.35 2.96 -0.08 -1.67 0.00 -0.17 -4.86 121.76 114.60 1jhd s ALA 221 Ca 0.53 0.33 0.14 0.00 0.00 0.00 0.00 51.96 52.96 1jhd s ALA 221 Cb -0.25 -3.17 -0.08 0.00 0.00 0.00 0.00 23.12 19.62 1jhd s ALA 221 CO 0.78 -0.29 1.13 -0.44 0.00 0.00 0.00 175.76 176.94 1jhd h ASP 222 N 1.11 0.00 -5.22 0.00 3.32 -0.95 -3.46 116.42 111.23 1jhd h ASP 222 Ca -0.48 0.00 0.14 0.00 0.02 0.00 0.00 57.03 56.72 1jhd h ASP 222 Cb 1.20 0.00 -0.07 0.00 0.22 0.00 0.00 39.33 40.68 1jhd h ASP 222 CO 0.60 0.67 0.40 -0.83 -1.72 0.00 0.00 179.24 178.36 1jhd s GLY 223 N -4.68 -0.18 -0.07 2.75 0.00 -1.21 -4.57 107.32 99.35 1jhd s GLY 223 Ca 0.00 -0.02 0.04 0.00 0.00 0.00 0.00 44.72 44.74 1jhd s GLY 223 CO 0.79 -0.03 -0.19 0.14 0.00 0.00 0.00 173.10 173.81 1jhd s VAL 224 N -3.50 2.59 -0.33 1.40 1.01 0.59 -1.54 120.40 120.64 1jhd s VAL 224 Ca 0.12 -0.87 -0.07 0.00 0.00 0.00 0.00 61.98 61.16 1jhd s VAL 224 Cb -0.03 -2.01 0.03 0.00 0.00 0.00 0.00 36.38 34.37 1jhd s VAL 224 CO 0.04 0.56 0.10 -0.69 0.00 0.00 0.00 175.10 175.11 1jhd s VAL 225 N -0.18 3.88 -0.22 2.92 1.01 -0.18 -1.11 120.40 126.51 1jhd s VAL 225 Ca -0.02 -0.97 -0.28 0.00 0.00 0.00 0.00 61.98 60.72 1jhd s VAL 225 Cb -0.13 -3.13 0.00 0.00 0.00 0.00 0.00 36.38 33.12 1jhd s VAL 225 CO 0.03 -0.09 0.98 -0.69 0.00 0.00 0.00 175.10 175.33 1jhd s VAL 226 N 1.44 4.74 -0.45 2.92 1.01 0.17 -1.68 120.40 128.53 1jhd s VAL 226 Ca -0.00 1.91 0.04 0.00 0.00 0.00 0.00 61.98 63.92 1jhd s VAL 226 Cb -0.19 -4.26 0.12 0.00 0.00 0.00 0.00 36.38 32.06 1jhd s VAL 226 CO 0.03 -0.13 0.19 -2.28 0.00 0.00 0.00 175.10 172.91 1jhd s HIS 227 N 2.95 3.21 0.24 5.22 2.46 -0.28 -0.72 115.29 128.37 1jhd s HIS 227 Ca 0.42 -3.02 -0.30 0.00 0.47 0.00 0.00 55.06 52.63 1jhd s HIS 227 Cb -0.15 -2.74 -0.09 0.00 -0.13 0.00 0.00 32.58 29.46 1jhd s HIS 227 CO 0.08 -0.81 0.96 -1.64 -2.47 0.00 0.00 174.74 170.86 1jhd s MET 228 N 0.16 4.83 -0.30 2.88 -1.94 0.55 -3.69 119.30 121.78 1jhd s MET 228 Ca 0.15 1.52 -0.27 0.00 -1.71 0.00 0.00 55.69 55.39 1jhd s MET 228 Cb -0.24 -3.28 0.01 0.00 2.01 0.00 0.00 34.83 33.34 1jhd s MET 228 CO -0.03 0.47 0.96 -1.17 -0.01 0.00 0.00 175.02 175.24 1jhd s LEU 229 N -1.14 4.02 0.14 -0.03 2.96 -1.13 -0.84 118.68 122.64 1jhd s LEU 229 Ca 0.42 0.96 -0.11 0.00 -0.22 0.00 0.00 54.13 55.18 1jhd s LEU 229 Cb -0.27 -3.37 -0.06 0.00 0.50 0.00 0.00 46.19 42.99 1jhd s LEU 229 CO 0.33 -0.75 0.48 -0.76 -1.32 0.00 0.00 176.35 174.33 1jhd s LEU 230 N 3.32 4.30 0.00 -0.68 1.43 0.09 -4.83 118.68 122.31 1jhd s LEU 230 Ca 0.40 0.90 -0.09 0.00 -1.03 0.00 0.00 54.13 54.31 1jhd s LEU 230 Cb -0.13 -3.26 0.03 0.00 0.03 0.00 0.00 46.19 42.86 1jhd s LEU 230 CO 0.13 0.08 0.43 0.61 0.23 0.00 0.00 176.35 177.83 1jhd n GLY 231 N 0.57 0.83 3.80 -3.19 0.00 -1.26 -4.31 105.19 101.62 1jhd n GLY 231 Ca -0.05 -0.98 -0.35 0.00 0.00 0.00 0.00 46.02 44.65 1jhd n GLY 231 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1jhd s LYS 232 N -2.01 4.04 0.15 1.61 -0.14 -1.26 -4.99 119.74 117.14 1jhd s LYS 232 Ca 0.10 1.35 -0.31 0.00 -1.36 0.00 0.00 55.97 55.75 1jhd s LYS 232 Cb -0.01 -2.28 -0.08 0.00 -1.68 0.00 0.00 37.83 33.78 1jhd s LYS 232 CO 0.01 -0.22 1.32 -1.17 -0.76 0.00 0.00 175.35 174.53 1jhd s LEU 233 N -3.10 4.40 0.31 3.17 2.96 -1.26 -5.02 118.68 120.13 1jhd s LEU 233 Ca 0.63 2.32 0.09 0.00 -0.22 0.00 0.00 54.13 56.94 1jhd s LEU 233 Cb -0.16 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 42.89 1jhd s LEU 233 CO 0.21 -0.56 0.10 -0.54 -1.32 0.00 0.00 176.35 174.24 1jhd s LYS 234 N 0.46 2.41 0.01 1.98 -0.14 -1.26 -5.02 119.74 118.18 1jhd s LYS 234 Ca 0.60 -1.45 -0.37 0.00 -1.36 0.00 0.00 55.97 53.38 1jhd s LYS 234 Cb -0.35 -2.21 -0.16 0.00 -1.68 0.00 0.00 37.83 33.42 1jhd s LYS 234 CO 0.34 0.23 1.47 1.17 -0.76 0.00 0.00 175.35 177.80 1jhd n LYS 235 N -1.07 1.31 0.00 1.68 3.00 -1.26 -0.71 118.16 121.11 1jhd n LYS 235 Ca -0.05 0.47 0.00 0.00 -0.00 0.00 0.00 58.31 58.74 1jhd n LYS 235 Cb 0.60 -2.15 0.00 0.00 0.00 0.00 0.00 35.03 33.48 1jhd n LYS 235 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1jhd n GLY 236 N 3.04 3.05 3.73 3.14 0.00 -1.26 -5.03 105.19 111.87 1jhd n GLY 236 Ca 0.20 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 1jhd n GLY 236 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1jhd s ASP 237 N -1.24 4.61 -0.06 1.61 1.01 0.11 -4.99 116.67 117.72 1jhd s ASP 237 Ca 0.00 2.45 -0.23 0.00 0.71 0.00 0.00 52.55 55.48 1jhd s ASP 237 Cb 0.00 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.29 1jhd s ASP 237 CO 0.00 -1.99 0.68 -0.63 0.21 0.00 0.00 175.17 173.44 1jhd s ILE 238 N -1.69 5.02 0.44 0.77 1.01 -1.26 -4.92 121.20 120.57 1jhd s ILE 238 Ca 0.78 1.41 -0.25 0.00 0.00 0.00 0.00 60.65 62.59 1jhd s ILE 238 Cb -0.32 -4.02 -0.09 0.00 0.01 0.00 0.00 42.46 38.03 1jhd s ILE 238 CO 0.40 0.28 1.18 -2.65 0.00 0.00 0.00 174.94 174.15 1jhd n PRO 239 N 3.61 1.69 -0.33 2.79 -0.02 -1.26 -4.70 135.00 136.79 1jhd n PRO 239 Ca -0.02 0.61 0.09 0.00 -2.02 0.00 0.00 63.50 62.15 1jhd n PRO 239 Cb 0.51 -2.28 0.25 0.00 -0.02 0.00 0.00 33.50 31.96 1jhd n PRO 239 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1jhd h ALA 240 N 1.81 1.46 -0.79 3.55 0.00 -1.98 -1.17 119.26 122.15 1jhd h ALA 240 Ca -0.47 0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.58 1jhd h ALA 240 Cb 1.31 -0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.95 1jhd h ALA 240 CO 0.58 0.03 0.51 -1.35 0.00 0.00 0.00 179.25 179.03 1jhd h PRO 241 N 0.79 0.75 -0.00 0.00 0.11 -1.99 0.76 132.00 132.43 1jhd h PRO 241 Ca 0.50 -0.05 -0.12 0.00 0.11 0.00 0.00 66.00 66.45 1jhd h PRO 241 Cb 0.66 -0.17 0.01 0.00 0.11 0.00 0.00 31.00 31.61 1jhd h PRO 241 CO -0.33 0.50 -0.46 0.28 -0.21 0.00 0.00 178.00 177.77 1jhd h VAL 242 N 0.77 1.47 -0.34 3.15 2.07 -1.62 -1.87 116.25 119.90 1jhd h VAL 242 Ca 0.35 -2.03 -0.01 0.00 0.82 0.00 0.00 66.70 65.83 1jhd h VAL 242 Cb 0.36 2.