#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1jtd h GLU 28 N 0.00 0.00 -0.15 -0.52 4.22 -2.00 -3.06 114.58 113.08 1jtd h GLU 28 Ca 0.00 0.00 -0.20 0.00 0.08 0.00 0.00 59.36 59.24 1jtd h GLU 28 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1jtd h GLU 28 CO 0.00 0.10 -0.70 1.15 -2.18 0.00 0.00 179.01 177.38 1jtd h THR 29 N 0.00 1.32 -0.59 0.32 2.02 -1.95 -2.33 112.91 111.69 1jtd h THR 29 Ca -0.00 -1.98 0.00 0.00 0.77 0.00 0.00 66.41 65.20 1jtd h THR 29 Cb 1.08 1.96 -0.03 0.00 -1.74 0.00 0.00 68.15 69.42 1jtd h THR 29 CO 0.01 0.61 0.38 0.25 0.37 0.00 0.00 175.52 177.15 1jtd h LEU 30 N 0.44 0.69 -0.13 2.58 6.46 -1.95 0.86 115.31 124.26 1jtd h LEU 30 Ca -0.03 -0.03 0.03 0.00 -0.12 0.00 0.00 57.88 57.73 1jtd h LEU 30 Cb 1.29 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 41.02 1jtd h LEU 30 CO 0.13 0.51 -0.06 0.58 -0.62 0.00 0.00 178.44 178.99 1jtd h VAL 31 N 0.80 0.81 -0.94 1.05 2.07 -1.42 -1.52 116.25 117.09 1jtd h VAL 31 Ca 0.22 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.73 1jtd h VAL 31 Cb -0.07 0.81 -0.05 0.00 -1.52 0.00 0.00 31.29 30.46 1jtd h VAL 31 CO -0.04 0.00 0.58 0.50 0.02 0.00 0.00 177.57 178.63 1jtd h LYS 32 N -0.04 1.27 -0.12 1.57 1.63 -0.88 -0.76 116.57 119.24 1jtd h LYS 32 Ca 0.07 -0.11 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1jtd h LYS 32 Cb 0.15 -0.27 -0.01 0.00 -0.60 0.00 0.00 32.23 31.50 1jtd h LYS 32 CO -0.16 0.88 0.06 0.28 -3.45 0.00 0.00 179.45 177.06 1jtd h VAL 33 N 1.30 1.09 -0.32 2.00 2.07 -0.35 0.94 116.25 122.98 1jtd h VAL 33 Ca 0.34 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.57 1jtd h VAL 33 Cb -0.08 1.06 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1jtd h VAL 33 CO -0.07 0.08 0.09 0.11 0.02 0.00 0.00 177.57 177.81 1jtd h LYS 34 N 0.09 0.46 -0.01 1.57 1.57 -1.09 -0.43 116.57 118.72 1jtd h LYS 34 Ca 0.04 -0.06 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 1jtd h LYS 34 Cb 0.08 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 32.29 1jtd h LYS 34 CO -0.01 0.42 -0.48 0.22 -0.57 0.00 0.00 179.45 179.03 1jtd h ASP 35 N 0.46 0.03 -0.56 0.86 -0.00 -0.52 -2.07 116.42 114.62 1jtd h ASP 35 Ca 0.11 -0.01 -0.07 0.00 -0.00 0.00 0.00 57.03 57.05 1jtd h ASP 35 Cb 0.16 -0.01 -0.02 0.00 -0.00 0.00 0.00 39.33 39.45 1jtd h ASP 35 CO -0.01 0.51 0.08 0.00 -0.00 0.00 0.00 179.24 179.82 1jtd h ALA 36 N 1.49 1.01 -0.55 -0.78 0.00 0.87 0.19 119.26 121.48 1jtd h ALA 36 Ca -0.00 -0.26 -0.09 0.00 0.00 0.00 0.00 54.91 54.56 1jtd h ALA 36 Cb 0.86 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1jtd h ALA 36 CO 0.06 0.63 0.01 0.93 0.00 0.00 0.00 179.25 180.88 1jtd h GLU 37 N 0.92 0.97 -0.12 0.00 5.08 -1.11 0.66 114.58 120.98 1jtd h GLU 37 Ca 0.18 -0.31 0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1jtd h GLU 37 Cb 0.43 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.58 1jtd h GLU 37 CO 0.01 0.97 0.05 -0.44 -1.00 0.00 0.00 179.01 178.61 1jtd h ASP 38 N 0.85 0.08 -0.57 1.42 3.32 -0.74 0.22 116.42 121.00 1jtd h ASP 38 Ca 0.16 0.01 -0.10 0.00 0.02 0.00 0.00 57.03 57.11 1jtd h ASP 38 Cb 0.53 -0.01 -0.02 0.00 0.22 0.00 0.00 39.33 40.05 1jtd h ASP 38 CO 0.03 0.06 -0.03 1.56 -1.72 0.00 0.00 179.24 179.14 1jtd h GLN 39 N 0.12 1.02 0.00 3.56 1.08 -0.45 -3.24 115.11 117.21 1jtd h GLN 39 Ca 0.05 -0.34 0.00 0.00 -1.45 0.00 0.00 58.65 56.91 1jtd h GLN 39 Cb 0.01 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.35 1jtd h GLN 39 CO -0.03 1.03 -0.61 1.28 -0.95 0.00 0.00 178.83 179.55 1jtd n LEU 40 N -4.21 0.59 -3.52 1.46 4.77 0.21 -4.96 117.00 111.34 1jtd n LEU 40 Ca 0.02 0.12 -0.20 0.00 -0.03 0.00 0.00 56.01 55.91 1jtd n LEU 40 Cb 0.36 -0.21 0.08 0.00 -2.33 0.00 0.00 43.42 41.32 1jtd n LEU 40 CO 0.44 0.03 0.16 0.61 -1.33 0.00 0.00 177.39 177.30 1jtd n GLY 41 N 1.41 -0.44 3.69 -0.72 0.00 0.76 -4.18 105.19 105.71 1jtd n GLY 41 Ca 0.04 0.17 -0.10 0.00 0.00 0.00 0.00 46.02 46.13 1jtd n GLY 41 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1jtd s ALA 42 N -3.35 -0.34 0.22 4.61 0.00 -1.16 -4.45 121.76 117.29 1jtd s ALA 42 Ca 0.26 -0.89 -0.25 0.00 0.00 0.00 0.00 51.96 51.08 1jtd s ALA 42 Cb -0.12 0.91 -0.09 0.00 0.00 0.00 0.00 23.12 23.83 1jtd s ALA 42 CO 0.74 -0.92 0.82 1.03 0.00 0.00 0.00 175.76 177.43 1jtd s ARG 43 N -3.15 4.54 -0.05 0.00 0.52 -1.14 -4.47 118.95 115.19 1jtd s ARG 43 Ca 0.20 1.17 0.01 0.00 -0.52 0.00 0.00 55.73 56.59 1jtd s ARG 43 Cb -0.03 -3.08 0.02 0.00 0.52 0.00 0.00 34.95 32.38 1jtd s ARG 43 CO 0.12 0.47 -0.05 0.08 0.02 0.00 0.00 175.30 175.94 1jtd s VAL 44 N -1.33 0.59 -0.09 3.52 1.01 -1.26 -2.50 120.40 120.34 1jtd s VAL 44 Ca 0.41 -0.13 -0.01 0.00 0.00 0.00 0.00 61.98 62.25 1jtd s VAL 44 Cb -0.21 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.52 1jtd s VAL 44 CO 0.25 0.25 -0.04 -0.83 0.00 0.00 0.00 175.10 174.73 1jtd s GLY 45 N 1.04 1.74 -0.05 4.51 0.00 0.46 -4.64 107.32 110.38 1jtd s GLY 45 Ca -0.09 -0.85 -0.04 0.00 0.00 0.00 0.00 44.72 43.73 1jtd s GLY 45 CO -0.01 -0.50 0.13 -0.47 0.00 0.00 0.00 173.10 172.26 1jtd s TYR 46 N -0.55 -0.14 -0.14 1.90 5.04 0.83 -1.69 117.35 122.61 1jtd s TYR 46 Ca 0.08 0.36 -0.07 0.00 -2.44 0.00 0.00 57.07 55.00 1jtd s TYR 46 Cb -0.12 0.04 0.05 0.00 0.35 0.00 0.00 41.96 42.29 1jtd s TYR 46 CO 0.02 -0.07 0.33 -1.50 -1.34 0.00 0.00 175.55 172.99 1jtd s ILE 47 N 0.13 -0.03 -0.21 3.14 1.10 -0.69 -0.16 121.20 124.48 1jtd s ILE 47 Ca -0.01 0.12 0.01 0.00 -0.51 0.00 0.00 60.65 60.27 1jtd s ILE 47 Cb -0.02 -0.50 0.04 0.00 0.15 0.00 0.00 42.46 42.13 1jtd s ILE 47 CO -0.00 0.05 -0.12 -0.70 -2.11 0.00 0.00 174.94 172.05 1jtd s GLU 48 N 1.33 2.28 0.06 3.50 2.12 -0.30 -0.92 118.70 126.77 1jtd s GLU 48 Ca -0.09 -0.98 0.04 0.00 0.36 0.00 0.00 54.97 54.30 1jtd s GLU 48 Cb -0.09 -2.58 -0.04 0.00 0.26 0.00 0.00 34.13 31.68 1jtd s GLU 48 CO -0.11 -0.42 -0.03 -0.51 -0.54 0.00 0.00 175.26 173.65 1jtd s LEU 49 N 1.30 3.32 -0.26 2.70 1.02 0.14 -0.58 118.68 126.32 1jtd s LEU 49 Ca -0.02 -0.19 -0.24 0.00 0.02 0.00 0.00 54.13 53.70 1jtd s LEU 49 Cb -0.17 -2.02 -0.00 0.00 0.02 0.00 0.00 46.19 44.02 1jtd s LEU 49 CO -0.08 0.21 0.81 -0.62 0.02 0.00 0.00 176.35 176.69 1jtd s ASP 50 N -1.98 6.78 0.29 2.29 -1.08 -0.08 -0.83 116.67 122.07 1jtd s ASP 50 Ca 0.22 0.93 0.02 0.00 -0.52 0.00 0.00 52.55 53.20 1jtd s ASP 50 Cb -0.11 -2.43 0.59 0.00 -1.46 0.00 0.00 42.92 39.51 1jtd s ASP 50 CO 0.14 -0.54 1.84 0.25 0.52 0.00 0.00 175.17 177.38 1jtd h LEU 51 N 9.25 0.90 0.08 -1.34 5.85 -1.60 0.36 115.31 128.81 1jtd h LEU 51 Ca -0.23 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.53 1jtd h LEU 51 Cb 1.09 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.99 1jtd h LEU 51 CO 0.87 0.48 -0.04 0.78 -0.34 0.00 0.00 178.44 180.19 1jtd h ASN 52 N 0.96 -0.09 0.69 1.25 4.21 -1.92 -3.36 115.58 117.33 1jtd h ASN 52 Ca 0.49 0.00 -0.07 0.00 1.21 0.00 0.00 56.30 57.93 1jtd h ASN 52 Cb 0.51 0.02 -0.01 0.00 -1.12 0.00 0.00 38.32 37.73 1jtd h ASN 52 CO -0.26 0.00 -0.34 0.77 -1.29 0.00 0.00 177.43 176.32 1jtd h SER 53 N -0.23 0.00 -0.54 5.81 4.64 -1.96 -3.46 113.55 117.80 1jtd h SER 53 Ca -0.01 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.22 1jtd h SER 53 Cb 0.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.15 1jtd h SER 53 CO 0.02 0.34 -0.11 0.61 -0.87 0.00 0.00 176.83 176.81 1jtd n GLY 54 N -0.02 0.33 3.82 -0.77 0.00 0.13 -5.02 105.19 103.67 1jtd n GLY 54 Ca -0.01 -0.74 -0.38 0.00 0.00 0.00 0.00 46.02 44.90 1jtd n GLY 54 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1jtd s LYS 55 N -3.72 4.11 -0.21 1.61 2.20 -1.23 -4.78 119.74 117.72 1jtd s LYS 55 Ca 0.00 0.63 -0.29 0.00 -0.36 0.00 0.00 55.97 55.95 1jtd s LYS 55 Cb 0.00 -3.15 -0.01 0.00 -1.51 0.00 0.00 37.83 33.17 1jtd s LYS 55 CO 0.00 0.60 1.22 0.42 -0.36 0.00 0.00 175.35 177.22 1jtd s ILE 56 N -1.21 4.35 -0.13 5.43 1.01 -1.26 -0.90 121.20 128.49 1jtd s ILE 56 Ca 0.31 1.61 0.20 0.00 0.00 0.00 0.00 60.65 62.77 1jtd s ILE 56 Cb -0.18 -4.10 -0.19 0.00 0.01 0.00 0.00 42.46 38.00 1jtd s ILE 56 CO 0.18 -0.21 0.64 0.18 0.00 0.00 0.00 174.94 175.73 1jtd n LEU 57 N 6.72 0.44 -3.60 2.97 4.77 0.26 -4.97 117.00 123.59 1jtd n LEU 57 Ca 0.14 0.19 -0.08 0.00 -0.03 0.00 0.00 56.01 56.22 1jtd n LEU 57 Cb 0.45 0.09 -0.05 0.00 -2.33 0.00 0.00 43.42 41.58 1jtd n LEU 57 CO 0.56 0.08 0.89 -0.70 -1.33 0.00 0.00 177.39 176.90 1jtd s GLU 58 N -3.14 0.42 0.12 3.23 2.56 -1.17 -5.00 118.70 115.72 1jtd s GLU 58 Ca -0.05 0.13 -0.25 0.00 0.00 0.00 0.00 54.97 54.80 1jtd s GLU 58 Cb 0.10 0.20 0.08 0.00 2.00 0.00 0.00 34.13 36.51 1jtd s GLU 58 CO 0.84 -0.13 0.71 -1.54 -0.56 0.00 0.00 175.26 174.59 1jtd s SER 59 N -0.99 -0.47 -0.26 -1.70 1.04 -1.26 -1.14 113.70 108.92 1jtd s SER 59 Ca 0.02 -0.06 -0.10 0.00 0.48 0.00 0.00 55.95 56.28 1jtd s SER 59 Cb -0.01 0.54 0.10 0.00 0.10 0.00 0.00 66.02 66.75 1jtd s SER 59 CO -0.02 -0.89 0.57 0.12 0.98 0.00 0.00 173.24 174.00 1jtd s PHE 60 N -3.55 -1.08 -1.55 5.02 5.36 0.78 -4.89 117.98 118.08 1jtd s PHE 60 Ca 0.03 1.97 -0.14 0.00 -0.96 0.00 