#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hjt s MET 33 N 0.00 2.56 -0.14 1.61 0.23 -1.26 -4.97 119.30 117.34 3hjt s MET 33 Ca 0.00 -0.72 -0.29 0.00 -1.03 0.00 0.00 55.69 53.64 3hjt s MET 33 Cb 0.00 -2.52 -0.01 0.00 -1.53 0.00 0.00 34.83 30.77 3hjt s MET 33 CO 0.00 0.60 1.12 -1.12 -2.03 0.00 0.00 175.02 173.59 3hjt s SER 34 N -1.49 7.09 0.00 -1.18 0.01 -1.26 -3.01 113.70 113.87 3hjt s SER 34 Ca 0.18 1.59 0.04 0.00 1.31 0.00 0.00 55.95 59.07 3hjt s SER 34 Cb -0.11 -2.55 -0.03 0.00 0.21 0.00 0.00 66.02 63.54 3hjt s SER 34 CO 0.08 -0.61 -0.09 -0.69 0.41 0.00 0.00 173.24 172.34 3hjt s VAL 35 N 2.69 3.46 -0.01 3.43 1.01 -0.24 -0.74 120.40 130.01 3hjt s VAL 35 Ca 0.50 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.66 3hjt s VAL 35 Cb -0.20 -2.49 0.00 0.00 0.00 0.00 0.00 36.38 33.70 3hjt s VAL 35 CO 0.15 0.40 -0.05 -0.69 0.00 0.00 0.00 175.10 174.92 3hjt s VAL 36 N -0.96 0.42 0.18 2.92 1.01 0.03 -1.94 120.40 122.05 3hjt s VAL 36 Ca 0.16 -0.17 0.09 0.00 0.00 0.00 0.00 61.98 62.05 3hjt s VAL 36 Cb -0.11 -0.39 -0.04 0.00 0.00 0.00 0.00 36.38 35.84 3hjt s VAL 36 CO 0.06 0.14 -0.18 0.42 0.00 0.00 0.00 175.10 175.55 3hjt s THR 37 N 0.19 1.85 -0.00 3.92 -4.23 -0.11 0.06 115.64 117.32 3hjt s THR 37 Ca -0.02 -2.00 -0.10 0.00 -1.18 0.00 0.00 61.69 58.39 3hjt s THR 37 Cb -0.06 -1.91 -0.05 0.00 1.34 0.00 0.00 72.50 71.82 3hjt s THR 37 CO -0.00 -0.37 0.75 0.77 -0.54 0.00 0.00 174.62 175.22 3hjt h SER 38 N 3.06 -0.30 -1.89 3.99 4.64 -1.68 -0.83 113.55 120.54 3hjt h SER 38 Ca -0.41 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.92 3hjt h SER 38 Cb 1.21 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 3hjt h SER 38 CO 0.53 -0.13 0.00 2.22 -0.87 0.00 0.00 176.83 178.59 3hjt n PHE 39 N -3.45 0.00 -0.09 4.77 -1.74 -1.26 -1.12 117.46 114.57 3hjt n PHE 39 Ca -0.04 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.78 3hjt n PHE 39 Cb 0.14 0.00 -0.00 0.00 1.52 0.00 0.00 39.48 41.14 3hjt n PHE 39 CO 0.00 0.00 0.00 -0.92 -0.56 0.00 0.00 176.76 175.28 3hjt h TYR 40 N 0.86 -0.56 -0.19 2.97 3.20 -1.79 -1.72 116.97 119.75 3hjt h TYR 40 Ca 0.00 0.04 0.04 0.00 3.14 0.00 0.00 58.73 61.95 3hjt h TYR 40 Cb 0.00 0.30 -0.01 0.00 1.54 0.00 0.00 36.73 38.56 3hjt h TYR 40 CO 0.00 -0.29 0.13 -1.35 -1.64 0.00 0.00 178.16 175.01 3hjt h PRO 41 N -0.18 0.05 0.12 1.82 0.11 -1.92 -0.10 132.00 131.90 3hjt h PRO 41 Ca 0.17 -0.00 -0.22 0.00 0.11 0.00 0.00 66.00 66.05 3hjt h PRO 41 Cb 0.44 -0.01 0.02 0.00 0.11 0.00 0.00 31.00 31.56 3hjt h PRO 41 CO -0.43 0.04 -0.93 0.52 -0.21 0.00 0.00 178.00 176.98 3hjt h MET 42 N 0.06 0.42 0.24 1.05 2.86 -1.88 -2.64 114.93 115.04 3hjt h MET 42 Ca 0.09 -0.61 -0.00 0.00 -2.06 0.00 0.00 59.70 57.11 3hjt h MET 42 Cb 0.27 0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.13 3hjt h MET 42 CO -0.01 1.26 -0.20 -0.92 1.06 0.00 0.00 176.91 178.11 3hjt h TYR 43 N -0.12 -0.51 0.10 -0.22 3.20 -0.91 -1.78 116.97 116.73 3hjt h TYR 43 Ca -0.15 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.74 3hjt h TYR 43 Cb 1.69 0.19 -0.03 0.00 1.54 0.00 0.00 36.73 40.11 3hjt h TYR 43 CO 0.16 -0.30 -0.26 0.00 -1.64 0.00 0.00 178.16 176.12 3hjt h ALA 44 N 0.27 -0.43 0.54 1.82 0.00 -1.13 -0.95 119.26 119.37 3hjt h ALA 44 Ca -0.01 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.84 3hjt h ALA 44 Cb 0.40 0.43 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3hjt h ALA 44 CO -0.02 -0.79 -0.36 0.52 0.00 0.00 0.00 179.25 178.60 3hjt h MET 45 N -0.46 -0.83 -0.18 0.00 2.86 -1.42 0.06 114.93 114.96 3hjt h MET 45 Ca 0.03 0.06 -0.03 0.00 -2.06 0.00 0.00 59.70 57.71 3hjt h MET 45 Cb 0.50 0.19 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 3hjt h MET 45 CO -0.16 -0.55 -0.00 1.79 1.06 0.00 0.00 176.91 179.04 3hjt h THR 46 N -0.86 1.12 -0.06 2.22 1.35 -1.32 -1.84 112.91 113.51 3hjt h THR 46 Ca -0.06 -0.46 -0.02 0.00 -0.55 0.00 0.00 66.41 65.31 3hjt h THR 46 Cb 0.71 0.99 -0.00 0.00 -1.73 0.00 0.00 68.15 68.12 3hjt h THR 46 CO 0.04 0.15 -0.06 0.50 -0.25 0.00 0.00 175.52 175.91 3hjt h LYS 47 N 0.25 0.15 -0.06 4.72 1.63 -0.93 0.96 116.57 123.30 3hjt h LYS 47 Ca 0.06 -0.08 -0.04 0.00 -0.85 0.00 0.00 60.65 59.74 3hjt h LYS 47 Cb 0.18 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.81 3hjt h LYS 47 CO 0.00 0.58 -0.14 0.93 -3.45 0.00 0.00 179.45 177.37 3hjt h GLU 48 N -0.28 0.09 0.15 1.90 5.08 -0.80 0.08 114.58 120.80 3hjt h GLU 48 Ca 0.01 -0.02 -0.30 0.00 -1.00 0.00 0.00 59.36 58.05 3hjt h GLU 48 Cb 0.55 -0.01 0.03 0.00 0.50 0.00 0.00 28.75 29.82 3hjt h GLU 48 CO 0.01 0.24 -1.30 0.28 -1.00 0.00 0.00 179.01 177.25 3hjt h VAL 49 N 0.09 1.31 -0.02 3.13 2.07 -1.26 -3.30 116.25 118.27 3hjt h VAL 49 Ca 0.02 -2.59 -0.16 0.00 0.82 0.00 0.00 66.70 64.79 3hjt h VAL 49 Cb 0.31 2.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.87 3hjt h VAL 49 CO 0.02 0.78 -0.71 -1.28 0.02 0.00 0.00 177.57 176.40 3hjt h SER 50 N 0.22 0.15 0.00 0.57 0.87 -0.52 -3.40 113.55 111.44 3hjt h SER 50 Ca -0.20 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.26 3hjt h SER 50 Cb 1.98 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.89 3hjt h SER 50 CO 0.24 0.81 0.00 0.61 -0.53 0.00 0.00 176.83 177.96 3hjt n GLY 51 N 0.51 1.99 0.00 5.77 0.00 -0.01 -2.69 105.19 110.75 3hjt n GLY 51 Ca -0.02 -0.43 0.10 0.00 0.00 0.00 0.00 46.02 45.67 3hjt n GLY 51 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hjt n ASP 52 N 7.86 0.82 -0.03 1.61 8.00 -1.26 -4.67 116.55 128.87 3hjt n ASP 52 Ca 0.00 -0.80 -0.14 0.00 0.71 0.00 0.00 54.79 54.56 3hjt n ASP 52 Cb 0.00 1.18 -0.09 0.00 -0.02 0.00 0.00 41.12 42.20 3hjt n ASP 52 CO 0.00 0.00 0.00 -0.07 -0.39 0.00 0.00 177.20 176.74 3hjt h LEU 53 N 0.00 -1.62 0.00 0.64 3.38 -1.91 -3.45 115.31 112.35 3hjt h LEU 53 Ca 0.00 0.20 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 3hjt h LEU 53 Cb 0.57 0.65 -0.00 0.00 0.09 0.00 0.00 40.66 41.97 3hjt h LEU 53 CO 0.00 -0.46 -0.02 0.59 0.09 0.00 0.00 178.44 178.65 3hjt n ASN 54 N -5.43 0.83 -4.07 -0.43 3.02 -1.26 -4.51 115.26 103.41 3hjt n ASN 54 Ca -0.05 -1.13 -0.33 0.00 -0.03 0.00 0.00 54.58 53.03 3hjt n ASN 54 Cb 0.37 -0.01 -0.14 0.00 -0.61 0.00 0.00 39.78 39.40 3hjt n ASN 54 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 3hjt s ASP 55 N -1.25 4.96 -0.15 6.41 2.15 -1.16 -4.97 116.67 122.65 3hjt s ASP 55 Ca 0.03 -2.00 -0.14 0.00 0.43 0.00 0.00 52.55 50.87 3hjt s ASP 55 Cb -0.00 -1.71 -0.05 0.00 -0.30 0.00 0.00 42.92 40.86 3hjt s ASP 55 CO 0.02 -0.43 0.32 -0.69 -0.17 0.00 0.00 175.17 174.22 3hjt s VAL 56 N 1.03 5.28 0.25 1.11 1.01 -1.26 -1.07 120.40 126.76 3hjt s VAL 56 Ca 0.08 0.61 0.06 0.00 0.00 0.00 0.00 61.98 62.72 3hjt s VAL 56 Cb -0.21 -3.66 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 3hjt s VAL 56 CO -0.06 0.39 -0.06 -0.13 0.00 0.00 0.00 175.10 175.24 3hjt s ARG 57 N 0.43 1.46 0.00 2.72 1.81 -0.82 -5.00 118.95 119.55 3hjt s ARG 57 Ca 0.18 -1.72 0.06 0.00 -1.72 0.00 0.00 55.73 52.53 3hjt s ARG 57 Cb -0.13 -1.01 -0.02 0.00 -0.45 0.00 0.00 34.95 33.34 3hjt s ARG 57 CO 0.05 0.03 -0.19 1.41 -0.68 0.00 0.00 175.30 175.92 3hjt s MET 58 N -3.75 1.42 -0.08 3.54 -2.45 -1.26 -0.94 119.30 115.78 3hjt s MET 58 Ca 0.28 -0.74 -0.01 0.00 -1.25 0.00 0.00 55.69 53.97 3hjt s MET 58 Cb 0.04 -1.42 -0.01 0.00 1.25 0.00 0.00 34.83 34.69 3hjt s MET 58 CO 0.10 0.38 0.05 0.82 1.05 0.00 0.00 175.02 177.42 3hjt h ILE 59 N 4.59 0.00 -3.65 10.11 1.08 -1.13 -3.45 117.51 125.06 3hjt h ILE 59 Ca -0.39 -0.81 -0.69 0.00 -0.39 0.00 0.00 64.86 62.59 3hjt h ILE 59 Cb 1.15 0.00 -0.34 0.00 -3.07 0.00 0.00 36.82 34.57 3hjt h ILE 59 