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.78 1jhd h VAL 242 CO -0.13 0.58 0.15 -0.09 0.02 0.00 0.00 177.57 178.10 1jhd h ARG 243 N -0.26 0.49 -0.63 1.57 1.12 -0.68 0.15 114.38 116.14 1jhd h ARG 243 Ca -0.06 -0.08 0.02 0.00 -1.11 0.00 0.00 59.98 58.75 1jhd h ARG 243 Cb 1.19 -0.09 -0.04 0.00 -0.01 0.00 0.00 29.97 31.03 1jhd h ARG 243 CO 0.09 0.46 0.40 -0.44 -3.11 0.00 0.00 179.97 177.37 1jhd h ASP 244 N 0.41 0.67 -0.65 -3.80 5.19 0.48 -1.41 116.42 117.31 1jhd h ASP 244 Ca 0.11 -0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.47 1jhd h ASP 244 Cb 0.14 -0.15 -0.03 0.00 0.18 0.00 0.00 39.33 39.47 1jhd h ASP 244 CO -0.01 0.48 0.22 0.00 -3.12 0.00 0.00 179.24 176.80 1jhd h ALA 245 N 1.26 0.85 -0.65 3.45 0.00 -0.90 -0.26 119.26 123.00 1jhd h ALA 245 Ca 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1jhd h ALA 245 Cb -0.03 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.48 1jhd h ALA 245 CO -0.08 0.51 0.41 0.00 0.00 0.00 0.00 179.25 180.09 1jhd h ALA 246 N 1.09 0.83 -0.23 0.00 0.00 -0.55 -0.76 119.26 119.63 1jhd h ALA 246 Ca 0.21 -0.06 -0.20 0.00 0.00 0.00 0.00 54.91 54.86 1jhd h ALA 246 Cb 0.27 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1jhd h ALA 246 CO -0.01 0.28 -0.64 0.82 0.00 0.00 0.00 179.25 179.70 1jhd h ILE 247 N 0.88 1.28 -0.46 0.00 2.04 -0.99 -2.18 117.51 118.09 1jhd h ILE 247 Ca 0.24 -1.82 -0.06 0.00 1.00 0.00 0.00 64.86 64.22 1jhd h ILE 247 Cb -0.06 1.78 -0.02 0.00 -0.74 0.00 0.00 36.82 37.78 1jhd h ILE 247 CO -0.05 0.59 0.05 0.03 0.00 0.00 0.00 178.15 178.77 1jhd h ARG 248 N 0.60 0.72 -0.36 2.37 3.08 -0.89 -1.10 114.38 118.80 1jhd h ARG 248 Ca -0.01 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 59.82 1jhd h ARG 248 Cb 1.25 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 31.19 1jhd h ARG 248 CO 0.14 0.70 0.03 1.15 -1.07 0.00 0.00 179.97 180.91 1jhd h THR 249 N 0.68 1.25 -0.42 2.04 2.02 -1.12 0.16 112.91 117.53 1jhd h THR 249 Ca 0.14 -0.92 0.05 0.00 0.77 0.00 0.00 66.41 66.45 1jhd h THR 249 Cb 0.35 1.15 -0.05 0.00 -1.74 0.00 0.00 68.15 67.87 1jhd h THR 249 CO 0.01 0.31 0.16 -0.03 0.37 0.00 0.00 175.52 176.34 1jhd h MET 250 N 0.44 0.33 -0.50 6.66 1.85 -1.13 -0.70 114.93 121.89 1jhd h MET 250 Ca 0.11 -0.02 -0.02 0.00 -0.61 0.00 0.00 59.70 59.16 1jhd h MET 250 Cb 0.41 -0.07 -0.02 0.00 0.43 0.00 0.00 31.60 32.35 1jhd h MET 250 CO 0.01 0.22 0.23 0.00 -0.40 0.00 0.00 176.91 176.97 1jhd h ALA 251 N 1.27 0.64 -0.40 0.39 0.00 -0.89 -0.83 119.26 119.44 1jhd h ALA 251 Ca 0.19 -0.13 -0.12 0.00 0.00 0.00 0.00 54.91 54.86 1jhd h ALA 251 Cb 0.17 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1jhd h ALA 251 CO -0.19 0.21 -0.23 1.49 0.00 0.00 0.00 179.25 180.54 1jhd h GLU 252 N 0.66 0.86 0.07 0.00 4.57 -0.41 -2.72 114.58 117.61 1jhd h GLU 252 Ca 0.17 -0.39 -0.30 0.00 -1.18 0.00 0.00 59.36 57.66 1jhd h GLU 252 Cb 0.13 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.68 1jhd h GLU 252 CO -0.02 1.03 -1.60 0.28 -1.18 0.00 0.00 179.01 177.53 1jhd h VAL 253 N 0.67 1.04 0.00 0.32 2.07 -1.11 -3.41 116.25 115.82 1jhd h VAL 253 Ca 0.08 -2.77 0.00 0.00 0.82 0.00 0.00 66.70 64.83 1jhd h VAL 253 Cb 0.80 2.62 0.00 0.00 -1.52 0.00 0.00 31.29 33.19 1jhd h VAL 253 CO 0.07 0.74 -0.80 -1.22 0.02 0.00 0.00 177.57 176.38 1jhd n TYR 254 N -3.31 0.00 -3.81 1.57 4.01 -0.32 -4.98 117.16 110.31 1jhd n TYR 254 Ca -0.17 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.26 1jhd n TYR 254 Cb 1.03 -0.07 -0.04 0.00 -0.31 0.00 0.00 39.34 39.95 1jhd n TYR 254 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 1jhd s PHE 255 N -2.26 3.50 0.87 -0.72 0.40 -1.03 -5.05 117.98 113.69 1jhd s PHE 255 Ca 0.02 0.37 -0.10 0.00 -0.60 0.00 0.00 56.93 56.61 1jhd s PHE 255 Cb 0.08 -1.85 0.12 0.00 0.51 0.00 0.00 43.02 41.87 1jhd s PHE 255 CO 0.47 0.51 1.12 -2.14 0.70 0.00 0.00 175.22 175.89 1jhd s PRO 256 N -2.64 1.43 0.33 0.24 0.02 -1.26 -4.87 135.00 128.24 1jhd s PRO 256 Ca 0.37 1.39 -0.28 0.00 0.02 0.00 0.00 61.00 62.50 1jhd s PRO 256 Cb -0.12 -1.79 -0.12 0.00 0.02 0.00 0.00 34.50 32.48 1jhd s PRO 256 CO 0.27 -2.30 1.30 -2.30 -0.33 0.00 0.00 177.00 173.64 1jhd n PRO 257 N -3.99 2.10 -3.62 5.54 -0.02 -1.26 -3.09 135.00 130.66 1jhd n PRO 257 Ca 0.11 0.74 -0.20 0.00 -2.02 0.00 0.00 63.50 62.12 1jhd n PRO 257 Cb 0.52 -2.32 0.05 0.00 -0.02 0.00 0.00 33.50 31.73 1jhd n PRO 257 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 1jhd n ASN 258 N 0.98 -1.70 0.00 2.55 5.15 -1.26 -4.93 115.26 116.04 1jhd n ASN 258 Ca 0.06 -0.75 0.00 0.00 -0.60 0.00 0.00 54.58 53.29 1jhd n ASN 258 Cb 0.35 -4.41 0.00 0.00 -0.53 0.00 0.00 39.78 35.19 1jhd n ASN 258 CO 0.00 0.00 0.00 0.35 1.40 0.00 0.00 177.26 179.01 1jhd n THR 259 N -4.26 0.00 -3.80 -0.44 -2.24 -1.18 -4.79 114.28 97.57 1jhd n THR 259 Ca -0.28 -0.18 -0.13 0.00 -2.27 0.00 0.00 64.05 61.20 1jhd n THR 259 Cb 0.67 1.45 -0.13 0.00 -2.10 0.00 0.00 70.33 70.21 1jhd n THR 259 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1jhd s VAL 260 N -0.11 -0.02 -0.06 2.28 1.01 -1.26 -0.30 120.40 121.94 1jhd s VAL 260 Ca 0.00 0.06 0.05 0.00 0.00 0.00 0.00 61.98 62.10 1jhd s VAL 260 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 36.38 36.16 1jhd s VAL 260 CO 0.00 0.03 -0.23 -0.04 0.00 0.00 0.00 175.10 174.85 1jhd s MET 261 N 0.46 2.63 -0.26 2.72 -1.94 -0.27 -4.97 119.30 117.66 1jhd s MET 261 Ca -0.03 -0.87 -0.07 0.00 -1.71 0.00 0.00 55.69 53.00 1jhd s MET 261 Cb -0.05 -2.22 -0.02 0.00 2.01 0.00 0.00 34.83 34.56 1jhd s MET 261 CO -0.02 0.38 0.08 0.08 -0.01 0.00 0.00 175.02 175.53 1jhd s VAL 262 N -0.15 4.28 0.33 -6.03 1.01 -1.26 -0.66 120.40 117.92 1jhd s VAL 262 Ca -0.04 -0.29 0.04 0.00 0.00 0.00 0.00 61.98 61.69 1jhd s VAL 262 Cb -0.14 -3.06 -0.02 0.00 0.00 0.00 0.00 36.38 33.17 1jhd s VAL 262 CO 0.04 0.27 0.34 0.42 0.00 0.00 0.00 175.10 176.17 1jhd s THR 263 N 1.60 0.00 0.21 3.92 -4.23 0.10 -4.89 115.64 112.35 1jhd s THR 263 Ca 0.06 -1.86 -0.13 0.00 -1.18 0.00 0.00 61.69 58.58 1jhd s THR 263 Cb -0.16 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.13 1jhd s THR 263 CO 0.04 0.00 0.43 -0.83 -0.54 0.00 0.00 174.62 173.72 1jhd s GLY 264 N -3.32 0.35 0.18 3.99 0.00 0.34 -0.33 107.32 108.53 1jhd s GLY 264 Ca 0.37 -0.70 -0.05 0.00 0.00 0.00 0.00 44.72 44.34 1jhd s GLY 264 