0.00 56.93 57.84 1jtd s PHE 60 Cb -0.01 0.59 0.09 0.00 -0.34 0.00 0.00 43.02 43.35 1jtd s PHE 60 CO -0.10 -0.56 0.92 0.54 -1.46 0.00 0.00 175.22 174.56 1jtd n ARG 61 N 5.14 -5.07 0.09 10.12 1.74 -1.26 -0.12 116.66 127.30 1jtd n ARG 61 Ca -0.13 0.57 0.16 0.00 -0.77 0.00 0.00 57.85 57.68 1jtd n ARG 61 Cb 0.51 -5.43 0.69 0.00 -1.02 0.00 0.00 32.46 27.21 1jtd n ARG 61 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 1jtd h PRO 62 N -1.93 0.00 -0.45 5.56 0.13 -1.90 -2.59 132.00 130.83 1jtd h PRO 62 Ca -0.57 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 1jtd h PRO 62 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1jtd h PRO 62 CO 0.68 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.84 1jtd n GLU 63 N -4.37 3.21 -3.38 0.86 1.02 -1.26 -1.95 120.64 114.78 1jtd n GLU 63 Ca 0.05 -2.59 -0.30 0.00 -0.02 0.00 0.00 57.16 54.30 1jtd n GLU 63 Cb 0.43 -1.66 -0.04 0.00 -0.02 0.00 0.00 31.44 30.15 1jtd n GLU 63 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1jtd s GLU 64 N -1.80 3.71 0.18 3.49 2.02 -0.97 -4.95 118.70 120.38 1jtd s GLU 64 Ca 0.39 0.14 -0.18 0.00 0.02 0.00 0.00 54.97 55.34 1jtd s GLU 64 Cb 0.26 -2.65 -0.08 0.00 0.10 0.00 0.00 34.13 31.76 1jtd s GLU 64 CO 0.18 0.27 0.65 1.03 0.02 0.00 0.00 175.26 177.41 1jtd s ARG 65 N -3.18 4.16 -0.03 1.61 0.52 -1.26 -4.11 118.95 116.65 1jtd s ARG 65 Ca 0.46 0.73 -0.07 0.00 -0.52 0.00 0.00 55.73 56.32 1jtd s ARG 65 Cb -0.11 -2.93 0.01 0.00 0.52 0.00 0.00 34.95 32.44 1jtd s ARG 65 CO 0.26 0.44 0.16 -0.06 0.02 0.00 0.00 175.30 176.13 1jtd s PHE 66 N -1.47 -0.09 0.25 -0.53 0.40 -0.30 -4.94 117.98 111.30 1jtd s PHE 66 Ca 0.40 0.20 -0.30 0.00 -0.60 0.00 0.00 56.93 56.63 1jtd s PHE 66 Cb -0.16 0.02 -0.10 0.00 0.51 0.00 0.00 43.02 43.28 1jtd s PHE 66 CO 0.20 -0.19 1.51 -1.25 0.70 0.00 0.00 175.22 176.19 1jtd s PRO 67 N -0.60 4.21 0.19 0.24 0.04 -1.26 -1.68 135.00 136.14 1jtd s PRO 67 Ca -0.07 2.40 -0.02 0.00 0.04 0.00 0.00 61.00 63.35 1jtd s PRO 67 Cb -0.04 -3.09 0.12 0.00 0.04 0.00 0.00 34.50 31.52 1jtd s PRO 67 CO 0.01 -0.52 1.49 0.52 0.04 0.00 0.00 177.00 178.55 1jtd h MET 68 N 5.28 0.49 0.00 4.56 2.86 -1.69 -3.47 114.93 122.96 1jtd h MET 68 Ca -0.46 -0.33 0.00 0.00 -2.06 0.00 0.00 59.70 56.85 1jtd h MET 68 Cb 1.22 0.05 0.00 0.00 0.06 0.00 0.00 31.60 32.92 1jtd h MET 68 CO 0.81 0.94 0.00 -1.33 1.06 0.00 0.00 176.91 178.39 1jtd n MET 69 N -3.92 0.00 0.00 1.72 2.81 -1.26 -1.84 117.12 114.63 1jtd n MET 69 Ca -0.03 0.00 0.03 0.00 -1.81 0.00 0.00 57.70 55.89 1jtd n MET 69 Cb 0.63 0.00 0.14 0.00 -0.71 0.00 0.00 33.22 33.28 1jtd n MET 69 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1jtd n SER 70 N -1.95 0.00 0.25 7.83 7.64 -1.26 -2.57 113.62 123.55 1jtd n SER 70 Ca 0.00 0.40 0.17 0.00 1.01 0.00 0.00 58.87 60.45 1jtd n SER 70 Cb 0.00 -0.43 0.84 0.00 -1.01 0.00 0.00 64.21 63.61 1jtd n SER 70 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 1jtd h THR 71 N 0.00 0.00 0.00 0.44 1.35 -1.47 -0.85 112.91 112.38 1jtd h THR 71 Ca 0.00 -0.13 -0.02 0.00 -0.55 0.00 0.00 66.41 65.72 1jtd h THR 71 Cb 0.09 0.93 -0.00 0.00 -1.73 0.00 0.00 68.15 67.44 1jtd h THR 71 CO 0.00 0.00 -0.08 2.19 -0.25 0.00 0.00 175.52 177.38 1jtd h PHE 72 N 0.00 0.00 0.00 4.73 -5.15 -1.67 -3.10 116.94 111.75 1jtd h PHE 72 Ca 0.00 0.00 -0.00 0.00 -0.20 0.00 0.00 57.97 57.77 1jtd h PHE 72 Cb 0.14 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 36.31 1jtd h PHE 72 CO 0.00 0.08 -0.00 0.87 -2.00 0.00 0.00 178.31 177.25 1jtd h LYS 73 N 0.00 0.00 -0.06 6.09 1.57 -1.40 0.76 116.57 123.54 1jtd h LYS 73 Ca -0.00 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.62 1jtd h LYS 73 Cb 0.49 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 1jtd h LYS 73 CO 0.01 0.00 -0.67 0.28 -0.57 0.00 0.00 179.45 178.50 1jtd h VAL 74 N 0.00 1.41 -0.12 0.50 2.07 -1.74 -1.19 116.25 117.18 1jtd h VAL 74 Ca -0.00 -2.14 -0.22 0.00 0.82 0.00 0.00 66.70 65.16 1jtd h VAL 74 Cb 0.01 2.11 0.01 0.00 -1.52 0.00 0.00 31.29 31.90 1jtd h VAL 74 CO 0.00 0.63 -0.80 -0.07 0.02 0.00 0.00 177.57 177.35 1jtd h LEU 75 N 0.17 0.91 -0.17 2.57 3.38 -1.11 -1.83 115.31 119.23 1jtd h LEU 75 Ca -0.02 -0.65 0.03 0.00 0.09 0.00 0.00 57.88 57.33 1jtd h LEU 75 Cb 1.21 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 41.66 1jtd h LEU 75 CO 0.10 1.42 -0.05 0.25 0.09 0.00 0.00 178.44 180.26 1jtd h LEU 76 N 0.46 -0.17 -1.49 1.67 5.85 -0.95 -0.83 115.31 119.86 1jtd h LEU 76 Ca -0.07 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 1jtd h LEU 76 Cb 1.44 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 42.58 1jtd h LEU 76 CO 0.16 -0.06 -0.22 0.00 -0.34 0.00 0.00 178.44 177.98 1jtd h GLY 78 N 1.35 0.76 1.23 0.00 0.00 -0.34 0.31 103.07 106.38 1jtd h GLY 78 Ca -0.00 -0.38 -0.06 0.00 0.00 0.00 0.00 47.33 46.88 1jtd h GLY 78 CO 0.03 0.36 0.11 0.00 0.00 0.00 0.00 176.54 177.05 1jtd h ALA 79 N 1.07 1.07 -0.25 3.60 0.00 -0.35 -0.92 119.26 123.49 1jtd h ALA 79 Ca 0.17 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1jtd h ALA 79 Cb 0.13 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1jtd h ALA 79 CO -0.02 0.61 0.08 0.28 0.00 0.00 0.00 179.25 180.20 1jtd h VAL 80 N 0.91 1.19 -0.58 0.00 2.07 -0.81 -2.45 116.25 116.57 1jtd h VAL 80 Ca 0.19 -0.59 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 1jtd h VAL 80 Cb 0.37 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.22 1jtd h VAL 80 CO 0.01 0.19 0.18 -0.07 0.02 0.00 0.00 177.57 177.90 1jtd h LEU 81 N 0.24 0.79 -1.05 2.57 3.38 -0.65 -1.02 115.31 119.58 1jtd h LEU 81 Ca 0.08 -0.12 0.04 0.00 0.09 0.00 0.00 57.88 57.97 1jtd h LEU 81 Cb 0.22 -0.21 -0.06 0.00 0.09 0.00 0.00 40.66 40.71 1jtd h LEU 81 CO -0.00 0.75 0.64 -1.28 0.09 0.00 0.00 178.44 178.63 1jtd h SER 82 N 0.84 1.06 -0.07 -0.43 0.87 -0.96 0.20 113.55 115.06 1jtd h SER 82 Ca 0.19 -0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.59 1jtd h SER 82 Cb 0.24 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 1jtd h SER 82 CO -0.01 0.73 -0.46 0.03 -0.53 0.00 0.00 176.83 176.59 1jtd h ARG 83 N 1.23 0.62 -0.33 2.24 3.08 -0.86 -1.57 114.38 118.79 1jtd h ARG 83 Ca 0.39 -0.35 -0.03 0.00 0.07 0.00 0.00 59.98 60.06 1jtd h ARG 83 Cb 0.01 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.07 1jtd h ARG 83 CO -0.12 0.95 0.09 0.28 -1.07 0.00 0.00 179.97 180.10 1jtd h VAL 84 N 0.50 1.22 -0.74 2.04 2.07 -0.12 0.35 116.25 121.58 1jtd h VAL 84 Ca 0.03 -0.73 0.06 0.00 0.82 0.00 0.00 66.70 66.87 1jtd h VAL 84 Cb 0.99 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 31.77 1jtd h VAL 84 CO 0.09 0.25 0.44 0.44 0.02 0.00 0.00 177.57 178.80 1jtd h ASP 85 N 0.39 0.67 0.19 0.57 3.45 -0.52 -0.57 116.42 120.60 1jtd h ASP 85 Ca 0.11 0.02 0.00 0.00 0.43 0.00 0.00 57.03 57.59 1jtd h ASP 85 Cb 0.29 -0.12 0.00 0.00 -0.56 0.00 0.00 39.33 38.94 1jtd h ASP 85 CO 0.00 0.44 0.00 0.00 -1.57 0.00 0.00 179.24 178.11 1jtd n ALA 86 N -2.35 2.61 -1.12 3.45 0.00 -0.60 -4.89 120.51 117.60 1jtd n ALA 86 Ca 0.10 -0.18 -0.01 0.00 0.00 0.00 0.00 53.44 53.35 1jtd n ALA 86 Cb 0.16 -1.51 -0.00 0.00 0.00 0.00 0.00 19.45 18.10 1jtd n ALA 86 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jtd n GLY 87 N 1.07 0.45 1.04 0.00 0.00 -0.22 -4.93 105.19 102.60 1jtd n GLY 87 Ca 0.20 -1.03 0.12 0.00 0.00 0.00 0.00 46.02 45.32 1jtd n GLY 87 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1jtd n GLN 88 N -2.80 2.40 -3.61 1.61 6.02 0.11 -4.96 117.38 116.15 1jtd n GLN 88 Ca -0.01 -2.07 -0.12 0.00 -0.01 0.00 0.00 57.00 54.80 1jtd n GLN 88 Cb 0.08 -1.49 -0.05 0.00 1.02 0.00 0.00 30.24 29.80 1jtd n GLN 88 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 1jtd s GLU 89 N -1.78 1.05 -0.06 -1.09 2.56 -1.15 -4.90 118.70 113.33 1jtd s GLU 89 Ca 0.33 -0.54 0.03 0.00 0.00 0.00 0.00 54.97 54.79 1jtd s GLU 89 Cb 0.21 0.47 0.00 0.00 2.00 0.00 0.00 34.13 36.82 1jtd s GLU 89 CO 0.31 -0.40 -0.17 -0.65 -0.56 0.00 0.00 175.26 173.79 1jtd s GLN 90 N -3.31 2.05 0.53 4.30 1.11 -1.26 -4.28 119.66 118.80 1jtd s GLN 90 Ca -0.00 -0.60 0.30 0.00 0.01 0.00 0.00 55.36 55.07 1jtd s GLN 90 Cb 0.01 -1.67 1.48 0.00 -1.01 0.00 0.00 33.01 31.82 1jtd s GLN 90 CO -0.09 0.14 2.06 -0.07 0.01 0.00 0.00 175.29 177.35 1jtd h LEU 91 N 6.64 0.00 -0.63 2.90 3.38 -1.96 -2.41 115.31 123.23 1jtd h LEU 91 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1jtd h LEU 91 Cb 1.