CO 0.47 0.00 -0.64 -1.58 -0.69 0.00 0.00 178.15 175.71 3hjt s GLN 60 N -1.59 2.23 0.00 2.37 2.00 -0.28 -4.94 119.66 119.45 3hjt s GLN 60 Ca -0.01 -1.51 0.24 0.00 -2.00 0.00 0.00 55.36 52.09 3hjt s GLN 60 Cb 0.00 -3.36 0.28 0.00 0.80 0.00 0.00 33.01 30.73 3hjt s GLN 60 CO 0.02 -0.82 1.29 -1.13 -0.50 0.00 0.00 175.29 174.15 3hjt n SER 61 N 4.61 2.33 0.00 6.67 3.41 -1.26 -3.92 113.62 125.45 3hjt n SER 61 Ca -0.08 -1.68 0.00 0.00 -0.26 0.00 0.00 58.87 56.85 3hjt n SER 61 Cb 0.43 0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 3hjt n SER 61 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hjt n GLY 62 N 1.35 3.73 3.88 5.00 0.00 -1.26 -0.37 105.19 117.52 3hjt n GLY 62 Ca 0.13 -2.00 -0.30 0.00 0.00 0.00 0.00 46.02 43.85 3hjt n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hjt s ALA 63 N -2.14 3.22 0.00 4.61 0.00 -1.26 -4.35 121.76 121.84 3hjt s ALA 63 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.76 3hjt s ALA 63 Cb 0.00 -2.89 0.00 0.00 0.00 0.00 0.00 23.12 20.23 3hjt s ALA 63 CO 0.00 -0.45 0.00 0.41 0.00 0.00 0.00 175.76 175.72 3hjt n GLY 64 N -2.30 0.92 0.34 0.00 0.00 -1.26 -4.98 105.19 97.91 3hjt n GLY 64 Ca 0.04 -0.11 0.16 0.00 0.00 0.00 0.00 46.02 46.12 3hjt n GLY 64 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 3hjt h ILE 65 N 0.00 0.63 0.00 -0.61 6.09 -1.86 0.30 117.51 122.07 3hjt h ILE 65 Ca 0.00 0.00 -0.00 0.00 -1.37 0.00 0.00 64.86 63.49 3hjt h ILE 65 Cb 0.00 0.84 0.00 0.00 0.47 0.00 0.00 36.82 38.13 3hjt h ILE 65 CO 0.00 0.00 -0.00 0.45 -3.07 0.00 0.00 178.15 175.53 3hjt h HIS 66 N 0.00 -0.00 -0.60 2.19 3.86 -1.93 -3.25 115.15 115.41 3hjt h HIS 66 Ca 0.12 -0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.33 3hjt h HIS 66 Cb 0.55 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.02 3hjt h HIS 66 CO 0.00 0.42 0.00 -1.13 0.86 0.00 0.00 177.93 178.08 3hjt n SER 67 N -4.89 4.48 -4.79 2.45 3.41 -0.68 -4.99 113.62 108.62 3hjt n SER 67 Ca -0.08 -2.43 -0.36 0.00 -0.26 0.00 0.00 58.87 55.74 3hjt n SER 67 Cb 0.22 -0.56 -0.04 0.00 -0.26 0.00 0.00 64.21 63.56 3hjt n SER 67 CO 0.00 0.00 0.00 0.12 -0.16 0.00 0.00 175.04 175.00 3hjt s PHE 68 N -1.85 3.25 -0.04 7.33 5.36 0.98 -5.07 117.98 127.94 3hjt s PHE 68 Ca 0.48 1.64 -0.01 0.00 -0.96 0.00 0.00 56.93 58.07 3hjt s PHE 68 Cb 0.31 -3.07 0.03 0.00 -0.34 0.00 0.00 43.02 39.95 3hjt s PHE 68 CO 0.23 -0.55 0.08 -1.21 -1.46 0.00 0.00 175.22 172.31 3hjt s GLU 69 N -2.68 0.00 0.61 10.12 0.41 -1.26 -4.88 118.70 121.03 3hjt s GLU 69 Ca 0.59 0.28 -0.18 0.00 -0.41 0.00 0.00 54.97 55.26 3hjt s GLU 69 Cb -0.19 -0.25 -0.02 0.00 -1.78 0.00 0.00 34.13 31.88 3hjt s GLU 69 CO 0.24 -0.19 1.22 -1.25 -0.49 0.00 0.00 175.26 174.79 3hjt s PRO 70 N 1.28 2.83 0.46 0.39 0.04 -1.26 -5.03 135.00 133.71 3hjt s PRO 70 Ca -0.07 1.85 -0.03 0.00 0.04 0.00 0.00 61.00 62.79 3hjt s PRO 70 Cb -0.12 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.48 3hjt s PRO 70 CO -0.04 -1.32 0.74 -1.54 0.04 0.00 0.00 177.00 174.87 3hjt s SER 71 N -1.61 6.12 0.44 6.66 1.04 -1.26 -4.89 113.70 120.20 3hjt s SER 71 Ca 0.78 0.71 0.19 0.00 0.48 0.00 0.00 55.95 58.11 3hjt s SER 71 Cb -0.31 -2.03 1.14 0.00 0.10 0.00 0.00 66.02 64.91 3hjt s SER 71 CO 0.35 -0.60 1.87 -0.37 0.98 0.00 0.00 173.24 175.48 3hjt h VAL 72 N 0.30 0.68 -0.39 5.02 -1.51 -2.00 0.23 116.25 118.59 3hjt h VAL 72 Ca -0.47 -0.12 -0.09 0.00 -1.23 0.00 0.00 66.70 64.79 3hjt h VAL 72 Cb 1.22 0.31 -0.01 0.00 -2.13 0.00 0.00 31.29 30.68 3hjt h VAL 72 CO 0.61 0.06 -0.12 0.78 -1.23 0.00 0.00 177.57 177.67 3hjt h ASN 73 N 0.34 0.78 0.08 4.19 4.21 -1.99 -2.12 115.58 121.07 3hjt h ASN 73 Ca 0.44 -0.38 0.02 0.00 1.21 0.00 0.00 56.30 57.59 3hjt h ASN 73 Cb 1.18 -0.21 -0.03 0.00 -1.12 0.00 0.00 38.32 38.14 3hjt h ASN 73 CO -0.14 0.98 -0.19 0.44 -1.29 