CO 0.24 -0.59 0.21 -2.52 0.00 0.00 0.00 173.10 170.45 1jhd s TYR 265 N -3.96 0.77 -0.12 1.90 1.13 -0.02 -1.42 117.35 115.62 1jhd s TYR 265 Ca 0.17 -1.09 0.03 0.00 -1.41 0.00 0.00 57.07 54.77 1jhd s TYR 265 Cb 0.00 -0.29 0.01 0.00 -1.10 0.00 0.00 41.96 40.58 1jhd s TYR 265 CO 0.03 -0.69 -0.20 0.20 -2.51 0.00 0.00 175.55 172.37 1jhd s GLY 266 N -3.06 1.23 -0.05 5.49 0.00 -1.26 -0.73 107.32 108.94 1jhd s GLY 266 Ca 0.28 -0.92 -0.30 0.00 0.00 0.00 0.00 44.72 43.77 1jhd s GLY 266 CO 0.06 -0.04 0.97 -0.12 0.00 0.00 0.00 173.10 173.97 1jhd s PHE 267 N 0.71 -0.29 -0.22 1.90 5.36 -1.26 -4.38 117.98 119.80 1jhd s PHE 267 Ca -0.11 0.17 -0.12 0.00 -0.96 0.00 0.00 56.93 55.91 1jhd s PHE 267 Cb -0.16 0.53 -0.05 0.00 -0.34 0.00 0.00 43.02 43.01 1jhd s PHE 267 CO 0.02 -0.46 0.22 -0.51 -1.46 0.00 0.00 175.22 173.03 1jhd s ASP 268 N -2.42 6.23 0.40 6.13 1.01 -1.26 -4.85 116.67 121.92 1jhd s ASP 268 Ca 0.06 0.26 -0.27 0.00 0.71 0.00 0.00 52.55 53.31 1jhd s ASP 268 Cb -0.01 -2.14 -0.10 0.00 1.01 0.00 0.00 42.92 41.68 1jhd s ASP 268 CO -0.08 0.05 1.46 -0.32 0.21 0.00 0.00 175.17 176.50 1jhd s MET 269 N 0.97 3.98 0.14 8.23 -2.45 -1.26 -4.91 119.30 123.99 1jhd s MET 269 Ca 0.11 2.51 0.20 0.00 -1.25 0.00 0.00 55.69 57.27 1jhd s MET 269 Cb -0.13 -2.87 -0.07 0.00 1.25 0.00 0.00 34.83 33.00 1jhd s MET 269 CO 0.04 -0.61 0.92 1.28 1.05 0.00 0.00 175.02 177.70 1jhd n LEU 270 N 0.26 0.79 -3.14 4.11 4.77 -1.26 -4.94 117.00 117.60 1jhd n LEU 270 Ca 0.02 0.32 -0.23 0.00 -0.03 0.00 0.00 56.01 56.10 1jhd n LEU 270 Cb 0.40 -0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.51 1jhd n LEU 270 CO 0.62 -0.05 -0.00 -1.22 -1.33 0.00 0.00 177.39 175.40 1jhd n TYR 271 N -2.73 -1.95 0.77 -1.77 4.01 -1.26 -4.04 117.16 110.19 1jhd n TYR 271 Ca -0.04 0.52 0.11 0.00 -0.16 0.00 0.00 57.90 58.33 1jhd n TYR 271 Cb 0.66 -4.08 0.29 0.00 -0.31 0.00 0.00 39.34 35.90 1jhd n TYR 271 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1jhd n ALA 272 N -3.59 2.47 -0.96 -0.72 0.00 -1.18 -4.39 120.51 112.13 1jhd n ALA 272 Ca -0.08 -0.75 0.00 0.00 0.00 0.00 0.00 53.44 52.61 1jhd n ALA 272 Cb 0.60 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 19.06 1jhd n ALA 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jhd n GLY 273 N 1.30 3.65 0.35 0.00 0.00 0.04 -3.40 105.19 107.12 1jhd n GLY 273 Ca 0.17 -0.07 -0.01 0.00 0.00 0.00 0.00 46.02 46.11 1jhd n GLY 273 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1jhd h PRO 274 N 0.00 -0.05 -0.11 1.61 0.11 -1.86 0.12 132.00 131.82 1jhd h PRO 274 Ca 0.00 0.00 -0.06 0.00 0.11 0.00 0.00 66.00 66.06 1jhd h PRO 274 Cb 0.00 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.11 1jhd h PRO 274 CO 0.00 -0.04 -0.20 -0.09 -0.21 0.00 0.00 178.00 177.47 1jhd h ARG 275 N -0.06 0.17 -0.16 1.05 9.65 -1.76 -1.90 114.38 121.37 1jhd h ARG 275 Ca 0.32 -0.05 -0.14 0.00 -1.10 0.00 0.00 59.98 59.02 1jhd h ARG 275 Cb 0.59 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.14 1jhd h ARG 275 CO -0.86 0.37 -0.50 1.49 2.80 0.00 0.00 179.97 183.27 1jhd h GLU 276 N 0.16 0.44 -0.70 0.20 4.81 -1.04 -2.00 114.58 116.45 1jhd h GLU 276 Ca 0.03 -0.26 0.01 0.00 -0.13 0.00 0.00 59.36 59.01 1jhd h GLU 276 Cb 0.45 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.81 1jhd h GLU 276 CO 0.03 0.84 0.46 0.00 -0.73 0.00 0.00 179.01 179.61 1jhd h ALA 277 N 1.11 1.50 -0.39 2.92 0.00 -0.12 0.23 119.26 124.51 1jhd h ALA 277 Ca 0.01 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.78 1jhd h ALA 277 Cb 1.01 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1jhd h ALA 277 CO 0.09 0.47 -0.11 0.28 0.00 0.00 0.00 179.25 179.98 1jhd h VAL 278 N 0.95 1.28 -0.63 0.00 2.07 -1.04 -1.33 116.25 117.54 1jhd h VAL 278 Ca 0.26 -1.20 0.01 0.00 0.82 0.00 0.00 66.70 66.59 1jhd h VAL 278 Cb -0.11 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1jhd h VAL 278 CO -0.05 0.40 0.41 0.25 0.02 0.00 0.00 177.57 178.60 1jhd h LEU 279 N 0.57 0.70 -0.75 2.57 5.85 -0.70 -0.95 115.31 122.60 1jhd h LEU 279 Ca 0.10 -0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.87 1jhd h LEU 279 Cb 0.63 -0.17 -0.06 0.00 0.37 0.00 0.00 40.66 41.44 1jhd h LEU 279 CO 0.04 0.50 0.44 0.45 -0.34 0.00 0.00 178.44 179.53 1jhd h HIS 280 N 0.83 0.81 -0.44 1.25 3.86 -0.31 -1.71 115.15 119.44 1jhd h HIS 280 Ca 0.24 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 59.45 1jhd h HIS 280 Cb -0.06 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 28.14 1jhd h HIS 280 CO -0.04 0.39 0.16 0.00 0.86 0.00 0.00 177.93 179.30 1jhd h ALA 281 N 1.38 0.57 -0.15 2.45 0.00 -0.71 -1.92 119.26 120.88 1jhd h ALA 281 Ca 0.34 -0.16 0.05 0.00 0.00 0.00 0.00 54.91 55.14 1jhd h ALA 281 Cb 0.20 -0.17 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 1jhd h ALA 281 CO -0.19 0.19 -0.26 -0.92 0.00 0.00 0.00 179.25 178.07 1jhd h TYR 282 N 0.56 -0.69 0.00 0.00 5.03 -0.60 -0.54 116.97 120.72 1jhd h TYR 282 Ca 0.14 0.03 0.00 0.00 2.58 0.00 0.00 58.73 61.49 1jhd h TYR 282 Cb 0.22 0.33 0.00 0.00 1.55 0.00 0.00 36.73 38.83 1jhd h TYR 282 CO 0.01 -0.34 0.00 0.27 -1.32 0.00 0.00 178.16 176.78 1jhd h PHE 283 N -0.31 0.00 -0.13 -3.82 -0.00 -1.28 -2.39 116.94 109.01 1jhd h PHE 283 Ca 0.11 0.00 -0.14 0.00 -0.00 0.00 0.00 57.97 57.94 1jhd h PHE 283 Cb 0.48 0.00 -0.01 0.00 -0.00 0.00 0.00 35.95 36.42 1jhd h PHE 283 CO -0.37 0.00 -0.53 0.00 -0.00 0.00 0.00 178.31 177.41 1jhd h ARG 284 N 0.00 0.36 -0.53 6.09 -0.00 -1.02 -1.71 114.38 117.57 1jhd h ARG 284 Ca 0.00 -0.22 -0.10 0.00 -0.50 0.00 0.00 59.98 59.16 1jhd h ARG 284 Cb 0.89 0.02 -0.02 0.00 0.00 0.00 0.00 29.97 30.86 1jhd h ARG 284 CO 0.00 0.80 -0.05 0.37 0.00 0.00 0.00 179.97 181.09 1jhd h GLN 285 N 0.28 0.97 0.00 0.04 4.15 -0.62 -1.18 115.11 118.75 1jhd h GLN 285 Ca 0.01 -0.33 -0.03 0.00 0.77 0.00 0.00 58.65 59.07 1jhd h GLN 285 Cb 1.03 -0.07 -0.00 0.00 0.21 0.00 0.00 27.48 28.64 1jhd h GLN 285 CO 0.09 1.00 -0.13 -0.91 -1.93 0.00 0.00 178.83 176.95 1jhd h ASN 286 N 0.84 0.00 0.20 -0.69 2.35 -1.17 -0.71 115.58 116.39 1jhd h ASN 286 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1jhd