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.94 1jtd h LEU 91 CO 0.47 0.10 -0.33 0.61 0.09 0.00 0.00 178.44 179.38 1jtd n GLY 92 N -0.51 -0.44 3.71 0.83 0.00 -1.26 -0.63 105.19 106.90 1jtd n GLY 92 Ca -0.01 -0.48 -0.42 0.00 0.00 0.00 0.00 46.02 45.11 1jtd n GLY 92 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1jtd s ARG 93 N -2.51 4.15 -0.10 1.61 3.52 -0.91 -4.72 118.95 119.99 1jtd s ARG 93 Ca 0.22 2.55 -0.19 0.00 -0.13 0.00 0.00 55.73 58.18 1jtd s ARG 93 Cb 0.19 -3.24 -0.04 0.00 -1.56 0.00 0.00 34.95 30.30 1jtd s ARG 93 CO 0.54 -0.75 0.52 0.50 -0.81 0.00 0.00 175.30 175.30 1jtd s ARG 94 N 1.61 4.35 -0.18 5.12 3.52 -1.26 -1.37 118.95 130.75 1jtd s ARG 94 Ca 0.75 0.54 -0.02 0.00 -0.13 0.00 0.00 55.73 56.87 1jtd s ARG 94 Cb -0.47 -3.43 -0.01 0.00 -1.56 0.00 0.00 34.95 29.48 1jtd s ARG 94 CO 0.33 0.16 -0.10 0.42 -0.81 0.00 0.00 175.30 175.30 1jtd s ILE 95 N 0.60 3.10 -0.13 4.11 1.01 0.82 -4.94 121.20 125.78 1jtd s ILE 95 Ca 0.28 -0.61 -0.07 0.00 0.00 0.00 0.00 60.65 60.25 1jtd s ILE 95 Cb -0.16 -2.36 -0.04 0.00 0.01 0.00 0.00 42.46 39.92 1jtd s ILE 95 CO 0.12 0.48 0.14 -1.00 0.00 0.00 0.00 174.94 174.68 1jtd s HIS 96 N 0.97 3.58 0.40 3.97 3.76 -1.26 -1.32 115.29 125.39 1jtd s HIS 96 Ca -0.01 0.51 0.05 0.00 -0.15 0.00 0.00 55.06 55.46 1jtd s HIS 96 Cb -0.15 -1.96 -0.02 0.00 1.11 0.00 0.00 32.58 31.56 1jtd s HIS 96 CO -0.01 0.70 0.19 1.52 -0.85 0.00 0.00 174.74 176.29 1jtd s TYR 97 N -0.90 1.78 0.36 1.40 1.13 -1.26 -5.04 117.35 114.82 1jtd s TYR 97 Ca 0.14 -1.46 0.04 0.00 -1.41 0.00 0.00 57.07 54.38 1jtd s TYR 97 Cb -0.12 -1.00 -0.05 0.00 -1.10 0.00 0.00 41.96 39.69 1jtd s TYR 97 CO 0.03 -0.54 0.07 -1.54 -2.51 0.00 0.00 175.55 171.06 1jtd s SER 98 N -3.55 2.71 0.51 -0.18 1.04 -1.26 -4.87 113.70 108.11 1jtd s SER 98 Ca 0.28 -1.46 0.30 0.00 0.48 0.00 0.00 55.95 55.56 1jtd s SER 98 Cb 0.02 0.06 1.43 0.00 0.10 0.00 0.00 66.02 67.62 1jtd s SER 98 CO 0.20 -0.68 1.86 1.56 0.98 0.00 0.00 173.24 177.15 1jtd h GLN 99 N 1.96 0.07 0.00 4.02 7.50 -1.99 0.34 115.11 127.01 1jtd h GLN 99 Ca -0.40 -0.00 0.00 0.00 0.50 0.00 0.00 58.65 58.74 1jtd h GLN 99 Cb 1.26 -0.02 0.00 0.00 0.05 0.00 0.00 27.48 28.77 1jtd h GLN 99 CO 0.68 0.05 0.00 -0.97 -1.50 0.00 0.00 178.83 177.09 1jtd h ASN 100 N 0.08 0.00 1.01 1.46 -1.24 -2.05 -2.89 115.58 111.95 1jtd h ASN 100 Ca 0.47 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.48 1jtd h ASN 100 Cb 1.76 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.81 1jtd h ASN 100 CO -0.05 0.00 -0.89 0.44 -1.29 0.00 0.00 177.43 175.65 1jtd h ASP 101 N 0.00 0.00 -3.48 1.15 3.32 -0.72 -3.47 116.42 113.22 1jtd h ASP 101 Ca 0.00 -0.05 -0.52 0.00 0.02 0.00 0.00 57.03 56.48 1jtd h ASP 101 Cb 0.28 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.86 1jtd h ASP 101 CO 0.00 0.02 0.59 -0.76 -1.72 0.00 0.00 179.24 177.38 1jtd s LEU 102 N -5.17 4.44 0.28 1.55 1.43 -1.09 -4.86 118.68 115.26 1jtd s LEU 102 Ca 0.01 2.31 0.03 0.00 -1.03 0.00 0.00 54.13 55.45 1jtd s LEU 102 Cb 0.10 -3.61 -0.06 0.00 0.03 0.00 0.00 46.19 42.65 1jtd s LEU 102 CO 0.77 -0.43 0.05 0.68 0.23 0.00 0.00 176.35 177.66 1jtd s VAL 103 N -0.07 0.95 0.97 -1.59 -7.23 -1.26 -5.08 120.40 107.08 1jtd s VAL 103 Ca 0.54 -2.01 -0.12 0.00 -1.81 0.00 0.00 61.98 58.58 1jtd s VAL 103 Cb -0.34 -2.62 0.11 0.00 0.56 0.00 0.00 36.38 34.09 1jtd s VAL 103 CO 0.38 -0.09 0.76 -1.84 -0.31 0.00 0.00 175.10 173.99 1jtd n GLU 104 N -0.54 -0.62 -3.55 4.82 0.28 -1.26 -3.86 120.64 115.90 1jtd n GLU 104 Ca -0.02 -0.13 -0.20 0.00 -0.16 0.00 0.00 57.16 56.64 1jtd n GLU 104 Cb 0.66 -2.10 0.07 0.00 1.43 0.00 0.00 31.44 31.50 1jtd n GLU 104 CO 0.00 0.00 0.00 0.66 -0.16 0.00 0.00 177.13 177.63 1jtd n TYR 105 N -4.06 -2.31 -3.17 -1.84 4.01 -1.26 -4.44 117.16 104.10 1jtd n TYR 105 Ca 0.08 0.94 -0.25 0.00 -0.16 0.00 0.00 57.90 58.51 1jtd n TYR 105 Cb 0.53 -4.88 -0.05 0.00 -0.31 0.00 0.00 39.34 34.63 1jtd n TYR 105 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1jtd n SER 106 N -3.07 2.88 -0.34 7.72 7.64 -1.25 -1.59 113.62 125.60 1jtd n SER 106 Ca -0.20 -3.33 0.02 0.00 1.01 0.00 0.00 58.87 56.37 1jtd n SER 106 Cb 0.64 -0.62 0.19 0.00 -1.01 0.00 0.00 64.21 63.41 1jtd n SER 106 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1jtd h PRO 107 N 3.49 1.13 0.00 1.43 0.13 -1.93 -2.08 132.00 134.18 1jtd h PRO 107 Ca 0.13 -0.07 -0.09 0.00 -0.87 0.00 0.00 66.00 65.11 1jtd h PRO 107 Cb 0.70 -0.26 -0.01 0.00 0.13 0.00 0.00 31.00 31.56 1jtd h PRO 107 CO 0.71 0.75 -0.50 0.28 -0.23 0.00 0.00 178.00 179.00 1jtd h VAL 108 N 1.17 1.23 -0.46 1.56 2.07 -1.95 -3.37 116.25 116.50 1jtd h VAL 108 Ca 0.39 -2.11 -0.00 0.00 0.82 0.00 0.00 66.70 65.81 1jtd h VAL 108 Cb 0.08 2.50 -0.02 0.00 -1.52 0.00 0.00 31.29 32.33 1jtd h VAL 108 CO -0.13 0.42 0.28 0.71 0.02 0.00 0.00 177.57 178.86 1jtd h THR 109 N -1.00 1.13 0.00 2.57 1.35 -1.97 -1.76 112.91 113.23 1jtd h THR 109 Ca -0.13 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 1jtd h THR 109 Cb 1.01 0.48 0.00 0.00 -1.73 0.00 0.00 68.15 67.91 1jtd h THR 109 CO -0.08 0.13 0.00 1.05 -0.25 0.00 0.00 175.52 176.37 1jtd h GLU 110 N 0.62 0.00 0.00 4.72 4.11 -1.55 -1.63 114.58 120.86 1jtd h GLU 110 Ca 0.17 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.60 1jtd h GLU 110 Cb -0.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.21 1jtd h GLU 110 CO -0.03 0.00 -0.61 1.17 0.07 0.00 0.00 179.01 179.61 1jtd n LYS 111 N -2.75 0.16 -1.49 1.06 4.81 -0.66 -4.34 118.16 114.95 1jtd n LYS 111 Ca -0.01 0.04 -0.19 0.00 -0.87 0.00 0.00 58.31 57.27 1jtd n LYS 111 Cb 0.13 -1.59 0.09 0.00 0.02 0.00 0.00 35.03 33.67 1jtd n LYS 111 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1jtd n HIS 112 N -1.83 2.24 -0.20 5.64 8.25 -0.61 -4.73 115.22 123.98 1jtd n HIS 112 Ca 0.04 -2.18 -0.02 0.00 -0.26 0.00 0.00 57.72 55.31 1jtd n HIS 112 Cb 0.39 -0.59 0.20 0.00 1.12 0.00 0.00 29.99 31.11 1jtd n HIS 112 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1jtd h LEU 113 N 1.77 0.88 0.00 2.41 3.38 -1.76 0.13 115.31 122.12 1jtd h LEU 113 Ca 0.36 -0.08 -0.03 0.00 0.09 0.00 0.00 57.88 58.21 1jtd h LEU 113 Cb 1.40 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.92 1jtd h LEU 113 CO 0.78 0.73 -0.22 0.74 0.09 0.00 0.00 178.44 180.56 1jtd h THR 114 N 0.98 0.89 -0.00 0.22 2.02 -1.89 -3.39 112.91 111.74 1jtd h THR 114 Ca 0.24 -1.73 0.00 0.00 0.77 0.00 0.00 66.41 65.69 1jtd h THR 114 Cb 0.07 1.75 0.00 0.00 -1.74 0.00 0.00 68.15 68.22 1jtd h THR 114 CO -0.04 0.30 -0.16 -0.90 0.37 0.00 0.00 175.52 175.09 1jtd n ASP 115 N -4.65 0.18 -0.64 4.18 3.85 -1.24 -5.02 116.55 113.22 1jtd n ASP 115 Ca -0.09 0.19 0.02 0.00 -0.71 0.00 0.00 54.79 54.19 1jtd n ASP 115 Cb 0.32 -0.23 -0.00 0.00 -1.35 0.00 0.00 41.12 39.85 1jtd n ASP 115 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1jtd n GLY 116 N 1.48 -1.49 3.17 6.12 0.00 0.03 -4.92 105.19 109.57 1jtd n GLY 116 Ca 0.07 -1.19 -0.12 0.00 0.00 0.00 0.00 46.02 44.78 1jtd n GLY 116 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1jtd s MET 117 N -0.25 0.54 0.72 1.61 1.00 -0.44 -4.85 119.30 117.64 1jtd s MET 117 Ca 0.00 -0.23 -0.11 0.00 0.00 0.00 0.00 55.69 55.35 1jtd s MET 117 Cb 0.00 0.24 0.03 0.00 0.00 0.00 0.00 34.83 35.10 1jtd s MET 117 CO 0.00 -0.14 1.10 0.95 0.00 0.00 0.00 175.02 176.93 1jtd s THR 118 N -1.20 3.07 0.20 2.05 -4.23 -1.26 -0.12 115.64 114.14 1jtd s THR 118 Ca -0.13 0.28 -0.11 0.00 -1.18 0.00 0.00 61.69 60.56 1jtd s THR 118 Cb -0.06 -3.33 0.13 0.00 1.34 0.00 0.00 72.50 70.58 1jtd s THR 118 CO 0.03 -0.43 1.85 0.58 -0.54 0.00 0.00 174.62 176.10 1jtd h VAL 119 N -0.71 1.20 -0.34 2.29 2.07 -1.11 0.54 116.25 120.19 1jtd h VAL 119 Ca -0.45 -0.42 0.03 0.00 0.82 0.00 0.00 66.70 66.67 1jtd h VAL 119 Cb 1.28 0.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.23 1jtd h VAL 119 CO 0.64 0.20 0.16 -0.09 0.02 0.00 0.00 177.57 178.50 1jtd h ARG 120 N 0.96 0.33 -0.57 1.57 2.43 -1.16 -0.96 114.38 116.97 1jtd h ARG 120 Ca 0.25 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.36 1jtd h ARG 120 Cb -0.05 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.40 1jtd h ARG 120 CO -0.05 0.22 0.16 0.93 -1.51 0.00 0.00 179.97 179.72 1jtd h GLU 121 N 0.34 0.87 -0.59 0.20 5.08 -1.64 -1.38 114.58 117.45 1jtd h GLU 121 Ca 0.14 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.29 1jtd h GLU 121 Cb 0.06 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.15 1jtd h GLU 121 CO -0.11 0.76 0.20 -0.07 -1.00 0.00 0.00 179.01 178.79 1jtd h LEU 122 N 0.84 0.84 -0.59 1.33 3.38 -0.38 -0.91 115.31 119.82 1jtd h LEU 122 Ca 0.19 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 1jtd h LEU 122 Cb 0.27 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 1jtd h LEU 122 CO -0.01 0.81 0.01 0.00 0.09 0.00 0.00 178.44 179.34 1jtd h SER 124 N 0.93 0.66 -0.45 0.00 0.87 -1.07 -0.19 113.55 114.31 1jtd h SER 124 Ca 0.17 -0.04 -0.12 0.00 -1.23 0.00 0.00 61.79 60.56 1jtd h SER 124 Cb 0.54 -0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.33 1jtd h SER 124 CO 0.03 0.51 -0.19 0.00 -0.53 0.00 0.00 176.83 176.65 1jtd h ALA 125 N 1.18 0.63 -0.21 6.23 0.00 -0.96 0.20 119.26 126.33 1jtd h ALA 125 Ca 0.20 -0.37 -0.02 0.00 0.00 0.00 0.00 54.91 54.71 1jtd h ALA 125 Cb -0.04 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1jtd h ALA 125 CO -0.04 0.59 0.03 0.00 0.00 0.00 0.00 179.25 179.83 1jtd h ALA 126 N 0.85 0.27 0.03 0.00 0.00 -0.82 -1.56 119.26 118.03 1jtd h ALA 126 Ca 0.10 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 1jtd h ALA 126 Cb 0.75 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.47 1jtd h ALA 126 CO 0.06 -0.05 -0.32 0.82 0.00 0.00 