0.00 0.00 177.43 177.22 3hjt h ASP 74 N 0.57 -0.55 0.00 5.81 3.32 -0.94 -1.37 116.42 123.26 3hjt h ASP 74 Ca 0.10 0.07 -0.00 0.00 0.02 0.00 0.00 57.03 57.21 3hjt h ASP 74 Cb 0.65 0.21 -0.00 0.00 0.22 0.00 0.00 39.33 40.41 3hjt h ASP 74 CO 0.04 -0.27 -0.00 -0.37 -1.72 0.00 0.00 179.24 176.92 3hjt h VAL 75 N -0.36 0.95 -0.26 -1.35 -1.51 -1.25 -1.96 116.25 110.51 3hjt h VAL 75 Ca 0.03 -0.01 -0.07 0.00 -1.23 0.00 0.00 66.70 65.43 3hjt h VAL 75 Cb 0.39 1.00 -0.01 0.00 -2.13 0.00 0.00 31.29 30.55 3hjt h VAL 75 CO -0.13 0.00 -0.12 0.00 -1.23 0.00 0.00 177.57 176.09 3hjt h ALA 76 N 2.00 0.37 -0.02 5.19 0.00 -0.64 -1.12 119.26 125.04 3hjt h ALA 76 Ca -0.00 -0.31 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 3hjt h ALA 76 Cb 0.00 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3hjt h ALA 76 CO 0.00 0.23 -0.12 0.00 0.00 0.00 0.00 179.25 179.37 3hjt h ALA 77 N 0.73 1.77 -0.19 0.00 0.00 -0.56 0.16 119.26 121.17 3hjt h ALA 77 Ca 0.06 -0.12 -0.17 0.00 0.00 0.00 0.00 54.91 54.67 3hjt h ALA 77 Cb 0.63 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 3hjt h ALA 77 CO 0.04 0.18 -0.59 0.82 0.00 0.00 0.00 179.25 179.69 3hjt h ILE 78 N 0.03 1.32 0.00 0.00 2.04 -1.07 -2.56 117.51 117.26 3hjt h ILE 78 Ca 0.01 -1.84 -0.00 0.00 1.00 0.00 0.00 64.86 64.02 3hjt h ILE 78 Cb 0.23 1.81 -0.00 0.00 -0.74 0.00 0.00 36.82 38.12 3hjt h ILE 78 CO 0.02 0.58 -0.01 1.88 0.00 0.00 0.00 178.15 180.61 3hjt h TYR 79 N 0.46 0.00 -0.17 1.37 0.05 -0.06 -3.09 116.97 115.54 3hjt h TYR 79 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 3hjt h TYR 79 Cb 1.16 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.90 3hjt h TYR 79 CO 0.05 0.01 0.00 -0.25 -1.05 0.00 0.00 178.16 176.93 3hjt n ASP 80 N -3.10 2.69 -4.87 3.88 9.92 -0.07 -4.65 116.55 120.35 3hjt n ASP 80 Ca 0.03 -1.87 -0.29 0.00 -0.53 0.00 0.00 54.79 52.13 3hjt n ASP 80 Cb 0.48 -0.10 -0.05 0.00 -0.64 0.00 0.00 41.12 40.82 3hjt n ASP 80 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3hjt s ALA 81 N -1.80 3.81 0.17 2.24 0.00 -0.97 -4.94 121.76 120.28 3hjt s ALA 81 Ca 0.34 -1.00 -0.03 0.00 0.00 0.00 0.00 51.96 51.26 3hjt s ALA 81 Cb 0.21 -1.64 0.06 0.00 0.00 0.00 0.00 23.12 21.75 3hjt s ALA 81 CO 0.30 0.67 1.45 -0.44 0.00 0.00 0.00 175.76 177.74 3hjt h ASP 82 N 2.74 0.58 -3.68 0.00 3.32 -1.22 -3.39 116.42 114.77 3hjt h ASP 82 Ca -0.47 -0.35 -0.20 0.00 0.02 0.00 0.00 57.03 56.03 3hjt h ASP 82 Cb 1.18 -0.17 -0.28 0.00 0.22 0.00 0.00 39.33 40.28 3hjt h ASP 82 CO 0.69 1.09 -0.55 -0.22 -1.72 0.00 0.00 179.24 178.53 3hjt s LEU 83 N -8.16 1.19 -0.25 1.55 2.96 -0.75 -2.93 118.68 112.29 3hjt s LEU 83 Ca -0.07 0.32 0.01 0.00 -0.22 0.00 0.00 54.13 54.17 3hjt s LEU 83 Cb 0.11 0.51 0.07 0.00 0.50 0.00 0.00 46.19 47.38 3hjt s LEU 83 CO 0.85 -0.08 -0.02 0.12 -1.32 0.00 0.00 176.35 175.90 3hjt s PHE 84 N 0.40 2.38 -0.18 5.38 5.36 0.13 -0.79 117.98 130.66 3hjt s PHE 84 Ca -0.03 -1.84 -0.08 0.00 -0.96 0.00 0.00 56.93 54.02 3hjt s PHE 84 Cb -0.04 -1.71 -0.04 0.00 -0.34 0.00 0.00 43.02 40.89 3hjt s PHE 84 CO -0.02 -0.80 0.09 0.54 -1.46 0.00 0.00 175.22 173.58 3hjt s VAL 85 N 1.40 5.09 0.15 3.12 0.11 0.11 -1.35 120.40 129.03 3hjt s VAL 85 Ca -0.02 0.07 0.05 0.00 -2.93 0.00 0.00 61.98 59.15 3hjt s VAL 85 Cb -0.19 -3.29 -0.04 0.00 -1.53 0.00 0.00 36.38 31.33 3hjt s VAL 85 CO -0.09 0.48 -0.11 -0.72 -3.33 0.00 0.00 175.10 171.32 3hjt s TYR 86 N 0.16 1.35 -0.01 1.54 1.13 -0.89 -1.84 117.35 118.79 3hjt s TYR 86 Ca 0.07 -0.69 -0.19 0.00 -1.41 0.00 0.00 57.07 54.85 3hjt s TYR 86 Cb -0.12 -0.68 -0.10 0.00 -1.10 0.00 0.00 41.96 39.96 3hjt s TYR 86 CO -0.00 0.13 0.83 1.25 -2.51 0.00 0.00 175.55 175.25 3hjt h HIS 87 N 2.90 -0.63 -3.63 -3.49 -0.00 -1.94 0.25 115.15 108.61 3hjt h HIS 87 Ca -0.37 -0.01 -0.09 0.00 -0.00 0.00 0.00 60.37 