h ASN 286 Cb 0.60 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.97 1jhd h ASN 286 CO 0.04 0.13 -0.11 1.15 -1.65 0.00 0.00 177.43 176.98 1jhd n MET 287 N -3.89 0.99 0.00 0.81 0.00 -0.67 -4.77 117.12 109.60 1jhd n MET 287 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 57.70 57.23 1jhd n MET 287 Cb 0.22 -1.49 0.00 0.00 0.00 0.00 0.00 33.22 31.95 1jhd n MET 287 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1jhd n GLY 288 N 1.24 0.88 3.80 3.17 0.00 -0.27 -2.97 105.19 111.05 1jhd n GLY 288 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 1jhd n GLY 288 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhd s ALA 289 N -2.00 3.36 -0.31 4.61 0.00 -0.47 -4.68 121.76 122.27 1jhd s ALA 289 Ca 0.00 0.27 0.22 0.00 0.00 0.00 0.00 51.96 52.45 1jhd s ALA 289 Cb 0.00 -2.92 -0.11 0.00 0.00 0.00 0.00 23.12 20.09 1jhd s ALA 289 CO 0.00 0.29 0.83 0.25 0.00 0.00 0.00 175.76 177.13 1jhd n THR 290 N 0.74 0.24 -3.90 0.00 -2.24 -0.28 -4.31 114.28 104.53 1jhd n THR 290 Ca -0.01 -0.41 -0.11 0.00 -2.27 0.00 0.00 64.05 61.24 1jhd n THR 290 Cb 0.51 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.62 1jhd n THR 290 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1jhd s HIS 291 N -3.35 0.07 -0.04 4.78 3.76 -0.84 -1.27 115.29 118.41 1jhd s HIS 291 Ca -0.02 -0.14 0.02 0.00 -0.15 0.00 0.00 55.06 54.77 1jhd s HIS 291 Cb 0.13 -0.07 0.01 0.00 1.11 0.00 0.00 32.58 33.76 1jhd s HIS 291 CO 0.84 -0.15 -0.08 0.12 -0.85 0.00 0.00 174.74 174.62 1jhd s PHE 292 N -0.84 0.93 -0.06 1.40 5.36 -0.04 -0.90 117.98 123.82 1jhd s PHE 292 Ca -0.09 -0.26 -0.26 0.00 -0.96 0.00 0.00 56.93 55.36 1jhd s PHE 292 Cb -0.06 -0.70 -0.03 0.00 -0.34 0.00 0.00 43.02 41.89 1jhd s PHE 292 CO 0.00 -0.14 0.82 0.42 -1.46 0.00 0.00 175.22 174.85 1jhd s ILE 293 N 0.45 4.96 -0.15 3.12 1.01 -0.89 -0.74 121.20 128.97 1jhd s ILE 293 Ca -0.07 1.68 -0.01 0.00 0.00 0.00 0.00 60.65 62.25 1jhd s ILE 293 Cb -0.11 -4.15 0.04 0.00 0.01 0.00 0.00 42.46 38.25 1jhd s ILE 293 CO 0.01 0.18 -0.04 -0.63 0.00 0.00 0.00 174.94 174.46 1jhd s ILE 294 N 1.10 0.93 0.00 2.92 1.01 -0.38 -4.75 121.20 122.03 1jhd s ILE 294 Ca 0.42 -0.49 0.00 0.00 0.00 0.00 0.00 60.65 60.59 1jhd s ILE 294 Cb -0.19 -1.13 0.00 0.00 0.01 0.00 0.00 42.46 41.15 1jhd s ILE 294 CO 0.20 0.13 0.00 0.61 0.00 0.00 0.00 174.94 175.88 1jhd n GLY 295 N 4.94 2.63 3.77 6.18 0.00 -1.26 -0.70 105.19 120.75 1jhd n GLY 295 Ca -0.11 -2.06 -0.41 0.00 0.00 0.00 0.00 46.02 43.45 1jhd n GLY 295 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1jhd s ARG 296 N 1.93 4.42 -1.49 1.61 0.52 -1.26 -3.23 118.95 121.46 1jhd s ARG 296 Ca 0.00 2.11 -0.13 0.00 -0.52 0.00 0.00 55.73 57.19 1jhd s ARG 296 Cb 0.00 -3.10 0.09 0.00 0.52 0.00 0.00 34.95 32.46 1jhd s ARG 296 CO 0.00 -0.09 0.79 -3.47 0.02 0.00 0.00 175.30 172.55 1jhd n ASP 297 N 0.89 -4.42 -4.68 0.23 2.03 0.14 -4.87 116.55 105.87 1jhd n ASP 297 Ca -0.00 -0.66 -0.45 0.00 0.52 0.00 0.00 54.79 54.19 1jhd n ASP 297 Cb 0.43 -3.57 -0.03 0.00 -0.72 0.00 0.00 41.12 37.22 1jhd n ASP 297 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 1jhd n HIS 298 N -4.42 2.30 -1.50 -0.67 -0.00 -1.20 -1.60 115.22 108.13 1jhd n HIS 298 Ca 0.02 0.32 -0.17 0.00 -0.00 0.00 0.00 57.72 57.89 1jhd n HIS 298 Cb 0.53 -2.52 -0.07 0.00 -0.00 0.00 0.00 29.99 27.93 1jhd n HIS 298 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1jhd n ALA 299 N 2.70 -0.27 -1.99 1.57 0.00 -1.26 -4.26 120.51 117.01 1jhd n ALA 299 Ca 0.14 0.28 -0.24 0.00 0.00 0.00 0.00 53.44 53.62 1jhd n ALA 299 Cb 0.31 -1.85 0.12 0.00 0.00 0.00 0.00 19.45 18.03 1jhd n ALA 299 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1jhd s GLY 300 N -2.54 1.76 0.05 0.00 0.00 -0.63 -0.78 107.32 105.18 1jhd s GLY 300 Ca 0.00 -1.72 -0.18 0.00 0.00 0.00 0.00 44.72 42.82 1jhd s GLY 300 CO 0.00 -1.13 0.42 0.54 0.00 0.00 0.00 173.10 172.94 1jhd s VAL 301 N -3.20 0.05 0.00 1.40 0.11 -1.26 -4.89 120.40 112.62 1jhd s VAL 301 Ca 0.67 -0.44 0.00 0.00 -2.93 0.00 0.00 61.98 59.28 1jhd s VAL 301 Cb -0.05 -0.97 0.00 0.00 -1.53 0.00 0.00 36.38 33.83 1jhd s VAL 301 CO 0.45 -0.24 0.00 0.61 -3.33 0.00 0.00 175.10 172.59 1jhd n GLY 302 N 0.43 2.01 0.56 6.54 0.00 -1.26 -3.34 105.19 110.14 1jhd n GLY 302 Ca -0.18 -0.42 0.08 0.00 0.00 0.00 0.00 46.02 45.50 1jhd n GLY 302 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1jhd n ASP 303 N -0.96 3.10 0.17 1.61 4.64 -1.26 -4.76 116.55 119.09 1jhd n ASP 303 Ca 0.00 -3.13 0.03 0.00 -1.38 0.00 0.00 54.79 50.31 1jhd n ASP 303 Cb 0.00 -0.50 0.28 0.00 -1.04 0.00 0.00 41.12 39.85 1jhd n ASP 303 CO 0.00 0.00 0.00 1.88 -0.82 0.00 0.00 177.20 178.26 1jhd h TYR 304 N 0.99 0.00 -4.18 -0.67 0.05 -1.99 -3.45 116.97 107.72 1jhd h TYR 304 Ca 0.01 0.00 -0.68 0.00 0.05 0.00 0.00 58.73 58.12 1jhd h TYR 304 Cb 1.26 0.00 -0.25 0.00 1.01 0.00 0.00 36.73 38.75 1jhd h TYR 304 CO 0.34 0.47 -0.87 0.71 -1.05 0.00 0.00 178.16 177.75 1jhd s TYR 305 N -3.68 2.25 0.55 4.88 2.02 -1.26 -5.04 117.35 117.06 1jhd s TYR 305 Ca -0.01 -0.40 -0.19 0.00 -0.37 0.00 0.00 57.07 56.10 1jhd s TYR 305 Cb 0.12 -1.31 -0.06 0.00 -0.40 0.00 0.00 41.96 40.31 1jhd s TYR 305 CO 0.72 0.18 1.10 0.20 -1.57 0.00 0.00 175.55 176.18 1jhd s GLY 306 N -1.47 2.52 0.24 0.71 0.00 -1.26 -4.96 107.32 103.10 1jhd s GLY 306 Ca 0.12 0.71 -0.07 0.00 0.00 0.00 0.00 44.72 45.49 1jhd s GLY 306 CO 0.03 1.06 1.66 0.00 0.00 0.00 0.00 173.10 175.85 1jhd h ALA 307 N 1.10 0.84 -0.54 3.20 0.00 -1.99 -2.53 119.26 119.34 1jhd h ALA 307 Ca -0.49 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1jhd h ALA 307 Cb 1.25 0.31 0.00 0.00 0.00 0.00 0.00 17.79 19.35 1jhd h ALA 307 CO 0.57 -0.38 0.00 1.19 0.00 0.00 0.00 179.25 180.63 1jhd n PHE 308 N -5.24 0.99 0.16 0.00 3.72 -1.26 -0.68 117.46 115.15 1jhd n PHE 308 Ca 0.13 -0.58 0.06 0.00 -0.05 0.00 0.00 57.45 57.01 1jhd n PHE 308 Cb 0.45 -0.12 0.52 0.00 -0.94 0.00 0.00 39.48 39.38 1jhd n PHE 308 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 1jhd h ASP 309 N 3.28 0.16 0.86 4.37 3.32 -1.83 -0.63 116.42 125.94 1jhd h ASP 309 Ca 