0.00 179.25 179.76 1jtd h ILE 127 N 0.14 1.60 0.00 0.00 2.04 -1.03 -2.01 117.51 118.25 1jtd h ILE 127 Ca 0.06 -2.17 -0.00 0.00 1.00 0.00 0.00 64.86 63.75 1jtd h ILE 127 Cb 0.32 3.01 -0.00 0.00 -0.74 0.00 0.00 36.82 39.41 1jtd h ILE 127 CO 0.00 0.59 -0.27 0.71 0.00 0.00 0.00 178.15 179.19 1jtd h THR 128 N -0.58 0.01 0.00 -0.27 1.35 -0.72 -3.36 112.91 109.34 1jtd h THR 128 Ca -0.05 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1jtd h THR 128 Cb 1.15 1.88 0.00 0.00 -1.73 0.00 0.00 68.15 69.45 1jtd h THR 128 CO 0.06 0.01 0.00 0.23 -0.25 0.00 0.00 175.52 175.57 1jtd n MET 129 N -2.99 0.96 -3.97 4.72 2.81 -0.65 -1.31 117.12 116.67 1jtd n MET 129 Ca 0.03 -0.83 -0.30 0.00 -1.81 0.00 0.00 57.70 54.79 1jtd n MET 129 Cb 0.54 -0.82 0.01 0.00 -0.71 0.00 0.00 33.22 32.24 1jtd n MET 129 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91 1jtd n SER 130 N -0.20 -3.42 -4.63 7.83 7.64 -0.75 -4.86 113.62 115.23 1jtd n SER 130 Ca 0.00 -0.87 -0.43 0.00 1.01 0.00 0.00 58.87 58.58 1jtd n SER 130 Cb 0.25 -3.52 -0.02 0.00 -1.01 0.00 0.00 64.21 59.91 1jtd n SER 130 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1jtd s ASP 131 N -3.57 6.52 0.12 6.43 2.15 -0.79 -4.81 116.67 122.71 1jtd s ASP 131 Ca 0.52 1.48 -0.17 0.00 0.43 0.00 0.00 52.55 54.82 1jtd s ASP 131 Cb -0.27 -2.54 -0.03 0.00 -0.30 0.00 0.00 42.92 39.78 1jtd s ASP 131 CO 0.86 -1.16 1.62 0.78 -0.17 0.00 0.00 175.17 177.10 1jtd h ASN 132 N 10.06 0.51 -0.76 -0.34 2.35 -1.51 -2.84 115.58 123.06 1jtd h ASN 132 Ca -0.31 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.20 1jtd h ASN 132 Cb 1.13 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.33 1jtd h ASN 132 CO 1.01 0.60 0.36 0.74 -1.65 0.00 0.00 177.43 178.48 1jtd h THR 133 N 0.41 1.24 -0.45 2.81 2.02 -1.82 -1.42 112.91 115.70 1jtd h THR 133 Ca 0.11 -0.70 0.06 0.00 0.77 0.00 0.00 66.41 66.65 1jtd h THR 133 Cb 0.28 0.30 -0.05 0.00 -1.74 0.00 0.00 68.15 66.93 1jtd h THR 133 CO -0.00 0.29 0.14 0.00 0.37 0.00 0.00 175.52 176.32 1jtd h ALA 134 N 1.18 0.53 -0.75 6.16 0.00 -1.88 0.22 119.26 124.71 1jtd h ALA 134 Ca 0.26 0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.24 1jtd h ALA 134 Cb 0.13 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1jtd h ALA 134 CO -0.03 -0.25 0.48 0.00 0.00 0.00 0.00 179.25 179.44 1jtd h ALA 135 N 1.31 0.95 -0.65 0.00 0.00 -1.20 -0.51 119.26 119.16 1jtd h ALA 135 Ca 0.21 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1jtd h ALA 135 Cb 0.23 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1jtd h ALA 135 CO -0.24 0.40 0.22 -0.91 0.00 0.00 0.00 179.25 178.72 1jtd h ASN 136 N 1.02 0.92 -0.55 0.00 2.35 -0.12 0.14 115.58 119.35 1jtd h ASN 136 Ca 0.27 -0.20 -0.02 0.00 -0.55 0.00 0.00 56.30 55.80 1jtd h ASN 136 Cb -0.08 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.03 1jtd h ASN 136 CO -0.06 0.87 0.25 -0.07 -1.65 0.00 0.00 177.43 176.77 1jtd h LEU 137 N 0.92 0.73 -0.72 1.61 3.38 -0.15 -1.90 115.31 119.19 1jtd h LEU 137 Ca 0.21 -0.15 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1jtd h LEU 137 Cb 0.26 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1jtd h LEU 137 CO -0.01 0.67 -0.17 -0.07 0.09 0.00 0.00 178.44 178.96 1jtd h LEU 138 N 0.74 0.81 -0.92 1.67 3.38 -0.88 -2.26 115.31 117.85 1jtd h LEU 138 Ca 0.19 -0.27 0.05 0.00 0.09 0.00 0.00 57.88 57.94 1jtd h LEU 138 Cb 0.15 -0.22 -0.06 0.00 0.09 0.00 0.00 40.66 40.62 1jtd h LEU 138 CO -0.02 0.98 0.59 -0.07 0.09 0.00 0.00 178.44 180.00 1jtd h LEU 139 N 0.72 0.95 -0.99 1.67 3.38 -0.64 -0.96 115.31 119.44 1jtd h LEU 139 Ca 0.11 0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 1jtd h LEU 139 Cb 0.67 -0.20 -0.03 0.00 0.09 0.00 0.00 40.66 41.20 1jtd h LEU 139 CO 0.05 0.62 0.24 0.74 0.09 0.00 0.00 178.44 180.18 1jtd h THR 140 N 1.10 1.23 0.00 0.22 2.02 -0.78 -0.69 112.91 116.01 1jtd h THR 140 Ca 0.39 -0.75 -0.00 0.00 0.77 0.00 0.00 66.41 66.81 1jtd h THR 140 Cb 0.11 0.48 -0.00 0.00 -1.74 0.00 0.00 68.15 67.00 1jtd h THR 140 CO -0.15 0.30 -0.00 0.71 0.37 0.00 0.00 175.52 176.74 1jtd h THR 141 N 0.94 0.04 -0.02 3.16 1.35 -0.79 -1.89 112.91 115.70 1jtd h THR 141 Ca 0.22 -0.13 0.00 0.00 -0.55 0.00 0.00 66.41 65.94 1jtd h THR 141 Cb 0.21 1.13 0.00 0.00 -1.73 0.00 0.00 68.15 67.76 1jtd h THR 141 CO -0.02 0.00 -0.06 2.30 -0.25 0.00 0.00 175.52 177.50 1jtd n ILE 142 N -3.13 0.00 0.00 6.82 -5.35 -0.76 -4.99 119.36 111.96 1jtd n ILE 142 Ca -0.02 -0.47 0.00 0.00 -0.27 0.00 0.00 62.75 61.99 1jtd n ILE 142 Cb 0.13 1.31 0.00 0.00 -1.74 0.00 0.00 39.64 39.34 1jtd n ILE 142 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1jtd n GLY 143 N 0.96 0.72 0.00 3.28 0.00 -0.71 -4.78 105.19 104.66 1jtd n GLY 143 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1jtd n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1jtd n GLY 144 N -1.29 1.39 0.33 -0.02 0.00 -0.34 -4.66 105.19 100.60 1jtd n GLY 144 Ca 0.00 -2.15 0.08 0.00 0.00 0.00 0.00 46.02 43.95 1jtd n GLY 144 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1jtd h PRO 145 N 0.00 0.44 -0.30 1.61 0.11 -1.87 -2.24 132.00 129.76 1jtd h PRO 145 Ca 0.00 -0.03 -0.05 0.00 0.11 0.00 0.00 66.00 66.03 1jtd h PRO 145 Cb 0.00 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 30.99 1jtd h PRO 145 CO 0.00 0.29 -0.03 0.87 -0.21 0.00 0.00 178.00 178.92 1jtd h LYS 146 N 0.46 0.47 -0.15 1.05 1.79 -1.87 -1.86 116.57 116.45 1jtd h LYS 146 Ca 0.21 -0.10 -0.15 0.00 -2.18 0.00 0.00 60.65 58.43 1jtd h LYS 146 Cb 0.26 -0.07 -0.01 0.00 -1.58 0.00 0.00 32.23 30.83 1jtd h LYS 146 CO -0.05 0.52 -0.54 0.93 -1.08 0.00 0.00 179.45 179.23 1jtd h GLU 147 N 0.45 0.45 -0.47 3.15 4.39 -1.67 0.13 114.58 121.01 1jtd h GLU 147 Ca 0.10 -0.28 -0.09 0.00 0.34 0.00 0.00 59.36 59.42 1jtd h GLU 147 Cb 0.34 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.01 1jtd h GLU 147 CO 0.01 0.88 -0.07 1.25 -1.16 0.00 0.00 179.01 179.92 1jtd h LEU 148 N 0.35 0.87 -1.22 1.33 5.85 -1.37 0.14 115.31 121.25 1jtd h LEU 148 Ca 0.01 -0.34 -0.03 0.00 0.84 0.00 0.00 57.88 58.35 1jtd h LEU 148 Cb 1.06 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.83 1jtd h LEU 148 CO 0.10 1.01 0.19 0.74 -0.34 0.00 0.00 178.44 180.13 1jtd h THR 149 N 0.72 1.19 -0.42 1.05 2.02 -1.08 -0.12 112.91 116.26 1jtd h THR 149 Ca 0.12 -0.61 -0.09 0.00 0.77 0.00 0.00 66.41 66.60 1jtd h THR 149 Cb 0.61 0.61 -0.02 0.00 -1.74 0.00 0.00 68.15 67.61 1jtd h THR 149 CO 0.04 0.24 -0.09 0.00 0.37 0.00 0.00 175.52 176.07 1jtd h ALA 150 N 1.49 1.04 -0.59 6.16 0.00 0.12 -1.38 119.26 126.10 1jtd h ALA 150 Ca 0.17 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1jtd h ALA 150 Cb 0.17 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 1jtd h ALA 150 CO -0.01 0.59 0.32 0.35 0.00 0.00 0.00 179.25 180.49 1jtd h PHE 151 N 0.68 0.82 -0.54 0.00 3.57 0.75 -2.11 116.94 120.12 1jtd h PHE 151 Ca 0.12 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 1jtd h PHE 151 Cb 0.56 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 1jtd h PHE 151 CO 0.03 0.60 0.09 -0.07 -2.23 0.00 0.00 178.31 176.73 1jtd h LEU 152 N 0.80 0.85 -0.36 0.59 3.38 -0.64 -2.81 115.31 117.13 1jtd h LEU 152 Ca 0.21 -0.26 0.01 0.00 0.09 0.00 0.00 57.88 57.93 1jtd h LEU 152 Cb 0.06 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 1jtd h LEU 152 CO -0.03 0.90 0.22 0.45 0.09 0.00 0.00 178.44 180.06 1jtd h HIS 153 N 0.78 0.41 0.00 1.13 3.86 -1.01 -0.22 115.15 120.11 1jtd h HIS 153 Ca 0.16 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.39 1jtd h HIS 153 Cb 0.40 -0.14 0.00 0.00 1.06 0.00 0.00 27.41 28.74 1jtd h HIS 153 CO 0.03 0.25 0.00 0.09 0.86 0.00 0.00 177.93 179.16 1jtd n ASN 154 N -4.87 0.00 -0.10 2.45 3.02 -0.82 -1.36 115.26 113.58 1jtd n ASN 154 Ca -0.00 -0.48 0.08 0.00 -0.03 0.00 0.00 54.58 54.16 1jtd n ASN 154 Cb 0.04 -0.09 -0.08 0.00 -0.61 0.00 0.00 39.78 39.05 1jtd n ASN 154 CO 0.00 0.00 0.00 0.80 -2.62 0.00 0.00 177.26 175.44 1jtd n MET 155 N -1.09 1.32 0.00 3.52 1.56 -0.77 -4.97 117.12 116.68 1jtd n MET 155 Ca 0.14 -0.22 0.00 0.00 -0.27 0.00 0.00 57.70 57.36 1jtd n MET 155 Cb 0.10 -1.33 0.00 0.00 2.15 0.00 0.00 33.22 34.14 1jtd n MET 155 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 1jtd n GLY 156 N 1.37 0.89 3.24 -5.12 0.00 -0.47 -5.06 105.19 100.04 1jtd n GLY 156 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1jtd n GLY 156 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1jtd s ASP 157 N -2.22 5.81 -0.04 1.61 -1.08 -0.16 -4.91 116.67 115.67 1jtd s ASP 157 Ca 0.00 -1.86 0.20 0.00 -0.52 0.00 0.00 52.55 50.37 1jtd s ASP 157 Cb 0.00 -2.05 0.64 0.00 -1.46 0.00 0.00 42.92 40.05 1jtd s ASP 157 CO 0.00 -0.72 1.54 1.41 0.52 0.00 0.00 175.17 177.92 1jtd n HIS 158 N 4.98 1.11 -0.09 -5.34 8.25 -1.26 -3.08 115.22 119.79 1jtd n HIS 158 Ca -0.09 -0.50 -0.16 0.00 -0.26 0.00 0.00 57.72 56.70 1jtd n HIS 158 Cb 0.41 -0.09 -0.05 0.00 1.12 0.00 0.00 29.99 31.38 1jtd n HIS 158 CO 0.00 0.00 0.00 0.28 0.64 0.00 0.00 176.34 177.26 1jtd n VAL 159 N 1.36 1.38 -1.70 1.59 