59.90 3hjt h HIS 87 Cb 1.20 0.21 -0.08 0.00 -0.00 0.00 0.00 27.41 28.74 3hjt h HIS 87 CO 0.66 -0.39 -0.07 0.45 -0.00 0.00 0.00 177.93 178.58 3hjt s SER 88 N -4.51 0.10 0.00 3.26 0.15 -1.26 -1.44 113.70 110.01 3hjt s SER 88 Ca -0.10 -1.04 0.25 0.00 0.70 0.00 0.00 55.95 55.76 3hjt s SER 88 Cb 0.01 0.64 0.55 0.00 -1.71 0.00 0.00 66.02 65.51 3hjt s SER 88 CO 0.30 -1.25 1.44 0.00 1.20 0.00 0.00 173.24 174.93 3hjt n HIS 89 N -0.44 0.00 1.17 3.44 1.44 -1.26 -2.06 115.22 117.51 3hjt n HIS 89 Ca -0.02 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.82 3hjt n HIS 89 Cb 0.61 -0.16 0.33 0.00 0.12 0.00 0.00 29.99 30.89 3hjt n HIS 89 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 3hjt n THR 90 N -1.03 0.00 0.00 0.61 -2.24 -1.26 -4.09 114.28 106.27 3hjt n THR 90 Ca 0.09 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 3hjt n THR 90 Cb 0.35 0.38 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 3hjt n THR 90 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 3hjt n LEU 91 N -0.87 0.00 -3.73 3.22 7.94 -1.22 -4.83 117.00 117.51 3hjt n LEU 91 Ca 0.10 0.00 -0.42 0.00 -1.11 0.00 0.00 56.01 54.58 3hjt n LEU 91 Cb 0.35 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.29 3hjt n LEU 91 CO 0.29 -0.26 2.67 -0.62 -1.11 0.00 0.00 177.39 178.35 3hjt n GLU 92 N -1.79 2.80 0.05 1.96 4.71 -0.88 -4.71 120.64 122.79 3hjt n GLU 92 Ca 0.00 -2.57 0.18 0.00 -0.01 0.00 0.00 57.16 54.76 3hjt n GLU 92 Cb 0.00 -3.28 0.68 0.00 -1.01 0.00 0.00 31.44 27.84 3hjt n GLU 92 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3hjt h ALA 93 N 6.08 2.40 0.00 0.62 0.00 -1.77 -1.70 119.26 124.89 3hjt h ALA 93 Ca 0.56 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.43 3hjt h ALA 93 Cb 0.64 0.03 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 3hjt h ALA 93 CO 1.89 -0.52 -0.12 0.11 0.00 0.00 0.00 179.25 180.61 3hjt h TRP 94 N 0.00 0.00 -0.16 0.00 5.08 -1.90 -3.23 115.95 115.74 3hjt h TRP 94 Ca 0.20 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.14 3hjt h TRP 94 Cb 0.81 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.96 3hjt h TRP 94 CO 0.00 0.12 -0.05 0.00 -1.28 0.00 0.00 178.44 177.23 3hjt h ALA 95 N 1.88 1.62 0.00 0.11 0.00 -1.67 -2.60 119.26 118.60 3hjt h ALA 95 Ca -0.00 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.66 3hjt h ALA 95 Cb 0.65 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 3hjt h ALA 95 CO 0.02 0.28 -0.50 0.07 0.00 0.00 0.00 179.25 179.11 3hjt h ARG 96 N 0.23 0.00 -1.05 0.00 0.11 -1.74 -3.07 114.38 108.87 3hjt h ARG 96 Ca 0.05 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.13 3hjt h ARG 96 Cb 0.24 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.32 3hjt h ARG 96 CO 0.01 0.50 0.00 -0.25 0.10 0.00 0.00 179.97 180.33 3hjt n ASP 97 N -3.52 2.35 -5.00 0.08 8.00 -0.98 -4.80 116.55 112.67 3hjt n ASP 97 Ca -0.00 -1.82 -0.18 0.00 0.71 0.00 0.00 54.79 53.49 3hjt n ASP 97 Cb 0.61 -0.46 0.01 0.00 -0.02 0.00 0.00 41.12 41.26 3hjt n ASP 97 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3hjt s LEU 98 N 0.00 3.69 -0.28 0.64 1.02 -1.16 -5.11 118.68 117.47 3hjt s LEU 98 Ca 0.00 -0.26 0.02 0.00 0.02 0.00 0.00 54.13 53.90 3hjt s LEU 98 Cb 0.00 -2.74 0.17 0.00 0.02 0.00 0.00 46.19 43.64 3hjt s LEU 98 CO 0.00 -0.73 0.50 -0.62 0.02 0.00 0.00 176.35 175.52 3hjt s ASP 99 N -4.31 -0.63 -0.90 2.29 -1.08 -1.26 -5.14 116.67 105.64 3hjt s ASP 99 Ca 0.52 0.18 -0.24 0.00 -0.52 0.00 0.00 52.55 52.49 3hjt s ASP 99 Cb -0.10 1.62 0.02 0.00 -1.46 0.00 0.00 42.92 43.00 3hjt s ASP 99 CO 0.34 -0.31 1.55 -2.84 0.52 0.00 0.00 175.17 174.43 3hjt s PRO 100 N 2.70 3.20 -0.63 4.34 0.02 -1.26 -4.57 135.00 138.79 3hjt s PRO 100 Ca 0.13 -0.60 0.05 0.00 0.02 0.00 0.00 61.00 60.60 3hjt s PRO 100 Cb -0.13 -4.96 0.18 0.00 0.02 0.00 