0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 1jhd h ASP 309 Cb 1.12 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.63 1jhd h ASP 309 CO 0.10 0.18 0.00 0.00 -1.72 0.00 0.00 179.24 177.81 1jhd n ALA 310 N -2.51 1.97 -0.09 3.45 0.00 -1.26 -1.66 120.51 120.41 1jhd n ALA 310 Ca -0.01 -0.04 -0.23 0.00 0.00 0.00 0.00 53.44 53.16 1jhd n ALA 310 Cb 0.14 -1.37 -0.12 0.00 0.00 0.00 0.00 19.45 18.09 1jhd n ALA 310 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1jhd n GLN 311 N -1.76 0.62 0.25 0.00 6.02 -0.35 -4.44 117.38 117.73 1jhd n GLN 311 Ca 0.05 0.40 0.17 0.00 -0.01 0.00 0.00 57.00 57.61 1jhd n GLN 311 Cb 0.28 -1.67 0.69 0.00 1.02 0.00 0.00 30.24 30.56 1jhd n GLN 311 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 177.06 177.84 1jhd h THR 312 N -0.66 0.00 -0.17 5.09 1.35 -1.21 -2.37 112.91 114.94 1jhd h THR 312 Ca -0.46 -0.40 0.05 0.00 -0.55 0.00 0.00 66.41 65.04 1jhd h THR 312 Cb 1.59 1.34 -0.01 0.00 -1.73 0.00 0.00 68.15 69.34 1jhd h THR 312 CO -0.18 0.00 0.13 -0.29 -0.25 0.00 0.00 175.52 174.93 1jhd h ILE 313 N 0.00 0.84 0.00 6.82 2.10 -1.53 0.16 117.51 125.90 1jhd h ILE 313 Ca 0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1jhd h ILE 313 Cb 0.43 0.91 0.00 0.00 -1.09 0.00 0.00 36.82 37.07 1jhd h ILE 313 CO 0.00 0.00 0.00 -0.26 -1.08 0.00 0.00 178.15 176.81 1jhd h PHE 314 N 0.00 0.00 0.06 2.19 -1.00 -1.69 -0.24 116.94 116.27 1jhd h PHE 314 Ca 0.08 0.00 -0.33 0.00 2.81 0.00 0.00 57.97 60.53 1jhd h PHE 314 Cb 0.34 0.00 -0.03 0.00 3.61 0.00 0.00 35.95 39.86 1jhd h PHE 314 CO 0.00 0.00 -1.87 -0.25 -1.61 0.00 0.00 178.31 174.58 1jhd n ASP 315 N -3.03 1.52 -0.00 2.17 8.00 0.49 -4.48 116.55 121.22 1jhd n ASP 315 Ca 0.01 0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.81 1jhd n ASP 315 Cb 0.31 -0.46 0.00 0.00 -0.02 0.00 0.00 41.12 40.95 1jhd n ASP 315 CO 0.00 0.00 0.00 -0.90 -0.39 0.00 0.00 177.20 175.91 1jhd n ASP 316 N -3.27 1.01 0.00 -2.24 5.68 -0.73 -4.84 116.55 112.16 1jhd n ASP 316 Ca -0.25 -1.00 0.00 0.00 -0.50 0.00 0.00 54.79 53.04 1jhd n ASP 316 Cb 1.05 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 41.03 1jhd n ASP 316 CO 0.00 0.00 0.00 1.21 -1.33 0.00 0.00 177.20 177.08 1jhd n GLU 317 N 0.00 1.69 -2.37 0.11 2.13 -0.16 -5.04 120.64 117.00 1jhd n GLU 317 Ca 0.00 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.40 1jhd n GLU 317 Cb 0.00 -0.72 -0.03 0.00 0.27 0.00 0.00 31.44 30.96 1jhd n GLU 317 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1jhd s VAL 318 N -1.44 3.93 0.47 6.31 1.01 -0.82 -4.95 120.40 124.91 1jhd s VAL 318 Ca 0.00 1.36 -0.24 0.00 0.00 0.00 0.00 61.98 63.10 1jhd s VAL 318 Cb 0.00 -3.87 -0.08 0.00 0.00 0.00 0.00 36.38 32.43 1jhd s VAL 318 CO 0.00 0.07 1.24 -2.65 0.00 0.00 0.00 175.10 173.76 1jhd n PRO 319 N 4.38 1.71 -1.74 2.72 -0.02 -1.26 -4.89 135.00 135.91 1jhd n PRO 319 Ca 0.10 0.62 -0.42 0.00 -2.02 0.00 0.00 63.50 61.78 1jhd n PRO 319 Cb 0.45 -2.38 -0.01 0.00 -0.02 0.00 0.00 33.50 31.54 1jhd n PRO 319 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1jhd n GLU 320 N -0.33 2.52 -1.30 -0.52 2.13 -1.26 -2.17 120.64 119.72 1jhd n GLU 320 Ca 0.08 0.89 -0.10 0.00 0.66 0.00 0.00 57.16 58.69 1jhd n GLU 320 Cb 0.42 -2.61 -0.04 0.00 0.27 0.00 0.00 31.44 29.47 1jhd n GLU 320 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 1jhd n GLY 321 N 1.54 1.14 0.32 8.31 0.00 -1.26 -4.92 105.19 110.31 1jhd n GLY 321 Ca 0.07 -0.38 -0.05 0.00 0.00 0.00 0.00 46.02 45.66 1jhd n GLY 321 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jhd h ALA 322 N 0.00 1.01 -2.39 4.61 0.00 -1.80 -3.45 119.26 117.24 1jhd h ALA 322 Ca -0.21 -0.10 -0.23 0.00 0.00 0.00 0.00 54.91 54.38 1jhd h ALA 322 Cb 0.76 -0.32 -0.15 0.00 0.00 0.00 0.00 17.79 18.08 1jhd h ALA 322 CO 0.31 0.49 -0.65 -1.64 0.00 0.00 0.00 179.25 177.76 1jhd s MET 323 N -5.94 1.02 -0.08 0.00 -1.94 -1.26 -4.85 119.30 106.25 1jhd s MET 323 Ca -0.13 -1.50 0.20 0.00 -1.71 0.00 0.00 55.69 52.55 1jhd s MET 323 Cb 0.15 0.07 -0.30 0.00 2.01 0.00 0.00 34.83 36.77 1jhd s MET 323 CO 0.80 -0.23 0.33 0.39 -0.01 0.00 0.00 175.02 176.30 1jhd n GLU 324 N -0.17 0.69 -2.05 2.03 4.71 -1.26 -4.96 120.64 119.63 1jhd n GLU 324 Ca -0.05 -0.13 -0.37 0.00 -0.01 0.00 0.00 57.16 56.60 1jhd n GLU 324 Cb 0.64 -1.50 0.02 0.00 -1.01 0.00 0.00 31.44 29.59 1jhd n GLU 324 CO 0.00 0.00 0.00 -1.50 0.09 0.00 0.00 177.13 175.72 1jhd s ILE 325 N -3.14 2.67 0.15 -3.67 2.07 -1.26 -5.01 121.20 113.01 1jhd s ILE 325 Ca -0.08 0.47 0.07 0.00 -1.41 0.00 0.00 60.65 59.69 1jhd s ILE 325 Cb 0.11 -3.22 -0.04 0.00 0.13 0.00 0.00 42.46 39.44 1jhd s ILE 325 CO 0.85 -0.04 -0.03 -1.61 -1.91 0.00 0.00 174.94 172.20 1jhd s GLU 326 N -3.01 2.35 -0.13 3.50 2.02 -0.39 -5.00 118.70 118.04 1jhd s GLU 326 Ca 0.71 -1.06 -0.10 0.00 0.02 0.00 0.00 54.97 54.55 1jhd s GLU 326 Cb -0.32 -2.36 -0.05 0.00 0.10 0.00 0.00 34.13 31.50 1jhd s GLU 326 CO 0.37 0.48 0.19 0.42 0.02 0.00 0.00 175.26 176.74 1jhd s ILE 327 N -1.56 5.40 -0.34 -1.63 -1.09 -1.26 -0.86 121.20 119.85 1jhd s ILE 327 Ca 0.26 0.34 -0.12 0.00 -2.23 0.00 0.00 60.65 58.90 1jhd s ILE 327 Cb -0.10 -3.49 -0.00 0.00 -1.58 0.00 0.00 42.46 37.29 1jhd s ILE 327 CO 0.17 0.55 0.21 0.12 -1.23 0.00 0.00 174.94 174.77 1jhd s PHE 328 N -0.56 3.22 -0.39 3.97 2.19 0.08 -4.88 117.98 121.61 1jhd s PHE 328 Ca 0.15 -0.48 -0.24 0.00 0.33 0.00 0.00 56.93 56.69 1jhd s PHE 328 Cb -0.13 -2.45 0.01 0.00 -1.31 0.00 0.00 43.02 39.15 1jhd s PHE 328 CO 0.04 -0.46 0.82 1.03 1.83 0.00 0.00 175.22 178.48 1jhd s ARG 329 N 1.66 3.68 0.51 10.12 0.52 -1.26 -1.25 118.95 132.94 1jhd s ARG 329 Ca 0.05 0.26 0.06 0.00 -0.52 0.00 0.00 55.73 55.58 1jhd s ARG 329 Cb -0.18 -3.84 0.04 0.00 0.52 0.00 0.00 34.95 31.49 1jhd s ARG 329 CO 0.09 -0.95 0.71 0.00 0.02 0.00 0.00 175.30 175.16 1jhd s ALA 330 N 3.25 4.32 0.39 2.13 0.00 0.12 -4.97 121.76 127.01 1jhd s ALA 330 Ca 0.33 -1.67 -0.14 0.00 0.00 0.00 0.00 51.96 50.47 1jhd s ALA 330 Cb -0.12 -1.75 0.05 0.00 0.00 0.00 0.00 23.12 21.30 1jhd s ALA 330 CO 0.19 -0.62 0.77 0.34 0.00 0.00 0.00 175.76 176.44 1jhd s ASP 331 N -4.47 