0.31 -1.26 -4.99 118.33 115.01 1jtd n VAL 159 Ca 0.24 -0.06 -0.43 0.00 -0.01 0.00 0.00 64.34 64.07 1jtd n VAL 159 Cb 0.68 -2.04 -0.03 0.00 -0.91 0.00 0.00 33.84 31.55 1jtd n VAL 159 CO 0.00 0.00 0.00 0.41 -1.32 0.00 0.00 176.83 175.92 1jtd n THR 160 N -4.19 0.08 -3.87 2.52 -1.04 -1.26 -4.80 114.28 101.73 1jtd n THR 160 Ca -0.29 -0.02 -0.12 0.00 -2.04 0.00 0.00 64.05 61.59 1jtd n THR 160 Cb 0.63 -1.92 -0.14 0.00 -1.82 0.00 0.00 70.33 67.08 1jtd n THR 160 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1jtd s ARG 161 N 1.49 0.01 -0.13 -2.82 1.70 -0.64 -4.88 118.95 113.67 1jtd s ARG 161 Ca 0.78 0.02 0.02 0.00 -0.47 0.00 0.00 55.73 56.07 1jtd s ARG 161 Cb -0.54 0.00 -0.00 0.00 -0.57 0.00 0.00 34.95 33.84 1jtd s ARG 161 CO 0.35 -0.00 -0.20 -1.17 -1.08 0.00 0.00 175.30 173.20 1jtd s LEU 162 N 0.02 2.29 -0.04 -1.89 2.96 -1.26 -2.45 118.68 118.31 1jtd s LEU 162 Ca -0.00 -0.51 0.02 0.00 -0.22 0.00 0.00 54.13 53.42 1jtd s LEU 162 Cb -0.00 -1.49 -0.04 0.00 0.50 0.00 0.00 46.19 45.16 1jtd s LEU 162 CO -0.00 0.12 -0.00 0.47 -1.32 0.00 0.00 176.35 175.62 1jtd n ASP 163 N 3.78 3.98 -4.80 3.68 9.92 -1.26 -4.28 116.55 127.57 1jtd n ASP 163 Ca -0.19 -0.01 -0.32 0.00 -0.53 0.00 0.00 54.79 53.74 1jtd n ASP 163 Cb 0.52 0.37 -0.06 0.00 -0.64 0.00 0.00 41.12 41.31 1jtd n ASP 163 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1jtd s ARG 164 N -2.09 2.22 0.54 -1.24 0.52 -1.26 -4.83 118.95 112.82 1jtd s ARG 164 Ca -0.03 -2.37 0.08 0.00 -0.52 0.00 0.00 55.73 52.89 1jtd s ARG 164 Cb 0.01 -1.61 0.05 0.00 0.52 0.00 0.00 34.95 33.92 1jtd s ARG 164 CO 0.13 -0.43 0.58 -1.58 0.02 0.00 0.00 175.30 174.03 1jtd s TRP 165 N -2.88 1.65 0.34 -0.53 0.52 -1.26 -4.73 118.94 112.06 1jtd s TRP 165 Ca 0.08 -0.75 -0.26 0.00 0.02 0.00 0.00 56.10 55.20 1jtd s TRP 165 Cb 0.00 -2.08 -0.09 0.00 -1.15 0.00 0.00 33.47 30.14 1jtd s TRP 165 CO 0.05 -0.76 1.00 -1.21 0.02 0.00 0.00 176.95 176.05 1jtd s GLU 166 N -4.45 4.44 0.00 4.98 0.41 -1.26 -1.79 118.70 121.04 1jtd s GLU 166 Ca 0.48 1.46 0.24 0.00 -0.41 0.00 0.00 54.97 56.74 1jtd s GLU 166 Cb -0.04 -2.76 0.29 0.00 -1.78 0.00 0.00 34.13 29.84 1jtd s GLU 166 CO 0.30 0.12 1.27 -0.35 -0.49 0.00 0.00 175.26 176.11 1jtd n PRO 167 N 0.42 0.75 -0.32 0.39 -0.04 -1.26 -4.91 135.00 130.04 1jtd n PRO 167 Ca 0.03 -0.55 0.16 0.00 -0.04 0.00 0.00 63.50 63.10 1jtd n PRO 167 Cb 0.49 -1.49 0.41 0.00 -0.04 0.00 0.00 33.50 32.87 1jtd n PRO 167 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 1jtd h GLU 168 N 1.35 0.58 0.00 0.54 3.07 -1.89 -2.19 114.58 116.05 1jtd h GLU 168 Ca 0.00 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.83 1jtd h GLU 168 Cb 0.60 -0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.38 1jtd h GLU 168 CO 0.00 0.38 0.00 1.47 -1.40 0.00 0.00 179.01 179.46 1jtd n LEU 169 N -4.66 0.03 -0.74 1.33 -0.00 -0.74 -1.43 117.00 110.79 1jtd n LEU 169 Ca 0.22 0.52 0.12 0.00 -0.00 0.00 0.00 56.01 56.87 1jtd n LEU 169 Cb 0.66 -0.52 0.33 0.00 -0.00 0.00 0.00 43.42 43.89 1jtd n LEU 169 CO 0.25 -0.51 0.76 0.59 -0.00 0.00 0.00 177.39 178.47 1jtd n ASN 170 N -1.54 2.26 -0.14 1.45 3.02 -0.82 -4.53 115.26 114.96 1jtd n ASN 170 Ca 0.00 -1.77 0.20 0.00 -0.03 0.00 0.00 54.58 52.98 1jtd n ASN 170 Cb 0.01 -0.08 0.60 0.00 -0.61 0.00 0.00 39.78 39.70 1jtd n ASN 170 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1jtd h GLU 171 N 3.24 0.22 -6.70 3.52 4.81 -1.44 -2.04 114.58 116.19 1jtd h GLU 171 Ca 0.00 -0.01 -0.54 0.00 -0.13 0.00 0.00 59.36 58.67 1jtd h GLU 171 Cb 0.70 -0.05 -0.17 0.00 0.63 0.00 0.00 28.75 29.86 1jtd h GLU 171 CO 0.00 0.14 -0.86 0.00 -0.73 0.00 0.00 179.01 177.57 1jtd n ALA 172 N -2.59 -1.51 -2.09 2.92 0.00 -1.26 -4.54 120.51 111.44 1jtd n ALA 172 Ca 0.15 -0.10 -0.41 0.00 0.00 0.00 0.00 53.44 53.07 1jtd n ALA 172 Cb 0.66 -2.79 -0.03 0.00 0.00 0.00 0.00 19.45 17.29 1jtd n ALA 172 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 1jtd s ILE 173 N -3.54 3.43 0.27 0.00 -5.25 -1.26 -4.84 121.20 110.00 1jtd s ILE 173 Ca 0.50 1.14 -0.28 0.00 -0.99 0.00 0.00 60.65 61.01 1jtd s ILE 173 Cb -0.27 -3.73 -0.15 0.00 2.95 0.00 0.00 42.46 41.26 1jtd s ILE 173 CO 0.92 0.15 0.92 -2.65 -1.79 0.00 0.00 174.94 172.49 1jtd n PRO 174 N 2.95 1.08 -0.27 0.37 -0.02 -1.26 -2.08 135.00 135.77 1jtd n PRO 174 Ca 0.07 0.38 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1jtd n PRO 174 Cb 0.44 -1.68 0.00 0.00 -0.02 0.00 0.00 33.50 32.24 1jtd n PRO 174 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1jtd n ASN 175 N 1.40 0.00 -4.71 2.55 3.02 -1.26 -4.96 115.26 111.30 1jtd n ASN 175 Ca 0.11 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.25 1jtd n ASN 175 Cb 0.30 -1.09 -0.03 0.00 -0.61 0.00 0.00 39.78 38.35 1jtd n ASN 175 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1jtd s ASP 176 N -2.68 7.29 0.00 6.41 2.15 -0.88 -4.94 116.67 124.02 1jtd s ASP 176 Ca 0.00 1.79 0.24 0.00 0.43 0.00 0.00 52.55 55.02 1jtd s ASP 176 Cb 0.00 -2.58 0.39 0.00 -0.30 0.00 0.00 42.92 40.43 1jtd s ASP 176 CO 0.00 -0.30 1.33 -0.62 -0.17 0.00 0.00 175.17 175.41 1jtd n GLU 177 N 3.75 0.45 -1.76 4.34 1.02 -1.26 -4.88 120.64 122.30 1jtd n GLU 177 Ca 0.06 -0.31 -0.40 0.00 -0.02 0.00 0.00 57.16 56.50 1jtd n GLU 177 Cb 0.49 -1.49 0.03 0.00 -0.02 0.00 0.00 31.44 30.45 1jtd n GLU 177 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1jtd n ARG 178 N -1.00 2.12 -3.48 3.49 1.74 -1.26 -2.85 116.66 115.41 1jtd n ARG 178 Ca 0.08 0.76 -0.25 0.00 -0.77 0.00 0.00 57.85 57.67 1jtd n ARG 178 Cb 0.36 -2.63 0.03 0.00 -1.02 0.00 0.00 32.46 29.20 1jtd n ARG 178 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1jtd n ASP 179 N -0.43 -5.29 -4.67 0.55 10.43 -1.16 -4.89 116.55 111.09 1jtd n ASP 179 Ca 0.07 -0.51 -0.30 0.00 2.57 0.00 0.00 54.79 56.62 1jtd n ASP 179 Cb 0.42 -4.25 -0.10 0.00 1.84 0.00 0.00 41.12 39.04 1jtd n ASP 179 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 1jtd s THR 180 N -3.19 1.63 0.28 -3.53 -4.23 -1.02 -1.84 115.64 103.73 1jtd s THR 180 Ca 0.49 -2.00 -0.15 0.00 -1.18 0.00 0.00 61.69 58.85 1jtd s THR 180 Cb -0.24 -2.64 0.01 0.00 1.34 0.00 0.00 72.50 70.97 1jtd s THR 180 CO 0.61 0.00 0.59 0.28 -0.54 0.00 0.00 174.62 175.56 1jtd s THR 181 N -2.79 0.00 0.12 3.99 -1.32 -0.68 -1.63 115.64 113.33 1jtd s THR 181 Ca 0.23 -1.24 0.06 0.00 -1.21 0.00 0.00 61.69 59.53 1jtd s THR 181 Cb 0.06 -2.23 -0.04 0.00 -1.51 0.00 0.00 72.50 68.78 1jtd s THR 181 CO 0.12 0.00 -0.04 -0.04 -2.21 0.00 0.00 174.62 172.45 1jtd s MET 182 N -3.74 2.35 0.20 7.08 -1.94 -1.26 -1.15 119.30 120.83 1jtd s MET 182 Ca 0.18 -0.98 -0.11 0.00 -1.71 0.00 0.00 55.69 53.07 1jtd s MET 182 Cb -0.03 -2.40 0.22 0.00 2.01 0.00 0.00 34.83 34.63 1jtd s MET 182 CO 0.09 0.50 1.76 -1.35 -0.01 0.00 0.00 175.02 176.02 1jtd h PRO 183 N 3.30 0.42 -0.55 2.03 0.11 -1.64 0.40 132.00 136.07 1jtd h PRO 183 Ca -0.48 -0.03 -0.09 0.00 0.11 0.00 0.00 66.00 65.52 1jtd h PRO 183 Cb 1.18 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1jtd h PRO 183 CO 0.56 0.28 -0.00 -0.24 -0.21 0.00 0.00 178.00 178.39 1jtd h VAL 184 N 0.44 1.26 0.31 3.15 3.04 -1.74 -0.39 116.25 122.32 1jtd h VAL 184 Ca 0.27 -1.10 -0.02 0.00 -1.01 0.00 0.00 66.70 64.85 1jtd h VAL 184 Cb 0.28 0.84 0.00 0.00 -2.01 0.00 0.00 31.29 30.40 1jtd h VAL 184 CO -0.25 0.40 -0.15 0.00 -1.01 0.00 0.00 177.57 176.56 1jtd h ALA 185 N 1.11 -0.42 -0.80 3.17 0.00 -1.64 -1.06 119.26 119.62 1jtd h ALA 185 Ca 0.16 -0.17 0.04 0.00 0.00 0.00 0.00 54.91 54.95 1jtd h ALA 185 Cb 0.52 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.42 1jtd h ALA 185 CO 0.03 -0.61 0.50 1.98 0.00 0.00 0.00 179.25 181.15 1jtd h MET 186 N -0.67 0.92 -0.60 0.00 -1.53 -0.90 -0.21 114.93 111.94 1jtd h MET 186 Ca -0.04 -0.06 -0.08 0.00 -3.44 0.00 0.00 59.70 56.08 1jtd h MET 186 Cb 0.47 -0.21 -0.02 0.00 -0.55 0.00 0.00 31.60 31.29 1jtd h MET 186 CO 0.07 0.61 0.06 0.00 0.14 0.00 0.00 176.91 177.79 1jtd h ALA 187 N 1.35 0.98 -0.15 0.39 0.00 -1.02 0.17 119.26 120.98 1jtd h ALA 187 Ca 0.33 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 1jtd h ALA 187 Cb 0.07 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1jtd h ALA 187 CO -0.14 0.63 -0.07 1.15 0.00 0.00 0.00 179.25 180.82 1jtd h THR 188 N 0.93 1.32 -0.86 0.00 2.02 -0.66 -1.54 112.91 114.11 1jtd h THR 188 Ca 0.18 -1.12 -0.02 0.00 0.77 0.00 0.00 66.41 66.21 1jtd h THR 188 Cb 0.46 1.75 -0.04 0.00 -1.74 0.00 0.00 68.15 68.57 1jtd h THR 188 CO 0.02 0.33 0.44 0.74 0.37 0.00 0.00 175.52 177.42 1jtd h THR 189 N -0.03 1.26 -0.60 3.16 2.02 -0.92 -0.58 112.91 117.22 1jtd h THR 189 Ca 0.03 -0.68 -0.02 0.00 0.77 0.00 0.00 66.41 66.51 1jtd h THR 189 Cb 0.55 0.12 -0.03 0.00 -1.74 0.00 0.00 68.15 67.05 1jtd h THR 189 CO 0.02 0.30 0.30 0.25 0.37 0.00 0.00 175.52 176.76 1jtd h LEU 190 N 1.22 0.78 -0.73 2.58 5.85 -0.52 -1.88 115.31 122.61 1jtd h LEU 190 Ca 0.30 -0.12 -0.04 0.00 0.84 0.00 0.00 57.88 58.86 1jtd h LEU 190 Cb 0.07 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 40.87 1jtd h LEU 190 CO -0.04 0.68 0.29 -0.09 -0.34 0.00 0.00 178.44 178.94 1jtd h ARG 191 N 0.82 1.09 -0.72 1.25 2.43 -0.66 -1.24 114.38 117.36 1jtd h ARG 191 Ca 0.21 -0.20 -0.04 0.00 -0.81 0.00 0.00 59.98 59.14 1jtd h ARG 191 Cb 0.10 -0.18 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 1jtd h ARG 191 CO -0.03 0.90 0.31 0.87 -1.51 0.00 0.00 179.97 180.51 1jtd h LYS 192 N 1.05 1.05 -0.26 0.20 1.57 -0.84 -1.55 116.57 117.79 1jtd h LYS 192 Ca 0.24 -0.17 -0.16 0.00 -1.87 0.00 0.00 60.65 58.69 1jtd h LYS 192 Cb 0.21 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1jtd h LYS 192 CO -0.02 0.84 -0.48 -0.07 -0.57 0.00 0.00 179.45 179.15 1jtd h LEU 193 N 1.04 0.87 0.00 2.94 3.38 -0.95 -1.02 115.31 121.56 1jtd h LEU 193 Ca 0.25 -0.53 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 1jtd h LEU 193 Cb 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1jtd h LEU 193 CO -0.03 1.24 -0.22 -0.07 0.09 0.00 0.00 178.44 179.46 1jtd h LEU 194 N 0.54 0.00 0.00 1.67 3.38 -1.09 -3.41 115.31 116.40 1jtd h LEU 194 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.98 1jtd h LEU 194 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1jtd h LEU 194 CO 0.11 0.16 -0.36 0.35 0.09 0.00 0.00 178.44 178.79 1jtd n THR 195 N -3.12 0.00 -0.30 0.22 -2.24 -0.60 -4.92 114.28 103.32 1jtd n THR 195 Ca 0.03 -0.02 0.00 0.00 -2.27 0.00 0.00 64.05 61.79 1jtd n THR 195 Cb 0.60 0.27 0.00 0.00 -2.10 0.00 0.00 70.33 69.10 1jtd n THR 195 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1jtd n GLY 196 N 0.94 -2.88 1.20 3.38 0.00 -0.39 -4.93 105.19 102.51 1jtd n GLY 196 Ca 0.00 -1.37 0.11 0.00 0.00 0.00 0.00 46.02 44.76 1jtd n GLY 196 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1jtd n GLU 197 N -1.59 2.58 -0.29 1.61 -0.58 -1.26 -4.46 120.64 116.65 1jtd n GLU 197 Ca 0.00 -2.42 -0.05 0.00 -0.42 0.00 0.00 57.16 54.27 1jtd n GLU 197 Cb 0.00 -1.52 0.07 0.00 -0.57 0.00 0.00 31.44 29.42 1jtd n GLU 197 CO 0.00 0.00 0.00 1.25 -0.48 0.00 0.00 177.13 177.90 1jtd h LEU 198 N 4.22 1.00 -9.28 -4.62 5.85 -1.91 -3.43 115.31 107.15 1jtd h LEU 198 Ca 0.00 -0.11 -0.65 0.00 0.84 0.00 0.00 57.88 57.97 1jtd h LEU 198 Cb 0.97 -0.26 -0.15 0.00 0.37 0.00 0.00 40.66 41.59 1jtd h LEU 198 CO 0.00 0.82 -0.74 -0.76 -0.34 0.00 0.00 178.44 177.43 1jtd s LEU 199 N -9.91 2.97 1.13 2.25 1.43 -1.26 -4.93 118.68 110.37 1jtd s LEU 199 Ca -0.13 -0.50 -0.14 0.00 -1.03 0.00 0.00 54.13 52.33 1jtd s LEU 199 Cb 0.15 -1.71 0.26 0.00 0.03 0.00 0.00 46.19 44.92 1jtd s LEU 199 CO 0.81 0.14 1.05 0.42 0.23 0.00 0.00 176.35 179.00 1jtd s THR 200 N -1.46 1.94 0.17 5.49 -4.23 -1.26 -4.66 115.64 111.63 1jtd s THR 200 Ca 0.23 0.00 -0.13 0.00 -1.18 0.00 0.00 61.69 60.61 1jtd s THR 200 Cb -0.10 -2.24 0.06 0.00 1.34 0.00 0.00 72.50 71.56 1jtd s THR 200 CO 0.14 0.00 1.75 0.25 -0.54 0.00 0.00 174.62 176.22 1jtd h LEU 201 N -2.44 0.73 -0.56 4.79 5.85 -1.97 0.05 115.31 121.75 1jtd h LEU 201 Ca -0.58 -0.13 -0.01 0.00 0.84 0.00 0.00 57.88 58.00 1jtd h LEU 201 Cb 1.34 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.15 1jtd h LEU 201 CO 0.52 0.65 0.31 0.00 -0.34 0.00 0.00 178.44 179.58 1jtd h ALA 202 N 1.10 0.72 -0.40 1.25 0.00 -1.99 -1.29 119.26 118.65 1jtd h ALA 202 Ca 0.19 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.86 1jtd h ALA 202 Cb 0.12 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.67 1jtd h ALA 202 CO -0.02 0.24 -0.32 0.77 0.00 0.00 0.00 179.25 179.92 1jtd h SER 203 N 0.76 0.96 -0.86 0.00 0.02 -1.82 -1.34 113.55 111.27 1jtd h SER 203 Ca 0.20 -0.41 0.01 0.00 -0.84 0.00 0.00 61.79 60.75 1jtd h SER 203 Cb 0.05 -0.27 -0.04 0.00 0.14 0.00 0.00 62.40 62.28 1jtd h SER 203 CO -0.03 1.19 0.57 0.03 -1.14 0.00 0.00 176.83 177.45 1jtd h ARG 204 N 0.76 1.13 -0.18 3.45 3.08 -0.82 -1.26 114.38 120.54 1jtd h ARG 204 Ca 0.08 -0.07 -0.14 0.00 0.07 0.00 0.00 59.98 59.92 1jtd h ARG 204 Cb 0.90 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.68 1jtd h ARG 204 CO 0.08 0.74 -0.48 0.37 -1.07 0.00 0.00 179.97 179.62 1jtd h GLN 205 N 1.16 0.48 -0.44 0.04 5.75 -1.03 -2.38 115.11 118.69 1jtd h GLN 205 Ca 0.31 -0.27 -0.13 0.00 -0.15 0.00 0.00 58.65 58.42 1jtd h GLN 205 Cb -0.13 0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.42 1jtd h GLN 205 CO -0.07 0.85 -0.23 0.37 -2.65 0.00 0.00 178.83 177.10 1jtd h GLN 206 N 0.38 0.90 0.06 1.69 5.75 -0.82 0.32 115.11 123.39 1jtd h GLN 206 Ca 0.02 -0.38 -0.00 0.00 -0.15 0.00 0.00 58.65 58.14 1jtd h GLN 206 Cb 0.98 -0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.50 1jtd h GLN 206 CO 0.09 1.03 -0.03 1.25 -2.65 0.00 0.00 178.83 178.52 1jtd h LEU 207 N 0.77 -0.06 -1.37 -2.39 5.85 -1.12 -1.55 115.31 115.45 1jtd h LEU 207 Ca 0.10 -0.15 -0.07 0.00 0.84 0.00 0.00 57.88 58.61 1jtd h LEU 207 Cb 0.78 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1jtd h LEU 207 CO 0.06 0.11 -0.32 -0.29 -0.34 0.00 0.00 178.44 177.67 1jtd h ILE 208 N -0.23 1.22 -0.63 4.05 2.10 -1.42 -2.29 117.51 120.31 1jtd h ILE 208 Ca -0.01 -1.09 -0.05 0.00 1.08 0.00 0.00 64.86 64.79 1jtd h ILE 208 Cb 0.21 1.59 -0.03 0.00 -1.09 0.00 0.00 36.82 37.50 1jtd h ILE 208 CO 0.01 0.31 0.19 0.44 -1.08 0.00 0.00 178.15 178.02 1jtd h ASP 209 N 0.00 0.92 -0.36 2.19 3.32 -0.48 0.02 116.42 122.02 1jtd h ASP 209 Ca -0.00 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.82 1jtd h ASP 209 Cb 0.56 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 1jtd h ASP 209 CO 0.04 0.88 0.15 -0.50 -1.72 0.00 0.00 179.24 178.09 1jtd h TRP 210 N 0.90 0.54 -0.67 4.55 6.55 -0.87 -1.51 115.95 125.43 1jtd h TRP 210 Ca 0.20 -0.04 -0.04 0.00 0.95 0.00 0.00 58.89 59.97 1jtd h TRP 210 Cb 0.30 -0.16 -0.03 0.00 -0.86 0.00 0.00 29.16 28.41 1jtd h TRP 210 CO 0.02 0.49 0.28 0.52 -1.05 0.00 0.00 178.44 178.70 1jtd h MET 211 N 0.43 0.98 0.00 0.49 2.86 -1.23 -1.58 114.93 116.88 1jtd h MET 211 Ca 0.12 -0.16 -0.07 0.00 -2.06 0.00 0.00 59.70 57.54 1jtd h MET 211 Cb 0.18 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 1jtd h MET 211 CO -0.01 0.79 -0.32 1.49 1.06 0.00 0.00 176.91 179.92 1jtd h GLU 212 N 0.97 0.00 -0.20 1.72 4.81 -0.64 -1.59 114.58 119.65 1jtd h GLU 212 Ca 0.23 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.46 1jtd h GLU 212 Cb 0.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.55 1jtd h GLU 212 CO -0.02 0.32 0.00 0.00 -0.73 0.00 0.00 179.01 178.58 1jtd n ALA 213 N -2.47 2.48 -1.58 2.92 0.00 -0.60 -4.87 120.51 116.38 1jtd n ALA 213 Ca -0.02 -0.37 -0.49 0.00 0.00 0.00 0.00 53.44 52.56 1jtd n ALA 213 Cb 0.36 -1.00 -0.04 0.00 0.00 0.00 0.00 19.45 18.77 1jtd n ALA 213 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1jtd n ASP 214 N 0.09 1.47 -0.00 0.00 4.64 -0.88 -4.80 116.55 117.07 1jtd n ASP 214 Ca 0.08 1.14 0.05 0.00 -1.38 0.00 0.00 54.79 54.68 1jtd n ASP 214 Cb 0.18 -1.22 -0.07 0.00 -1.04 0.00 0.00 41.12 38.98 1jtd n ASP 214 CO 0.00 0.00 0.00 0.29 -0.82 0.00 0.00 177.20 176.67 1jtd n LYS 215 N 1.96 1.62 -1.65 -0.67 4.76 -0.43 -4.70 118.16 119.05 1jtd n LYS 215 Ca 0.16 -0.06 -0.27 0.00 -2.87 0.00 0.00 58.31 55.27 1jtd n LYS 215 Cb 0.23 -1.14 0.06 0.00 -1.84 0.00 0.00 35.03 32.35 1jtd n LYS 215 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 1jtd n VAL 216 N -1.62 2.99 -0.69 -0.18 0.24 -1.23 -4.53 118.33 113.30 1jtd n VAL 216 Ca -0.00 -3.58 0.00 0.00 -2.04 0.00 0.00 64.34 58.72 1jtd n VAL 216 Cb 0.22 -1.08 0.00 0.00 -1.47 0.00 0.00 33.84 31.51 1jtd n VAL 216 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1jtd n ALA 217 N -0.83 1.30 -0.34 2.33 0.00 -1.26 -4.79 120.51 116.92 1jtd n ALA 217 Ca 0.51 -0.65 0.14 0.00 0.00 0.00 0.00 53.44 53.45 1jtd n ALA 217 Cb 0.86 0.00 0.36 0.00 0.00 0.00 0.00 19.45 20.66 1jtd n ALA 217 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1jtd h GLY 218 N 0.00 1.63 -0.05 0.00 0.00 -1.92 -1.02 103.07 101.72 1jtd h GLY 218 Ca 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 47.33 47.00 1jtd h GLY 218 CO 0.00 -0.06 0.00 -1.55 0.00 0.00 0.00 176.54 174.93 1jtd n PRO 219 N -4.72 1.12 0.00 4.80 -0.04 -1.26 -2.45 135.00 132.45 1jtd n PRO 219 Ca 0.23 -0.19 0.00 0.00 -0.04 0.00 0.00 63.50 63.50 1jtd n PRO 219 Cb 0.61 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.95 1jtd n PRO 219 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 1jtd n LEU 220 N -0.42 0.00 -0.29 1.53 4.77 -0.39 -4.45 117.00 117.76 1jtd n LEU 220 Ca 0.05 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.08 1jtd n LEU 220 Cb 0.06 0.00 0.19 0.00 -2.33 0.00 0.00 43.42 41.35 1jtd n LEU 220 CO 0.04 0.00 1.12 -0.07 -1.33 0.00 0.00 177.39 177.15 1jtd h LEU 221 N 0.00 0.59 -1.86 2.23 3.38 -1.83 -2.07 115.31 115.76 1jtd h LEU 221 Ca 0.00 0.07 0.21 0.00 0.09 0.00 0.00 57.88 58.25 1jtd h LEU 221 Cb 0.00 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.67 1jtd h LEU 221 CO 0.00 0.30 0.56 0.03 0.09 0.00 0.00 178.44 179.42 1jtd h ARG 222 N 0.70 0.12 0.00 1.13 3.08 -1.78 -1.34 114.38 116.29 1jtd h ARG 222 Ca 0.43 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.47 1jtd h ARG 222 Cb 0.51 