0.00 34.50 29.62 3hjt s PRO 100 CO -0.24 -2.49 0.51 1.17 -0.33 0.00 0.00 177.00 175.62 3hjt n LYS 104 N 9.01 1.60 -3.46 5.54 4.81 -1.26 -4.91 118.16 129.49 3hjt n LYS 104 Ca 0.27 -4.23 -0.25 0.00 -0.87 0.00 0.00 58.31 53.23 3hjt n LYS 104 Cb 0.50 -2.13 -0.02 0.00 0.02 0.00 0.00 35.03 33.40 3hjt n LYS 104 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 3hjt s SER 105 N -1.34 6.33 -0.91 3.14 0.15 -1.26 -5.00 113.70 114.81 3hjt s SER 105 Ca 0.29 0.45 -0.26 0.00 0.70 0.00 0.00 55.95 57.13 3hjt s SER 105 Cb 0.01 -2.03 -0.13 0.00 -1.71 0.00 0.00 66.02 62.16 3hjt s SER 105 CO -0.15 -0.23 2.20 -0.75 1.20 0.00 0.00 173.24 175.52 3hjt s LYS 106 N -4.04 1.79 0.00 5.44 2.47 -1.26 -4.90 119.74 119.24 3hjt s LYS 106 Ca 0.40 -0.03 0.00 0.00 -1.56 0.00 0.00 55.97 54.78 3hjt s LYS 106 Cb -0.10 -4.93 0.00 0.00 -1.46 0.00 0.00 37.83 31.34 3hjt s LYS 106 CO 0.34 -4.42 0.00 0.28 0.16 0.00 0.00 175.35 171.71 3hjt n VAL 107 N 8.57 0.00 -3.30 4.02 0.31 -1.26 -4.71 118.33 121.95 3hjt n VAL 107 Ca 0.44 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.69 3hjt n VAL 107 Cb 0.45 -0.30 -0.06 0.00 -0.91 0.00 0.00 33.84 33.02 3hjt n VAL 107 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 3hjt s ASN 108 N -0.78 0.19 -0.56 4.52 3.84 -1.15 -4.93 114.94 116.08 3hjt s ASN 108 Ca 0.00 -0.17 -0.21 0.00 0.21 0.00 0.00 52.86 52.69 3hjt s ASN 108 Cb 0.00 1.19 0.06 0.00 -0.55 0.00 0.00 41.25 41.96 3hjt s ASN 108 CO 0.00 -0.34 0.78 -0.69 -2.79 0.00 0.00 177.10 174.06 3hjt s VAL 109 N 2.57 4.64 -0.38 -5.21 1.01 -1.26 0.18 120.40 121.96 3hjt s VAL 109 Ca 0.11 -0.35 -0.08 0.00 0.00 0.00 0.00 61.98 61.66 3hjt s VAL 109 Cb -0.13 -4.46 0.05 0.00 0.00 0.00 0.00 36.38 31.85 3hjt s VAL 109 CO -0.26 -1.05 0.18 0.12 0.00 0.00 0.00 175.10 174.09 3hjt s PHE 110 N 3.23 3.30 -0.97 5.22 5.36 -0.45 -4.99 117.98 128.66 3hjt s PHE 110 Ca 0.20 -1.42 -0.23 0.00 -0.96 0.00 0.00 56.93 54.52 3hjt s PHE 110 Cb -0.18 -2.58 0.06 0.00 -0.34 0.00 0.00 43.02 39.98 3hjt s PHE 110 CO 0.13 -0.77 1.39 -2.00 -1.46 0.00 0.00 175.22 172.51 3hjt s GLU 111 N 1.43 3.54 0.60 10.12 2.12 -1.26 -2.09 118.70 133.15 3hjt s GLU 111 Ca 0.01 -1.07 0.29 0.00 0.36 0.00 0.00 54.97 54.55 3hjt s GLU 111 Cb -0.21 -5.16 1.30 0.00 0.26 0.00 0.00 34.13 30.31 3hjt s GLU 111 CO 0.03 -2.16 1.68 0.00 -0.54 0.00 0.00 175.26 174.28 3hjt h ALA 112 N 9.73 2.46 -0.58 6.30 0.00 -1.03 -2.34 119.26 133.81 3hjt h ALA 112 Ca 0.13 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3hjt h ALA 112 Cb 1.02 0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.86 3hjt h ALA 112 CO 1.38 -1.10 0.00 -1.13 0.00 0.00 0.00 179.25 178.40 3hjt n SER 113 N -3.53 5.76 -0.11 0.00 3.41 -0.52 -4.63 113.62 114.00 3hjt n SER 113 Ca 0.14 -2.93 -0.05 0.00 -0.26 0.00 0.00 58.87 55.76 3hjt n SER 113 Cb 0.99 -0.69 0.01 0.00 -0.26 0.00 0.00 64.21 64.26 3hjt n SER 113 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 3hjt h LYS 114 N 4.01 -0.05 0.68 4.33 1.57 -1.66 -3.05 116.57 122.39 3hjt h LYS 114 Ca 0.00 0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 3hjt h LYS 114 Cb 1.99 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 34.30 3hjt h LYS 114 CO 0.49 -0.03 -0.45 -1.35 -0.57 0.00 0.00 179.45 177.53 3hjt h PRO 115 N -0.05 -1.04 -6.01 3.15 0.11 -1.87 -3.45 132.00 122.84 3hjt h PRO 115 Ca 0.19 0.07 -0.62 0.00 0.11 0.00 0.00 66.00 65.75 3hjt h PRO 115 Cb 0.34 0.24 0.16 0.00 0.11 0.00 0.00 31.00 31.84 3hjt h PRO 115 CO -0.42 -0.69 -0.97 1.28 -0.21 0.00 0.00 178.00 176.99 3hjt n LEU 116 N -5.58 -2.94 -4.14 2.35 4.32 -1.16 -4.92 117.00 104.94 3hjt n LEU 116 Ca -0.14 0.79 -0.38 0.00 -0.02 0.00 0.00 56.01 56.26 3hjt n LEU 116 Cb 0.46 -0.88 -0.08 0.00 -1.62 0.00 0.00 43.42 41.30 3hjt n LEU 116 CO 0.33 -4.26 0.10 0.42 -1.22 0.00 0.00 177.39 172.75 