0.10 0.31 0.00 -1.08 -1.26 -4.24 116.67 106.04 1jhd s ASP 331 Ca 0.58 -1.21 -0.29 0.00 -0.52 0.00 0.00 52.55 51.11 1jhd s ASP 331 Cb -0.09 0.85 -0.12 0.00 -1.46 0.00 0.00 42.92 42.10 1jhd s ASP 331 CO 0.37 -1.68 1.48 1.41 0.52 0.00 0.00 175.17 177.27 1jhd n HIS 332 N -0.54 2.67 -3.41 -5.34 8.25 -1.26 -4.90 115.22 110.69 1jhd n HIS 332 Ca -0.08 0.38 -0.19 0.00 -0.26 0.00 0.00 57.72 57.58 1jhd n HIS 332 Cb 0.60 -2.53 -0.00 0.00 1.12 0.00 0.00 29.99 29.18 1jhd n HIS 332 CO 0.00 0.00 0.00 0.95 0.64 0.00 0.00 176.34 177.93 1jhd s THR 333 N -0.47 3.81 0.09 1.59 -4.23 -1.26 -2.38 115.64 112.78 1jhd s THR 333 Ca 0.61 -1.03 -0.26 0.00 -1.18 0.00 0.00 61.69 59.82 1jhd s THR 333 Cb -0.53 -3.31 0.08 0.00 1.34 0.00 0.00 72.50 70.08 1jhd s THR 333 CO 0.55 -0.13 0.83 0.00 -0.54 0.00 0.00 174.62 175.33 1jhd s ALA 334 N -2.22 -1.69 -0.08 3.99 0.00 -0.47 -4.85 121.76 116.45 1jhd s ALA 334 Ca 0.47 0.60 -0.28 0.00 0.00 0.00 0.00 51.96 52.75 1jhd s ALA 334 Cb -0.09 0.60 -0.02 0.00 0.00 0.00 0.00 23.12 23.61 1jhd s ALA 334 CO 0.31 -0.81 0.90 -0.47 0.00 0.00 0.00 175.76 175.69 1jhd s TYR 335 N -3.35 3.56 -0.25 0.00 5.04 -0.13 -1.35 117.35 120.87 1jhd s TYR 335 Ca 0.06 1.49 -0.19 0.00 -2.44 0.00 0.00 57.07 55.99 1jhd s TYR 335 Cb -0.01 -3.05 -0.02 0.00 0.35 0.00 0.00 41.96 39.22 1jhd s TYR 335 CO -0.06 -0.09 0.57 0.45 -1.34 0.00 0.00 175.55 175.08 1jhd s SER 336 N 1.02 6.53 0.30 4.32 0.15 0.18 -1.20 113.70 125.00 1jhd s SER 336 Ca 0.45 0.64 0.09 0.00 0.70 0.00 0.00 55.95 57.83 1jhd s SER 336 Cb -0.19 -2.31 0.48 0.00 -1.71 0.00 0.00 66.02 62.29 1jhd s SER 336 CO 0.20 -0.31 1.70 0.11 1.20 0.00 0.00 173.24 176.14 1jhd h LYS 337 N 7.86 0.12 -0.37 5.44 1.57 -0.89 0.17 116.57 130.48 1jhd h LYS 337 Ca -0.29 -0.06 -0.15 0.00 -1.87 0.00 0.00 60.65 58.28 1jhd h LYS 337 Cb 1.13 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.44 1jhd h LYS 337 CO 0.75 0.57 -0.37 0.87 -0.57 0.00 0.00 179.45 180.69 1jhd h LYS 338 N 0.10 0.88 -0.01 3.15 1.57 -1.93 -3.26 116.57 117.07 1jhd h LYS 338 Ca 0.00 -0.45 0.00 0.00 -1.87 0.00 0.00 60.65 58.33 1jhd h LYS 338 Cb 0.87 0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.19 1jhd h LYS 338 CO 0.07 1.10 -0.77 1.28 -0.57 0.00 0.00 179.45 180.55 1jhd n LEU 339 N -4.06 1.44 -3.59 2.94 4.77 -1.19 -4.99 117.00 112.32 1jhd n LEU 339 Ca -0.02 -0.61 -0.21 0.00 -0.03 0.00 0.00 56.01 55.14 1jhd n LEU 339 Cb 0.53 0.00 0.07 0.00 -2.33 0.00 0.00 43.42 41.69 1jhd n LEU 339 CO 0.48 0.30 0.10 -3.20 -1.33 0.00 0.00 177.39 173.74 1jhd n ASN 340 N -0.86 -3.18 -3.76 -1.43 5.15 0.59 -4.98 115.26 106.79 1jhd n ASN 340 Ca 0.06 -0.67 -0.06 0.00 -0.60 0.00 0.00 54.58 53.31 1jhd n ASN 340 Cb 0.39 -4.70 -0.01 0.00 -0.53 0.00 0.00 39.78 34.93 1jhd n ASN 340 CO 0.00 0.00 0.00 -1.59 1.40 0.00 0.00 177.26 177.07 1jhd s LYS 341 N -5.89 1.70 0.01 1.20 -2.85 -1.19 -4.99 119.74 107.74 1jhd s LYS 341 Ca 0.22 -0.96 -0.24 0.00 -1.00 0.00 0.00 55.97 53.99 1jhd s LYS 341 Cb -0.10 0.57 -0.05 0.00 -2.06 0.00 0.00 37.83 36.19 1jhd s LYS 341 CO 0.76 -0.78 0.74 0.42 0.10 0.00 0.00 175.35 176.59 1jhd s ILE 342 N -3.64 4.84 0.14 3.79 -1.09 -1.26 -0.65 121.20 123.33 1jhd s ILE 342 Ca 0.12 1.55 -0.00 0.00 -2.23 0.00 0.00 60.65 60.09 1jhd s ILE 342 Cb -0.05 -4.08 -0.04 0.00 -1.58 0.00 0.00 42.46 36.71 1jhd s ILE 342 CO 0.06 0.34 0.04 0.68 -1.23 0.00 0.00 174.94 174.83 1jhd s VAL 343 N 0.18 0.30 -0.10 2.92 -7.23 -0.45 -4.95 120.40 111.07 1jhd s VAL 343 Ca 0.38 -1.93 -0.23 0.00 -1.81 0.00 0.00 61.98 58.39 1jhd s VAL 343 Cb -0.20 -2.06 -0.03 0.00 0.56 0.00 0.00 36.38 34.65 1jhd s VAL 343 CO 0.21 -0.48 0.70 -0.04 -0.31 0.00 0.00 175.10 175.19 1jhd s MET 344 N -4.00 4.39 0.31 4.82 -1.94 -1.26 -1.36 119.30 120.25 1jhd s MET 344 Ca 0.24 0.85 0.06 0.00 -1.71 0.00 0.00 55.69 55.13 1jhd s MET 344 Cb 0.07 -3.48 0.73 0.00 2.01 0.00 0.00 34.83 34.16 1jhd s MET 344 CO 0.02 -0.03 1.80 0.52 -0.01 0.00 0.00 175.02 177.32 1jhd h MET 345 N 6.93 0.76 0.00 2.03 2.86 -1.80 -1.01 114.93 124.70 1jhd h MET 345 Ca -0.38 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.21 1jhd h MET 345 Cb 1.18 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 32.67 1jhd h MET 345 CO 0.77 0.50 0.00 0.07 1.06 0.00 0.00 176.91 179.31 1jhd h ARG 346 N 0.78 0.00 0.00 1.72 -0.00 -1.92 -2.22 114.38 112.74 1jhd h ARG 346 Ca 0.55 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 60.53 1jhd h ARG 346 Cb 0.84 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.81 1jhd h ARG 346 CO -0.34 0.00 -0.25 -0.25 -0.00 0.00 0.00 179.97 179.14 1jhd n ASP 347 N -2.92 0.44 -3.51 0.08 8.00 -0.38 -4.35 116.55 113.90 1jhd n ASP 347 Ca -0.02 0.26 -0.27 0.00 0.71 0.00 0.00 54.79 55.47 1jhd n ASP 347 Cb 0.09 -0.25 -0.09 0.00 -0.02 0.00 0.00 41.12 40.84 1jhd n ASP 347 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 1jhd n VAL 348 N -1.79 1.59 0.00 2.53 0.24 -0.83 -4.97 118.33 115.10 1jhd n VAL 348 Ca 0.06 -4.88 0.00 0.00 -2.04 0.00 0.00 64.34 57.48 1jhd n VAL 348 Cb 0.38 -2.08 0.00 0.00 -1.47 0.00 0.00 33.84 30.67 1jhd n VAL 348 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1jhd n PRO 349 N 1.31 0.00 0.10 7.34 -0.02 -1.26 -2.45 135.00 140.02 1jhd n PRO 349 Ca 0.26 0.28 0.12 0.00 -2.02 0.00 0.00 63.50 62.14 1jhd n PRO 349 Cb 0.41 -1.54 0.09 0.00 -0.02 0.00 0.00 33.50 32.45 1jhd n PRO 349 CO 0.00 0.00 0.00 0.38 1.98 0.00 0.00 175.50 177.86 1jhd h ASP 350 N 0.00 0.00 -4.28 2.55 2.03 -1.93 -3.47 116.42 111.31 1jhd h ASP 350 Ca 0.00 -0.08 -0.51 0.00 -0.73 0.00 0.00 57.03 55.71 1jhd h ASP 350 Cb 0.08 0.00 0.12 0.00 -0.83 0.00 0.00 39.33 38.70 1jhd h ASP 350 CO 0.00 0.04 0.33 -1.00 -1.03 0.00 0.00 179.24 177.58 1jhd s HIS 351 N -3.27 2.58 0.48 4.15 3.76 -1.03 -5.08 115.29 116.89 1jhd s HIS 351 Ca 0.03 1.56 0.06 0.00 -0.15 0.00 0.00 55.06 56.56 1jhd s HIS 351 Cb 0.10 -3.09 0.00 0.00 1.11 0.00 0.00 32.58 30.71 1jhd s HIS 351 CO 0.75 -1.78 0.35 0.95 -0.85 0.00 0.00 174.74 174.16 1jhd s THR 352 N -2.74 2.07 0.19 1.30 -4.23 -1.26 -5.02 115.64 105.95 1jhd s THR 352 Ca 0.63 -1.49 -0.08 0.00 -1.18 0.00 0.00 61.69 59.57 