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.53 1jtd h ARG 222 CO -0.30 0.08 0.00 0.66 -1.07 0.00 0.00 179.97 179.34 1jtd h SER 223 N 0.12 0.00 -0.17 7.04 4.64 -1.03 -2.79 113.55 121.36 1jtd h SER 223 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1jtd h SER 223 Cb 1.35 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.44 1jtd h SER 223 CO -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.91 1jtd n ALA 224 N -1.92 2.44 -2.67 5.18 0.00 -0.51 -4.95 120.51 118.08 1jtd n ALA 224 Ca 0.02 -0.81 -0.41 0.00 0.00 0.00 0.00 53.44 52.25 1jtd n ALA 224 Cb 0.31 -0.77 -0.05 0.00 0.00 0.00 0.00 19.45 18.94 1jtd n ALA 224 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1jtd s LEU 225 N -1.66 4.19 0.77 0.00 2.96 -1.06 -4.74 118.68 119.15 1jtd s LEU 225 Ca 0.30 1.05 -0.11 0.00 -0.22 0.00 0.00 54.13 55.15 1jtd s LEU 225 Cb 0.20 -3.08 0.06 0.00 0.50 0.00 0.00 46.19 43.87 1jtd s LEU 225 CO 0.28 -0.31 1.14 -2.16 -1.32 0.00 0.00 176.35 173.99 1jtd s PRO 226 N 1.84 2.21 0.73 0.98 0.04 -1.26 -5.00 135.00 134.54 1jtd s PRO 226 Ca 0.35 0.15 -0.16 0.00 0.04 0.00 0.00 61.00 61.38 1jtd s PRO 226 Cb -0.16 -1.99 0.02 0.00 0.04 0.00 0.00 34.50 32.40 1jtd s PRO 226 CO 0.12 -1.42 1.06 0.00 0.04 0.00 0.00 177.00 176.81 1jtd n ALA 227 N -3.20 -0.03 -0.36 8.56 0.00 -1.26 -3.17 120.51 121.06 1jtd n ALA 227 Ca 0.08 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.32 1jtd n ALA 227 Cb 0.60 -2.17 0.00 0.00 0.00 0.00 0.00 19.45 17.88 1jtd n ALA 227 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1jtd n GLY 228 N 0.95 2.27 3.84 0.00 0.00 -1.26 -4.90 105.19 106.09 1jtd n GLY 228 Ca 0.13 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.82 1jtd n GLY 228 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1jtd s TRP 229 N -3.35 3.39 -0.13 1.61 0.52 -1.19 -0.09 118.94 119.70 1jtd s TRP 229 Ca 0.00 1.31 -0.04 0.00 0.02 0.00 0.00 56.10 57.39 1jtd s TRP 229 Cb 0.00 -2.60 -0.03 0.00 -1.15 0.00 0.00 33.47 29.69 1jtd s TRP 229 CO 0.00 0.09 0.01 0.12 0.02 0.00 0.00 176.95 177.18 1jtd s PHE 230 N -1.97 3.16 -0.08 -1.98 5.36 0.12 -4.69 117.98 117.90 1jtd s PHE 230 Ca 0.54 0.04 -0.05 0.00 -0.96 0.00 0.00 56.93 56.50 1jtd s PHE 230 Cb -0.11 -1.91 0.03 0.00 -0.34 0.00 0.00 43.02 40.70 1jtd s PHE 230 CO 0.17 0.26 0.20 -1.50 -1.46 0.00 0.00 175.22 172.90 1jtd s ILE 231 N -0.25 -0.03 -0.16 3.12 2.07 -1.26 -1.08 121.20 123.61 1jtd s ILE 231 Ca 0.06 0.10 -0.00 0.00 -1.41 0.00 0.00 60.65 59.40 1jtd s ILE 231 Cb -0.12 -0.31 0.04 0.00 0.13 0.00 0.00 42.46 42.19 1jtd s ILE 231 CO 0.02 0.04 -0.08 0.00 -1.91 0.00 0.00 174.94 173.01 1jtd s ALA 232 N 0.81 1.59 0.31 1.50 0.00 -0.11 -4.42 121.76 121.43 1jtd s ALA 232 Ca -0.06 -0.85 0.07 0.00 0.00 0.00 0.00 51.96 51.12 1jtd s ALA 232 Cb -0.07 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.92 1jtd s ALA 232 CO -0.05 -0.67 0.25 -0.40 0.00 0.00 0.00 175.76 174.89 1jtd n ASP 233 N 4.84 -0.54 -3.41 0.00 3.85 -0.65 -0.87 116.55 119.76 1jtd n ASP 233 Ca -0.13 -3.01 -0.05 0.00 -0.71 0.00 0.00 54.79 50.89 1jtd n ASP 233 Cb 0.48 1.50 -0.06 0.00 -1.35 0.00 0.00 41.12 41.69 1jtd n ASP 233 CO 0.00 0.00 0.00 -0.75 -1.01 0.00 0.00 177.20 175.44 1jtd s LYS 234 N -3.25 0.41 0.60 0.11 2.47 -0.18 -4.52 119.74 115.38 1jtd s LYS 234 Ca 0.36 0.85 0.00 0.00 -1.56 0.00 0.00 55.97 55.62 1jtd s LYS 234 Cb 0.02 0.08 0.05 0.00 -1.46 0.00 0.00 37.83 36.52 1jtd s LYS 234 CO 0.25 -0.50 0.84 -1.54 0.16 0.00 0.00 175.35 174.56 1jtd s SER 235 N 2.67 5.06 -0.12 1.43 1.04 -1.26 -1.59 113.70 120.93 1jtd s SER 235 Ca 0.09 -0.02 -0.19 0.00 0.48 0.00 0.00 55.95 56.30 1jtd s SER 235 Cb -0.14 -0.74 0.05 0.00 0.10 0.00 0.00 66.02 65.28 1jtd s SER 235 CO -0.16 -1.32 0.48 -0.83 0.98 0.00 0.00 173.24 172.39 1jtd s GLY 236 N -4.49 -0.35 -0.00 7.32 0.00 0.66 -3.84 107.32 106.62 1jtd s GLY 236 Ca 0.59 1.10 0.01 0.00 0.00 0.00 0.00 44.72 46.43 1jtd s GLY 236 CO 0.40 0.88 -0.04 0.00 0.00 0.00 0.00 173.10 174.34 1jtd s ALA 237 N -0.43 0.29 0.00 3.20 0.00 -1.26 -1.00 121.76 122.56 1jtd s ALA 237 Ca -0.06 -0.16 0.00 0.00 0.00 0.00 0.00 51.96 51.74 1jtd s ALA 237 Cb -0.03 -0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.02 1jtd s ALA 237 CO 0.03 0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.27 1jtd n GLY 238 N 2.96 4.27 3.95 0.00 0.00 -0.64 -4.63 105.19 111.08 1jtd n GLY 238 Ca -0.13 -1.39 -0.26 0.00 0.00 0.00 0.00 46.02 44.24 1jtd n GLY 238 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1jtd s GLU 239 N -0.27 1.64 -1.53 1.61 2.02 -0.77 -4.22 118.70 117.17 1jtd s GLU 239 Ca 0.00 -0.50 -0.06 0.00 0.02 0.00 0.00 54.97 54.43 1jtd s GLU 239 Cb 0.00 -2.12 0.05 0.00 0.10 0.00 0.00 34.13 32.17 1jtd s GLU 239 CO 0.00 -1.62 0.46 0.54 0.02 0.00 0.00 175.26 174.66 1jtd n ARG 240 N -3.14 -2.79 -0.80 1.61 1.74 -1.26 -1.55 116.66 110.46 1jtd n ARG 240 Ca 0.12 0.34 0.00 0.00 -0.77 0.00 0.00 57.85 57.53 1jtd n ARG 240 Cb 0.60 -4.54 0.00 0.00 -1.02 0.00 0.00 32.46 27.50 1jtd n ARG 240 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1jtd n GLY 241 N -1.89 0.53 3.74 -0.13 0.00 -1.25 -1.69 105.19 104.50 1jtd n GLY 241 Ca -0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.41 1jtd n GLY 241 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1jtd s SER 242 N -2.50 6.50 -0.14 1.61 1.04 -0.60 -4.36 113.70 115.26 1jtd s SER 242 Ca 0.00 2.78 -0.19 0.00 0.48 0.00 0.00 55.95 59.02 1jtd s SER 242 Cb 0.00 -2.62 0.05 0.00 0.10 0.00 0.00 66.02 63.55 1jtd s SER 242 CO 0.00 -0.84 0.50 -0.60 0.98 0.00 0.00 173.24 173.28 1jtd s ARG 243 N 0.06 0.67 0.15 4.02 6.06 -0.38 -1.62 118.95 127.90 1jtd s ARG 243 Ca 0.65 0.50 -0.25 0.00 -2.50 0.00 0.00 55.73 54.13 1jtd s ARG 243 Cb -0.45 0.32 0.06 0.00 0.06 0.00 0.00 34.95 34.94 1jtd s ARG 243 CO 0.41 -0.12 0.95 0.20 -2.50 0.00 0.00 175.30 174.24 1jtd s GLY 244 N -0.19 -0.24 -0.27 8.12 0.00 -0.17 -1.15 107.32 113.43 1jtd s GLY 244 Ca -0.04 0.15 -0.25 0.00 0.00 0.00 0.00 44.72 44.59 1jtd s GLY 244 CO 0.03 0.02 0.72 -1.50 0.00 0.00 0.00 173.10 172.36 1jtd s ILE 245 N -3.30 0.00 -0.02 0.90 2.07 0.06 -0.24 121.20 120.66 1jtd s ILE 245 Ca 0.12 -0.00 0.08 0.00 -1.41 0.00 0.00 60.65 59.43 1jtd s ILE 245 Cb -0.02 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.56 1jtd s ILE 245 CO 0.02 -0.00 -0.26 0.27 -1.91 0.00 0.00 174.94 173.06 1jtd s ILE 246 N 0.36 2.03 0.07 2.00 -4.36 -0.62 -1.28 121.20 119.41 1jtd s ILE 246 Ca -0.00 -1.10 -0.16 0.00 -0.26 0.00 0.00 60.65 59.13 1jtd s ILE 246 Cb -0.05 -1.69 0.03 0.00 1.25 0.00 0.00 42.46 42.00 1jtd s ILE 246 CO 0.01 0.57 0.37 0.00 0.24 0.00 0.00 174.94 176.14 1jtd s ALA 247 N -0.55 -0.87 -0.16 2.27 0.00 -0.26 -1.01 121.76 121.18 1jtd s ALA 247 Ca 0.08 0.08 -0.00 0.00 0.00 0.00 0.00 51.96 52.12 1jtd s ALA 247 Cb -0.10 0.46 0.04 0.00 0.00 0.00 0.00 23.12 23.52 1jtd s ALA 247 CO -0.00 -0.51 -0.07 0.00 0.00 0.00 0.00 175.76 175.17 1jtd s ALA 248 N -3.02 1.59 0.18 0.00 0.00 -0.05 -0.89 121.76 119.57 1jtd s ALA 248 Ca -0.02 -0.87 -0.02 0.00 0.00 0.00 0.00 51.96 51.04 1jtd s ALA 248 Cb 0.00 -1.12 -0.03 0.00 0.00 0.00 0.00 23.12 21.97 1jtd s ALA 248 CO -0.06 -0.72 0.14 -0.48 0.00 0.00 0.00 175.76 174.64 1jtd s LEU 249 N 1.59 1.28 0.00 0.00 2.34 -0.24 -0.93 118.68 122.72 1jtd s LEU 249 Ca 0.01 -1.25 0.00 0.00 0.06 0.00 0.00 54.13 52.95 1jtd s LEU 249 Cb -0.15 0.52 0.00 0.00 -0.56 0.00 0.00 46.19 46.00 1jtd s LEU 249 CO -0.08 -0.83 0.00 0.61 -1.06 0.00 0.00 176.35 174.99 1jtd n GLY 250 N -0.21 0.73 3.93 -3.48 0.00 -0.24 -0.49 105.19 105.43 1jtd n GLY 250 Ca -0.02 -0.72 -0.25 0.00 0.00 0.00 0.00 46.02 45.03 1jtd n GLY 250 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1jtd s PRO 251 N -2.00 2.52 -1.19 1.61 0.04 -1.23 0.15 135.00 134.90 1jtd s PRO 251 Ca 0.00 -0.23 -0.06 0.00 0.04 0.00 0.00 61.00 60.75 1jtd s PRO 251 Cb 0.00 -2.25 0.01 0.00 0.04 0.00 0.00 34.50 32.29 1jtd s PRO 251 CO 0.00 -0.96 1.03 -0.25 0.04 0.00 0.00 177.00 176.86 1jtd n ASP 252 N -2.71 -4.98 -1.89 6.66 10.43 -0.92 -2.80 116.55 120.33 1jtd n ASP 252 Ca 0.07 -0.51 -0.14 0.00 2.57 0.00 0.00 54.79 56.78 1jtd n ASP 252 Cb 0.59 -4.61 -0.04 0.00 1.84 0.00 0.00 41.12 38.90 1jtd n ASP 252 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 1jtd n GLY 253 N -1.68 0.49 2.81 0.44 0.00 0.86 -4.93 105.19 103.19 1jtd n GLY 253 Ca -0.06 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.80 1jtd n GLY 253 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1jtd s LYS 254 N -4.06 0.18 0.31 1.61 2.47 -1.12 -4.79 119.74 114.33 1jtd s LYS 254 Ca 0.00 0.09 -0.28 0.00 -1.56 0.00 0.00 55.97 54.23 1jtd s LYS 254 Cb 0.00 -0.38 -0.09 0.00 -1.46 0.00 0.00 37.83 35.90 1jtd s LYS 254 CO 0.00 -0.13 1.08 -1.25 0.16 0.00 0.00 175.35 175.21 1jtd s PRO 255 N 0.92 4.52 0.00 4.03 0.04 -1.26 -3.45 135.00 139.80 1jtd s PRO 255 Ca -0.09 1.71 0.00 0.00 0.04 0.00 0.00 61.00 62.67 1jtd s PRO 255 Cb -0.12 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.40 1jtd s PRO 255 CO -0.02 0.13 0.00 -1.13 0.04 0.00 0.00 177.00 176.02 1jtd n SER 