3hjt s THR 117 N -1.72 4.05 0.32 -5.08 -4.23 -1.26 -5.07 115.64 102.65 3hjt s THR 117 Ca 0.59 -2.80 -0.29 0.00 -1.18 0.00 0.00 61.69 58.01 3hjt s THR 117 Cb -0.62 -3.61 -0.11 0.00 1.34 0.00 0.00 72.50 69.50 3hjt s THR 117 CO 0.63 -0.89 1.46 -0.76 -0.54 0.00 0.00 174.62 174.51 3hjt s LEU 118 N 0.07 4.36 0.53 4.79 1.43 -1.26 -4.99 118.68 123.61 3hjt s LEU 118 Ca 0.16 2.86 -0.18 0.00 -1.03 0.00 0.00 54.13 55.94 3hjt s LEU 118 Cb -0.19 -3.65 -0.06 0.00 0.03 0.00 0.00 46.19 42.32 3hjt s LEU 118 CO -0.04 -0.76 1.03 -1.81 0.23 0.00 0.00 176.35 175.00 3hjt s ASP 119 N 0.03 6.18 0.59 2.29 1.01 -1.26 -4.87 116.67 120.63 3hjt s ASP 119 Ca 0.56 1.81 -0.14 0.00 0.71 0.00 0.00 52.55 55.49 3hjt s ASP 119 Cb -0.44 -2.54 -0.04 0.00 1.01 0.00 0.00 42.92 40.90 3hjt s ASP 119 CO 0.53 -0.89 1.03 -0.60 0.21 0.00 0.00 175.17 175.44 3hjt s ARG 120 N -3.72 3.53 0.18 8.23 3.52 -1.26 -1.48 118.95 127.95 3hjt s ARG 120 Ca 0.64 0.99 -0.10 0.00 -0.13 0.00 0.00 55.73 57.13 3hjt s ARG 120 Cb -0.15 -2.07 -0.07 0.00 -1.56 0.00 0.00 34.95 31.10 3hjt s ARG 120 CO 0.28 -0.63 0.51 0.08 -0.81 0.00 0.00 175.30 174.74 3hjt s VAL 121 N -2.74 4.96 0.00 7.11 1.01 -1.26 -4.66 120.40 124.81 3hjt s VAL 121 Ca 0.59 0.49 0.00 0.00 0.00 0.00 0.00 61.98 63.07 3hjt s VAL 121 Cb -0.13 -3.65 0.00 0.00 0.00 0.00 0.00 36.38 32.61 3hjt s VAL 121 CO 0.41 0.05 0.00 1.17 0.00 0.00 0.00 175.10 176.73 3hjt n LYS 122 N 0.21 0.00 -0.90 2.72 4.81 -1.26 -4.99 118.16 118.75 3hjt n LYS 122 Ca -0.02 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 57.49 3hjt n LYS 122 Cb 0.52 0.00 -0.04 0.00 0.02 0.00 0.00 35.03 35.53 3hjt n LYS 122 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 3hjt n LEU 138 N 0.00 -0.44 -4.44 3.14 4.32 -1.26 -5.30 117.00 113.02 3hjt n LEU 138 Ca 0.00 1.02 -0.28 0.00 -0.02 0.00 0.00 56.01 56.74 3hjt n LEU 138 Cb 0.00 -2.17 -0.12 0.00 -1.62 0.00 0.00 43.42 39.51 3hjt n LEU 138 CO 0.00 -0.90 -0.52 -0.31 -1.22 0.00 0.00 177.39 174.44 3hjt s TYR 139 N -4.73 2.37 -0.44 -1.77 2.02 -1.26 -4.54 117.35 108.99 3hjt s TYR 139 Ca 0.00 -0.34 -0.25 0.00 -0.37 0.00 0.00 57.07 56.11 3hjt s TYR 139 Cb 0.00 -1.21 0.02 0.00 -0.40 0.00 0.00 41.96 40.38 3hjt s TYR 139 CO 0.00 0.45 0.92 0.34 -1.57 0.00 0.00 175.55 175.69 3hjt s ASP 140 N -2.48 6.53 0.10 2.29 -1.08 -0.55 -4.85 116.67 116.63 3hjt s ASP 140 Ca 0.19 0.19 0.26 0.00 -0.52 0.00 0.00 52.55 52.67 3hjt s ASP 140 Cb -0.09 -2.45 0.99 0.00 -1.46 0.00 0.00 42.92 39.91 3hjt s ASP 140 CO 0.10 -1.01 1.80 -0.81 0.52 0.00 0.00 175.17 175.77 3hjt n PRO 141 N 7.08 0.12 -0.11 4.34 -0.04 -1.26 -4.38 135.00 140.75 3hjt n PRO 141 Ca 0.06 0.15 -0.00 0.00 -0.04 0.00 0.00 63.50 63.66 3hjt n PRO 141 Cb 0.48 -1.65 -0.01 0.00 -0.04 0.00 0.00 33.50 32.29 3hjt n PRO 141 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3hjt n HIS 142 N -1.86 0.00 -0.06 0.54 8.25 -1.26 -4.42 115.22 116.41 3hjt n HIS 142 Ca 0.06 -0.19 -0.12 0.00 -0.26 0.00 0.00 57.72 57.21 3hjt n HIS 142 Cb 0.35 -0.36 0.02 0.00 1.12 0.00 0.00 29.99 31.11 3hjt n HIS 142 CO 0.00 0.00 0.00 1.79 0.64 0.00 0.00 176.34 178.77 3hjt h THR 143 N 2.04 1.29 0.00 1.59 1.35 -1.92 -3.31 112.91 113.95 3hjt h THR 143 Ca 0.01 -1.67 0.00 0.00 -0.55 0.00 0.00 66.41 64.19 3hjt h THR 143 Cb 0.20 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 3hjt h THR 143 CO 0.10 0.54 0.20 4.11 -0.25 0.00 0.00 175.52 180.22 3hjt h TRP 144 N 0.60 0.00 -0.24 4.73 0.09 -1.89 -0.44 115.95 118.79 3hjt h TRP 144 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.01 3hjt h TRP 144 Cb 1.05 0.00 0.00 0.00 0.08 0.00 0.00 29.16 30.29 3hjt h TRP 144 CO 0.06 0.00 0.00 0.25 0.09 0.00 0.00 178.44 178.84 3hjt n THR 145 N -2.19 0.32 -3.76 0.12 -2.24 -1.25 -4.61 114.28 100.67 3hjt n THR 145 Ca -0.01 -0.39 -0.37 0.00 -2.27 0.00 0.00 