1jhd s THR 352 Cb -0.18 -2.56 0.07 0.00 1.34 0.00 0.00 72.50 71.17 1jhd s THR 352 CO 0.52 0.00 1.66 0.50 -0.54 0.00 0.00 174.62 176.75 1jhd h LYS 353 N 0.96 1.05 0.00 3.99 3.64 -1.98 -2.03 116.57 122.21 1jhd h LYS 353 Ca -0.39 -0.33 0.00 0.00 -1.27 0.00 0.00 60.65 58.66 1jhd h LYS 353 Cb 1.28 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 1jhd h LYS 353 CO 0.60 1.02 0.00 0.39 -2.27 0.00 0.00 179.45 179.19 1jhd n GLU 354 N -4.18 0.01 0.00 1.90 4.71 -1.26 -1.95 120.64 119.87 1jhd n GLU 354 Ca 0.03 0.23 0.14 0.00 -0.01 0.00 0.00 57.16 57.55 1jhd n GLU 354 Cb 0.35 -1.50 0.64 0.00 -1.01 0.00 0.00 31.44 29.91 1jhd n GLU 354 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1jhd n ASP 355 N -1.49 0.27 -4.41 1.62 8.00 -0.76 -4.86 116.55 114.91 1jhd n ASP 355 Ca 0.04 -0.30 -0.27 0.00 0.71 0.00 0.00 54.79 54.97 1jhd n ASP 355 Cb 0.18 -0.16 -0.12 0.00 -0.02 0.00 0.00 41.12 40.99 1jhd n ASP 355 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 1jhd s PHE 356 N -2.59 2.24 -0.07 1.24 0.08 -0.82 -0.18 117.98 117.87 1jhd s PHE 356 Ca 0.26 -0.37 0.02 0.00 0.12 0.00 0.00 56.93 56.96 1jhd s PHE 356 Cb 0.20 -1.12 0.02 0.00 -0.57 0.00 0.00 43.02 41.54 1jhd s PHE 356 CO 0.49 0.46 -0.11 0.08 -0.10 0.00 0.00 175.22 176.04 1jhd s VAL 357 N -1.64 1.08 0.05 -0.44 1.01 -0.34 -4.94 120.40 115.18 1jhd s VAL 357 Ca 0.19 -0.42 0.09 0.00 0.00 0.00 0.00 61.98 61.84 1jhd s VAL 357 Cb -0.08 -1.02 -0.03 0.00 0.00 0.00 0.00 36.38 35.26 1jhd s VAL 357 CO 0.09 0.35 -0.26 -0.76 0.00 0.00 0.00 175.10 174.52 1jhd s LEU 358 N 0.90 2.17 -0.20 3.92 1.02 -1.26 -0.96 118.68 124.28 1jhd s LEU 358 Ca -0.10 -0.59 -0.04 0.00 0.02 0.00 0.00 54.13 53.42 1jhd s LEU 358 Cb -0.15 -1.26 0.10 0.00 0.02 0.00 0.00 46.19 44.90 1jhd s LEU 358 CO 0.01 0.25 0.26 -0.22 0.02 0.00 0.00 176.35 176.66 1jhd s LEU 359 N -1.26 -0.24 0.77 1.79 2.96 -1.26 -5.06 118.68 116.38 1jhd s LEU 359 Ca 0.11 -0.01 -0.12 0.00 -0.22 0.00 0.00 54.13 53.90 1jhd s LEU 359 Cb -0.10 0.57 0.06 0.00 0.50 0.00 0.00 46.19 47.22 1jhd s LEU 359 CO 0.02 -0.31 1.11 -0.94 -1.32 0.00 0.00 176.35 174.92 1jhd s SER 360 N 2.38 4.33 0.33 3.68 1.04 -1.26 -4.80 113.70 119.40 1jhd s SER 360 Ca 0.07 1.95 0.02 0.00 0.48 0.00 0.00 55.95 58.47 1jhd s SER 360 Cb -0.15 -2.54 0.60 0.00 0.10 0.00 0.00 66.02 64.03 1jhd s SER 360 CO -0.12 -2.16 1.97 1.23 0.98 0.00 0.00 173.24 175.14 1jhd h GLY 361 N -0.98 1.05 0.93 7.32 0.00 -1.99 0.26 103.07 109.65 1jhd h GLY 361 Ca -0.44 -0.36 -0.02 0.00 0.00 0.00 0.00 47.33 46.50 1jhd h GLY 361 CO 0.50 0.32 0.13 -0.84 0.00 0.00 0.00 176.54 176.65 1jhd h THR 362 N 0.93 1.19 -0.26 4.70 2.02 -2.00 -0.96 112.91 118.53 1jhd h THR 362 Ca 0.30 -0.59 -0.09 0.00 0.77 0.00 0.00 66.41 66.80 1jhd h THR 362 Cb 0.05 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 1jhd h THR 362 CO -0.09 0.21 -0.24 0.11 0.37 0.00 0.00 175.52 175.88 1jhd h LYS 363 N 0.41 0.49 -0.22 6.66 1.57 -1.75 -1.04 116.57 122.68 1jhd h LYS 363 Ca 0.11 -0.18 -0.01 0.00 -1.87 0.00 0.00 60.65 58.70 1jhd h LYS 363 Cb 0.19 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 1jhd h LYS 363 CO -0.01 0.70 0.10 0.28 -0.57 0.00 0.00 179.45 179.95 1jhd h VAL 364 N 0.44 1.15 -0.16 0.50 2.07 -0.74 -1.92 116.25 117.59 1jhd h VAL 364 Ca 0.07 -0.45 -0.07 0.00 0.82 0.00 0.00 66.70 67.06 1jhd h VAL 364 Cb 0.65 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.45 1jhd h VAL 364 CO 0.05 0.15 -0.23 0.03 0.02 0.00 0.00 177.57 177.59 1jhd h ARG 365 N 0.22 0.28 -0.71 1.57 3.08 -0.88 -0.51 114.38 117.44 1jhd h ARG 365 Ca 0.08 -0.09 -0.06 0.00 0.07 0.00 0.00 59.98 59.98 1jhd h ARG 365 Cb 0.15 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.14 1jhd h ARG 365 CO -0.01 0.50 0.20 1.49 -1.07 0.00 0.00 179.97 181.08 1jhd h GLU 366 N 0.26 1.11 -0.19 0.04 4.81 -0.96 -0.31 114.58 119.33 1jhd h GLU 366 Ca 0.04 -0.25 -0.06 0.00 -0.13 0.00 0.00 59.36 58.96 1jhd h GLU 366 Cb 0.55 -0.15 -0.00 0.00 0.63 0.00 0.00 28.75 29.77 1jhd h GLU 366 CO 0.04 0.97 -0.11 0.52 -0.73 0.00 0.00 179.01 179.69 1jhd h MET 367 N 1.05 0.41 -1.00 1.92 2.86 -0.89 -2.93 114.93 116.36 1jhd h MET 367 Ca 0.22 -0.19 0.10 0.00 -2.06 0.00 0.00 59.70 57.77 1jhd h MET 367 Cb 0.33 -0.01 -0.08 0.00 0.06 0.00 0.00 31.60 31.91 1jhd h MET 367 CO -0.00 0.73 0.63 -0.07 1.06 0.00 0.00 176.91 179.26 1jhd h LEU 368 N 0.10 0.97 -2.04 1.22 3.38 -0.92 -0.10 115.31 117.91 1jhd h LEU 368 Ca 0.04 0.03 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1jhd h LEU 368 Cb 0.61 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1jhd h LEU 368 CO 0.03 0.56 -0.04 1.23 0.09 0.00 0.00 178.44 180.31 1jhd h GLY 369 N 1.06 0.00 -1.47 0.83 0.00 -0.91 0.27 103.07 102.85 1jhd h GLY 369 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 1jhd h GLY 369 CO -0.23 0.00 0.00 -1.06 0.00 0.00 0.00 176.54 175.25 1jhd n GLN 370 N -4.26 2.01 -1.06 4.80 6.02 -0.14 -4.80 117.38 119.94 1jhd n GLN 370 Ca -0.03 -1.55 -0.02 0.00 -0.01 0.00 0.00 57.00 55.39 1jhd n GLN 370 Cb 0.13 -1.39 -0.01 0.00 1.02 0.00 0.00 30.24 29.98 1jhd n GLN 370 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1jhd n GLY 371 N 1.24 0.56 3.64 1.08 0.00 0.08 -5.02 105.19 106.76 1jhd n GLY 371 Ca 0.16 -0.72 -0.36 0.00 0.00 0.00 0.00 46.02 45.10 1jhd n GLY 371 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1jhd s ILE 372 N -2.05 5.13 -0.15 -0.61 1.01 -0.65 -5.01 121.20 118.88 1jhd s ILE 372 Ca 0.00 0.10 -0.29 0.00 0.00 0.00 0.00 60.65 60.45 1jhd s ILE 372 Cb 0.00 -3.37 -0.01 0.00 0.01 0.00 0.00 42.46 39.09 1jhd s ILE 372 CO 0.00 0.38 1.06 0.00 0.00 0.00 0.00 174.94 176.38 1jhd s ALA 373 N 0.87 3.53 1.01 9.38 0.00 -1.26 -3.43 121.76 131.86 1jhd s ALA 373 Ca 0.06 0.34 -0.14 0.00 0.00 0.00 0.00 51.96 52.23 1jhd s ALA 373 Cb -0.13 -3.50 0.19 0.00 0.00 0.00 0.00 23.12 19.68 1jhd s ALA 373 CO 0.03 -0.82 1.12 -2.14 0.00 0.00 0.00 175.76 173.95 1jhd s PRO 374 N 2.55 0.36 0.78 0.00 0.02 -1.26 -4.97 135.00 132.48 1jhd s PRO 374 Ca 0.48 0.27 -0.14 0.00 0.02 0.00 0.00 61.00 61.63 1jhd s PRO 374 Cb -0.18 -1.75 0.07 0.00 0.02 0.00 0.00 34.50 32.66 1jhd