256 N 0.86 0.00 -3.74 6.66 3.41 0.35 -4.83 113.62 116.33 1jtd n SER 256 Ca 0.01 -0.84 -0.14 0.00 -0.26 0.00 0.00 58.87 57.64 1jtd n SER 256 Cb 0.46 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.32 1jtd n SER 256 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1jtd s ARG 257 N 0.00 0.65 -0.14 4.33 0.52 -0.80 -1.53 118.95 121.98 1jtd s ARG 257 Ca 0.00 0.01 -0.05 0.00 -0.52 0.00 0.00 55.73 55.17 1jtd s ARG 257 Cb 0.00 0.29 -0.04 0.00 0.52 0.00 0.00 34.95 35.73 1jtd s ARG 257 CO 0.00 -0.16 0.03 0.42 0.02 0.00 0.00 175.30 175.61 1jtd s ILE 258 N -0.96 4.57 -0.06 1.52 -1.09 -0.01 -1.08 121.20 124.09 1jtd s ILE 258 Ca -0.10 -0.13 0.01 0.00 -2.23 0.00 0.00 60.65 58.20 1jtd s ILE 258 Cb -0.04 -3.00 0.02 0.00 -1.58 0.00 0.00 42.46 37.85 1jtd s ILE 258 CO 0.04 0.53 -0.08 -0.69 -1.23 0.00 0.00 174.94 173.51 1jtd s VAL 259 N -0.17 0.81 -0.08 2.92 1.01 -0.06 0.24 120.40 125.06 1jtd s VAL 259 Ca 0.06 -0.28 0.03 0.00 0.00 0.00 0.00 61.98 61.79 1jtd s VAL 259 Cb -0.12 -0.78 0.01 0.00 0.00 0.00 0.00 36.38 35.48 1jtd s VAL 259 CO 0.02 0.29 -0.17 -0.69 0.00 0.00 0.00 175.10 174.55 1jtd s VAL 260 N 0.84 1.47 -0.04 2.92 1.01 -0.10 -1.10 120.40 125.40 1jtd s VAL 260 Ca -0.12 -0.68 0.00 0.00 0.00 0.00 0.00 61.98 61.19 1jtd s VAL 260 Cb -0.15 -1.30 0.03 0.00 0.00 0.00 0.00 36.38 34.95 1jtd s VAL 260 CO 0.01 0.43 -0.01 -0.63 0.00 0.00 0.00 175.10 174.90 1jtd s ILE 261 N 0.52 0.28 0.06 2.22 1.01 -0.40 -1.71 121.20 123.18 1jtd s ILE 261 Ca -0.16 0.04 0.03 0.00 0.00 0.00 0.00 60.65 60.57 1jtd s ILE 261 Cb -0.16 -0.37 -0.03 0.00 0.01 0.00 0.00 42.46 41.91 1jtd s ILE 261 CO 0.05 0.18 -0.11 -0.31 0.00 0.00 0.00 174.94 174.76 1jtd s TYR 262 N 1.13 0.92 -0.02 3.97 1.51 -0.68 -0.76 117.35 123.41 1jtd s TYR 262 Ca -0.08 -0.49 -0.14 0.00 -1.01 0.00 0.00 57.07 55.35 1jtd s TYR 262 Cb -0.14 -0.53 0.02 0.00 -0.11 0.00 0.00 41.96 41.21 1jtd s TYR 262 CO -0.02 -0.02 0.30 -0.08 -1.11 0.00 0.00 175.55 174.62 1jtd s THR 263 N -1.39 0.05 0.03 -0.71 -1.32 -0.30 -0.40 115.64 111.60 1jtd s THR 263 Ca -0.06 -0.45 -0.23 0.00 -1.21 0.00 0.00 61.69 59.74 1jtd s THR 263 Cb -0.10 -0.59 0.05 0.00 -1.51 0.00 0.00 72.50 70.36 1jtd s THR 263 CO 0.01 -0.25 0.53 0.28 -2.21 0.00 0.00 174.62 172.98 1jtd s THR 264 N -1.20 0.03 0.00 5.08 -1.32 -1.04 -1.25 115.64 115.93 1jtd s THR 264 Ca -0.12 -0.22 0.00 0.00 -1.21 0.00 0.00 61.69 60.13 1jtd s THR 264 Cb -0.05 -0.95 0.00 0.00 -1.51 0.00 0.00 72.50 69.99 1jtd s THR 264 CO 0.04 -0.12 0.00 0.61 -2.21 0.00 0.00 174.62 172.93 1jtd n GLY 265 N 0.56 1.31 3.79 6.08 0.00 -0.68 -2.89 105.19 113.35 1jtd n GLY 265 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.49 1jtd n GLY 265 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1jtd s SER 266 N -2.80 5.91 0.00 1.61 0.15 -1.26 -4.82 113.70 112.50 1jtd s SER 266 Ca 0.00 2.02 0.24 0.00 0.70 0.00 0.00 55.95 58.91 1jtd s SER 266 Cb 0.00 -2.56 0.24 0.00 -1.71 0.00 0.00 66.02 61.99 1jtd s SER 266 CO 0.00 -1.08 1.27 0.00 1.20 0.00 0.00 173.24 174.63 1jtd n GLN 267 N -1.36 1.77 -1.67 5.44 1.13 -1.26 -3.81 117.38 117.63 1jtd n GLN 267 Ca 0.10 -1.41 -0.32 0.00 -1.94 0.00 0.00 57.00 53.43 1jtd n GLN 267 Cb 0.52 -1.47 0.05 0.00 0.11 0.00 0.00 30.24 29.45 1jtd n GLN 267 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1jtd s ALA 268 N -2.20 2.47 1.05 -1.58 0.00 -1.26 -5.02 121.76 115.22 1jtd s ALA 268 Ca 0.25 0.44 -0.11 0.00 0.00 0.00 0.00 51.96 52.54 1jtd s ALA 268 Cb 0.19 -3.29 0.22 0.00 0.00 0.00 0.00 23.12 20.25 1jtd s ALA 268 CO 0.41 -1.32 1.09 0.95 0.00 0.00 0.00 175.76 176.89 1jtd s THR 269 N -2.52 2.00 0.17 0.00 -4.23 -1.26 -4.79 115.64 105.01 1jtd s THR 269 Ca 0.65 0.00 -0.12 0.00 -1.18 0.00 0.00 61.69 61.04 1jtd s THR 269 Cb -0.19 -2.00 0.06 0.00 1.34 0.00 0.00 72.50 71.71 1jtd s THR 269 CO 0.45 -0.00 1.67 -0.03 -0.54 0.00 0.00 174.62 176.17 1jtd h MET 270 N -2.32 0.91 -0.58 3.99 4.05 -1.99 -1.86 114.93 117.14 1jtd h MET 270 Ca -0.53 -0.23 0.01 0.00 -0.28 0.00 0.00 59.70 58.68 1jtd h MET 270 Cb 1.30 -0.12 -0.03 0.00 -0.80 0.00 0.00 31.60 31.95 1jtd h MET 270 CO 0.45 0.86 0.38 -0.44 0.23 0.00 0.00 176.91 178.39 1jtd h ASP 271 N 0.82 0.65 -0.81 1.39 3.32 -1.98 0.32 116.42 120.12 1jtd h ASP 271 Ca 0.18 -0.01 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1jtd h ASP 271 Cb 0.36 -0.16 -0.04 0.00 0.22 0.00 0.00 39.33 39.72 1jtd h ASP 271 CO 0.00 0.46 0.47 -0.33 -1.72 0.00 0.00 179.24 178.13 1jtd h GLU 272 N 0.77 1.12 -0.29 3.56 5.08 -1.84 0.14 114.58 123.12 1jtd h GLU 272 Ca 0.22 -0.11 -0.18 0.00 -1.00 0.00 0.00 59.36 58.29 1jtd h GLU 272 Cb -0.06 -0.23 0.00 0.00 0.50 0.00 0.00 28.75 28.96 1jtd h GLU 272 CO -0.06 0.80 -0.51 0.00 -1.00 0.00 0.00 179.01 178.24 1jtd h ARG 273 N 1.13 0.86 -0.12 2.33 3.08 -0.61 -2.30 114.38 118.75 1jtd h ARG 273 Ca 0.29 -0.54 0.01 0.00 0.07 0.00 0.00 59.98 59.81 1jtd h ARG 273 Cb -0.01 0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1jtd h ARG 273 CO -0.05 1.17 0.05 -0.91 -1.07 0.00 0.00 179.97 179.16 1jtd h ASN 274 N 0.64 0.07 -0.74 7.04 2.35 0.03 -2.31 115.58 122.65 1jtd h ASN 274 Ca 0.02 0.01 0.11 0.00 -0.55 0.00 0.00 56.30 55.89 1jtd h ASN 274 Cb 1.12 -0.00 -0.08 0.00 0.05 0.00 0.00 38.32 39.41 1jtd h ASN 274 CO 0.12 0.06 0.35 -0.09 -1.65 0.00 0.00 177.43 176.21 1jtd h ARG 275 N 0.11 0.55 -0.59 0.81 9.65 -0.64 0.17 114.38 124.45 1jtd h ARG 275 Ca 0.05 -0.03 -0.05 0.00 -1.10 0.00 0.00 59.98 58.84 1jtd h ARG 275 Cb 0.02 -0.12 -0.02 0.00 -1.39 0.00 0.00 29.97 28.45 1jtd h ARG 275 CO -0.04 0.36 0.16 1.96 2.80 0.00 0.00 179.97 185.21 1jtd h GLN 276 N 0.56 0.93 -0.68 0.20 1.08 -1.06 -0.07 115.11 116.08 1jtd h GLN 276 Ca 0.38 -0.21 -0.08 0.00 -1.45 0.00 0.00 58.65 57.29 1jtd h GLN 276 Cb 0.47 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.74 1jtd h GLN 276 CO -0.31 0.85 0.12 0.82 -0.95 0.00 0.00 178.83 179.35 1jtd h ILE 277 N 0.84 1.26 -0.27 2.54 2.04 -0.80 -1.21 117.51 121.92 1jtd h ILE 277 Ca 0.19 -1.04 0.02 0.00 1.00 0.00 0.00 64.86 65.03 1jtd h ILE 277 Cb 0.32 0.61 -0.02 0.00 -0.74 0.00 0.00 36.82 36.99 1jtd h ILE 277 CO -0.00 0.39 0.12 0.00 0.00 0.00 0.00 178.15 178.66 1jtd h ALA 278 N 1.07 0.32 -0.18 1.87 0.00 -0.28 -0.53 119.26 121.52 1jtd h ALA 278 Ca 0.21 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1jtd h ALA 278 Cb 0.44 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1jtd h ALA 278 CO 0.01 -0.27 -0.07 0.93 0.00 0.00 0.00 179.25 179.85 1jtd h GLU 279 N 0.27 0.27 -0.56 0.00 5.08 -0.69 0.16 114.58 119.11 1jtd h GLU 279 Ca 0.11 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.31 1jtd h GLU 279 Cb 0.04 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.23 1jtd h GLU 279 CO -0.08 0.36 -0.09 0.82 -1.00 0.00 0.00 179.01 179.01 1jtd h ILE 280 N 0.26 1.27 -0.80 3.13 2.04 -0.70 -2.07 117.51 120.64 1jtd h ILE 280 Ca 0.06 -1.26 -0.00 0.00 1.00 0.00 0.00 64.86 64.66 1jtd h ILE 280 Cb 0.30 0.94 -0.04 0.00 -0.74 0.00 0.00 36.82 37.28 1jtd h ILE 280 CO 0.01 0.45 0.49 1.23 0.00 0.00 0.00 178.15 180.33 1jtd h GLY 281 N 0.93 1.15 1.06 5.37 0.00 0.64 -1.88 103.07 110.34 1jtd h GLY 281 Ca 0.15 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 47.01 1jtd h GLY 281 CO 0.05 0.45 0.58 0.00 0.00 0.00 0.00 176.54 177.62 1jtd h ALA 282 N 1.27 1.27 -0.61 3.60 0.00 -0.44 -1.43 119.26 122.92 1jtd h ALA 282 Ca 0.29 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1jtd h ALA 282 Cb -0.06 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.33 1jtd h ALA 282 CO -0.06 0.64 0.26 1.03 0.00 0.00 0.00 179.25 181.13 1jtd h SER 283 N 1.27 0.83 -0.40 0.00 0.87 -0.82 0.13 113.55 115.44 1jtd h SER 283 Ca 0.34 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1jtd h SER 283 Cb -0.08 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.64 1jtd h SER 283 CO -0.07 0.76 0.25 0.25 -0.53 0.00 0.00 176.83 177.49 1jtd h LEU 284 N 0.84 0.47 -0.10 2.23 5.85 -0.76 -2.53 115.31 121.31 1jtd h LEU 284 Ca 0.21 -0.03 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 1jtd h LEU 284 Cb 0.18 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.09 1jtd h LEU 284 CO -0.02 0.36 -0.04 0.40 -0.34 0.00 0.00 178.44 178.80 1jtd h ILE 285 N 0.53 1.31 0.00 4.05 1.08 -1.02 -0.40 117.51 123.06 1jtd h ILE 285 Ca 0.14 -1.02 -0.02 0.00 -0.39 0.00 0.00 64.86 63.58 1jtd h ILE 285 Cb -0.03 1.78 -0.00 0.00 -3.07 0.00 0.00 36.82 35.50 1jtd h ILE 285 CO -0.03 0.29 -0.09 0.11 -0.69 0.00 0.00 178.15 177.74 1jtd h LYS 286 N -0.15 0.00 -0.14 2.37 6.56 -0.71 -2.61 116.57 121.89 1jtd h LYS 286 Ca 0.02 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1jtd h LYS 286 Cb 0.47 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.13 1jtd h LYS 286 CO 0.01 0.09 0.00 0.72 -2.06 0.00 0.00 179.45 178.21 1jtd n HIS 287 N -3.85 0.18 0.00 -1.35 8.25 -0.96 -5.09 115.22 112.40 1jtd n HIS 287 Ca -0.02 -0.22 0.00 0.00 -0.26 0.00 0.00 57.72 57.22 1jtd n HIS 287 Cb 0.18 -0.01 0.00 0.00 1.12 0.00 0.00 29.99 31.28 1jtd n HIS 287 CO 0.00 0.00 0.00 1.87 0.64 0.00 0.00 176.34 178.85