s PRO 374 CO 0.14 -2.72 1.20 -2.14 -0.33 0.00 0.00 177.00 173.15 1jhd s PRO 375 N -5.21 1.81 0.60 5.54 0.02 -1.26 -4.62 135.00 131.88 1jhd s PRO 375 Ca 0.66 1.73 0.30 0.00 0.02 0.00 0.00 61.00 63.72 1jhd s PRO 375 Cb -0.15 -1.80 1.84 0.00 0.02 0.00 0.00 34.50 34.42 1jhd s PRO 375 CO 0.56 -2.08 2.24 -1.35 -0.33 0.00 0.00 177.00 176.04 1jhd h PRO 376 N -0.73 0.00 0.00 5.54 0.11 -1.94 0.34 132.00 135.32 1jhd h PRO 376 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1jhd h PRO 376 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1jhd h PRO 376 CO 0.47 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.19 1jhd h GLU 377 N 0.00 0.00 0.00 1.05 3.07 -2.04 -3.25 114.58 113.41 1jhd h GLU 377 Ca 0.01 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.87 1jhd h GLU 377 Cb 0.07 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.98 1jhd h GLU 377 CO -0.00 0.00 -0.84 1.19 -1.40 0.00 0.00 179.01 177.96 1jhd n PHE 378 N -2.95 0.00 -3.69 4.33 3.72 -0.00 -4.71 117.46 114.16 1jhd n PHE 378 Ca -0.00 0.00 -0.16 0.00 -0.05 0.00 0.00 57.45 57.23 1jhd n PHE 378 Cb 0.21 -0.01 -0.16 0.00 -0.94 0.00 0.00 39.48 38.59 1jhd n PHE 378 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 1jhd s SER 379 N -1.86 0.59 -0.00 4.37 0.15 -0.52 -2.33 113.70 114.09 1jhd s SER 379 Ca -0.00 0.30 -0.30 0.00 0.70 0.00 0.00 55.95 56.65 1jhd s SER 379 Cb 0.00 0.22 -0.03 0.00 -1.71 0.00 0.00 66.02 64.50 1jhd s SER 379 CO 0.02 -0.22 1.06 -0.13 1.20 0.00 0.00 173.24 175.16 1jhd s ARG 380 N 2.03 4.49 0.27 5.44 1.81 -1.26 -4.24 118.95 127.48 1jhd s ARG 380 Ca 0.01 1.53 -0.00 0.00 -1.72 0.00 0.00 55.73 55.54 1jhd s ARG 380 Cb -0.12 -3.45 0.57 0.00 -0.45 0.00 0.00 34.95 31.50 1jhd s ARG 380 CO -0.05 -0.18 1.74 -1.35 -0.68 0.00 0.00 175.30 174.78 1jhd h PRO 381 N 6.90 0.54 -0.49 3.54 0.11 -1.96 0.23 132.00 140.88 1jhd h PRO 381 Ca -0.39 -0.03 -0.08 0.00 0.11 0.00 0.00 66.00 65.61 1jhd h PRO 381 Cb 1.20 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1jhd h PRO 381 CO 0.79 0.36 -0.02 0.93 -0.21 0.00 0.00 178.00 179.85 1jhd h GLU 382 N 0.56 0.84 -0.11 1.05 3.07 -1.99 0.42 114.58 118.42 1jhd h GLU 382 Ca 0.48 -0.24 -0.09 0.00 -0.50 0.00 0.00 59.36 59.00 1jhd h GLU 382 Cb 0.74 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.56 1jhd h GLU 382 CO -0.40 0.85 -0.30 0.28 -1.40 0.00 0.00 179.01 178.04 1jhd h VAL 383 N 0.77 1.39 -0.65 3.13 2.07 -1.72 -3.03 116.25 118.22 1jhd h VAL 383 Ca 0.14 -1.62 0.06 0.00 0.82 0.00 0.00 66.70 66.11 1jhd h VAL 383 Cb 0.50 2.14 -0.04 0.00 -1.52 0.00 0.00 31.29 32.37 1jhd h VAL 383 CO 0.02 0.47 0.43 0.00 0.02 0.00 0.00 177.57 178.52 1jhd h ALA 384 N 0.50 1.76 0.04 1.67 0.00 -0.29 -2.01 119.26 120.93 1jhd h ALA 384 Ca -0.01 -0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1jhd h ALA 384 Cb 0.92 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.54 1jhd h ALA 384 CO 0.07 0.14 -0.02 -0.22 0.00 0.00 0.00 179.25 179.22 1jhd h LYS 385 N 0.66 -0.05 -0.35 0.00 1.63 -0.91 0.44 116.57 117.99 1jhd h LYS 385 Ca 0.28 0.00 0.03 0.00 -0.85 0.00 0.00 60.65 60.11 1jhd h LYS 385 Cb 0.25 0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.86 1jhd h LYS 385 CO -0.08 -0.02 0.15 0.82 -3.45 0.00 0.00 179.45 176.86 1jhd h ILE 386 N -0.06 0.95 -0.21 2.00 2.04 -1.29 0.27 117.51 121.20 1jhd h ILE 386 Ca -0.01 -0.11 -0.17 0.00 1.00 0.00 0.00 64.86 65.58 1jhd h ILE 386 Cb 0.05 0.60 -0.00 0.00 -0.74 0.00 0.00 36.82 36.72 1jhd h ILE 386 CO 0.01 0.06 -0.56 -0.07 0.00 0.00 0.00 178.15 177.59 1jhd h LEU 387 N 0.32 0.73 -0.39 1.44 3.38 -1.00 -2.54 115.31 117.25 1jhd h LEU 387 Ca 0.15 -0.39 -0.19 0.00 0.09 0.00 0.00 57.88 57.54 1jhd h LEU 387 Cb 0.09 -0.21 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1jhd h LEU 387 CO -0.13 1.13 -0.71 0.24 0.09 0.00 0.00 178.44 179.06 1jhd h MET 388 N 0.50 0.47 -0.39 1.13 2.86 0.12 0.94 114.93 120.56 1jhd h MET 388 Ca 0.01 -0.37 0.00 0.00 -2.06 0.00 0.00 59.70 57.28 1jhd h MET 388 Cb 1.12 0.07 -0.02 0.00 0.06 0.00 0.00 31.60 32.84 1jhd h MET 388 CO 0.11 1.00 0.25 -0.44 1.06 0.00 0.00 176.91 178.89 1jhd h ASP 389 N 0.33 0.46 0.12 1.22 3.32 -0.42 0.18 116.42 121.63 1jhd h ASP 389 Ca -0.03 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.00 1jhd h ASP 389 Cb 1.29 -0.11 0.00 0.00 0.22 0.00 0.00 39.33 40.73 1jhd h ASP 389 CO 0.13 0.35 -0.06 0.22 -1.72 0.00 0.00 179.24 178.16 1jhd h TYR 390 N 0.54 -0.15 -0.90 4.55 3.20 -0.99 -3.22 116.97 119.99 1jhd h TYR 390 Ca 0.14 -0.00 0.05 0.00 3.14 0.00 0.00 58.73 62.06 1jhd h TYR 390 Cb -0.04 0.05 -0.06 0.00 1.54 0.00 0.00 36.73 38.23 1jhd h TYR 390 CO 0.00 0.33 0.59 1.88 -1.64 0.00 0.00 178.16 179.32 1jhd h TYR 391 N -0.86 1.06 0.00 -3.82 0.05 -0.43 -1.11 116.97 111.86 1jhd h TYR 391 Ca -0.02 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1jhd h TYR 391 Cb 0.55 -0.35 0.00 0.00 1.01 0.00 0.00 36.73 37.94 1jhd h TYR 391 CO 0.11 0.59 0.00 -0.56 -1.05 0.00 0.00 178.16 177.24 1jhd h GLN 392 N 1.07 0.00 0.00 4.88 3.07 -0.75 0.33 115.11 123.72 1jhd h GLN 392 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.11 1jhd h GLN 392 Cb 0.11 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.67 1jhd h GLN 392 CO -0.13 0.00 -0.06 -1.13 0.09 0.00 0.00 178.83 177.60 1jhd n SER 393 N -2.82 0.67 0.00 0.06 3.41 -0.42 -3.74 113.62 110.78 1jhd n SER 393 Ca 0.00 0.51 0.00 0.00 -0.26 0.00 0.00 58.87 59.13 1jhd n SER 393 Cb 0.24 -0.65 0.00 0.00 -0.26 0.00 0.00 64.21 63.55 1jhd n SER 393 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1jhd n ILE 394 N -2.11 0.00 0.87 -1.33 -5.35 -0.57 -4.81 119.36 106.05 1jhd n ILE 394 Ca 0.06 -0.16 0.10 0.00 -0.27 0.00 0.00 62.75 62.48 1jhd n ILE 394 Cb 0.42 0.65 0.02 0.00 -1.74 0.00 0.00 39.64 38.99 1jhd n ILE 394 CO 0.00 0.00 0.00 0.59 -1.76 0.00 0.00 176.55 175.38 1jhd n ASN 395 N -0.84 2.13 -0.33 7.28 3.02 0.11 -5.12 115.26 121.51 1jhd n ASN 395 Ca 0.00 -1.56 0.15 0.00 -0.03 0.00 0.00 54.58 53.13 1jhd n ASN 395 Cb 0.00 0.32 0.66 0.00 -0.61 0.00 0.00 39.78 40.15 1jhd n ASN 395 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44