64.05 61.01 3hjt n THR 145 Cb 0.23 0.28 -0.12 0.00 -2.10 0.00 0.00 70.33 68.61 3hjt n THR 145 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3hjt s ASP 146 N -1.30 5.28 0.29 3.42 -1.08 -0.17 -4.32 116.67 118.79 3hjt s ASP 146 Ca 0.27 -1.38 -0.01 0.00 -0.52 0.00 0.00 52.55 50.91 3hjt s ASP 146 Cb 0.15 -1.85 0.64 0.00 -1.46 0.00 0.00 42.92 40.40 3hjt s ASP 146 CO 0.21 -0.39 1.52 -2.65 0.52 0.00 0.00 175.17 174.38 3hjt n PRO 147 N 4.76 -0.08 0.28 4.34 -0.02 -1.26 -0.55 135.00 142.46 3hjt n PRO 147 Ca -0.10 1.47 -0.16 0.00 -2.02 0.00 0.00 63.50 62.69 3hjt n PRO 147 Cb 0.43 -2.29 -0.08 0.00 -0.02 0.00 0.00 33.50 31.54 3hjt n PRO 147 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 3hjt h VAL 148 N 0.00 0.46 -0.20 -1.45 2.07 -1.93 0.11 116.25 115.31 3hjt h VAL 148 Ca 0.55 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 67.81 3hjt h VAL 148 Cb 1.05 0.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 3hjt h VAL 148 CO -0.94 0.04 0.01 -0.07 0.02 0.00 0.00 177.57 176.63 3hjt h LEU 149 N -0.84 0.25 -0.13 2.57 3.38 -1.66 -0.13 115.31 118.75 3hjt h LEU 149 Ca -0.07 -0.03 -0.07 0.00 0.09 0.00 0.00 57.88 57.80 3hjt h LEU 149 Cb 0.59 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.27 3hjt h LEU 149 CO 0.12 0.29 -0.20 0.00 0.09 0.00 0.00 178.44 178.74 3hjt h ALA 150 N 1.74 0.20 -0.27 1.53 0.00 -0.72 -1.79 119.26 119.96 3hjt h ALA 150 Ca 0.07 -0.36 -0.05 0.00 0.00 0.00 0.00 54.91 54.57 3hjt h ALA 150 Cb 0.17 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 3hjt h ALA 150 CO 0.00 0.14 -0.04 0.78 0.00 0.00 0.00 179.25 180.13 3hjt h GLY 151 N -0.04 0.45 1.61 0.00 0.00 -0.28 -1.70 103.07 103.12 3hjt h GLY 151 Ca 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 47.33 47.08 3hjt h GLY 151 CO 0.05 0.25 -0.25 -1.84 0.00 0.00 0.00 176.54 174.75 3hjt n GLU 152 N -4.29 0.15 0.05 4.80 0.28 -0.11 -2.28 120.64 119.25 3hjt n GLU 152 Ca 0.01 0.08 -0.01 0.00 -0.16 0.00 0.00 57.16 57.08 3hjt n GLU 152 Cb 0.25 -1.63 -0.07 0.00 1.43 0.00 0.00 31.44 31.41 3hjt n GLU 152 CO 0.00 0.00 0.00 1.49 -0.16 0.00 0.00 177.13 178.46 3hjt h GLU 153 N 0.00 0.00 -0.06 3.44 4.81 -0.86 -3.06 114.58 118.84 3hjt h GLU 153 Ca 0.00 0.00 -0.13 0.00 -0.13 0.00 0.00 59.36 59.10 3hjt h GLU 153 Cb 0.63 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 3hjt h GLU 153 CO 0.00 0.38 -0.56 0.00 -0.73 0.00 0.00 179.01 178.10 3hjt h ALA 154 N 1.38 0.94 -0.29 2.92 0.00 -1.18 -2.58 119.26 120.45 3hjt h ALA 154 Ca -0.14 -0.51 -0.19 0.00 0.00 0.00 0.00 54.91 54.07 3hjt h ALA 154 Cb 1.60 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.30 3hjt h ALA 154 CO 0.06 0.70 -0.55 0.28 0.00 0.00 0.00 179.25 179.74 3hjt h VAL 155 N 0.14 1.27 -0.28 0.00 2.07 -1.49 -2.65 116.25 115.32 3hjt h VAL 155 Ca -0.00 -1.73 -0.01 0.00 0.82 0.00 0.00 66.70 65.78 3hjt h VAL 155 Cb 1.03 1.63 -0.01 0.00 -1.52 0.00 0.00 31.29 32.42 3hjt h VAL 155 CO 0.08 0.57 0.13 -1.13 0.02 0.00 0.00 177.57 177.24 3hjt h ASN 156 N 0.67 0.34 0.03 0.57 -0.00 -1.40 -1.36 115.58 114.43 3hjt h ASN 156 Ca 0.01 -0.02 -0.20 0.00 -0.00 0.00 0.00 56.30 56.09 3hjt h ASN 156 Cb 1.16 -0.08 0.00 0.00 -0.00 0.00 0.00 38.32 39.40 3hjt h ASN 156 CO 0.12 0.29 -0.73 0.40 -0.00 0.00 0.00 177.43 177.51 3hjt h ILE 157 N 0.39 1.32 -0.86 2.57 2.04 -1.36 -2.73 117.51 118.88 3hjt h ILE 157 Ca 0.10 -2.02 0.02 0.00 1.00 0.00 0.00 64.86 63.97 3hjt h ILE 157 Cb 0.04 2.00 -0.05 0.00 -0.74 0.00 0.00 36.82 38.08 3hjt h ILE 157 CO -0.01 0.63 0.56 0.00 0.00 0.00 0.00 178.15 179.32 3hjt h ALA 158 N 0.76 1.12 -0.23 1.87 0.00 -0.91 0.13 119.26 122.00 3hjt h ALA 158 Ca -0.04 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3hjt h ALA 158 Cb 1.33 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3hjt h ALA 158 CO 0.14 0.44 0.10 0.87 0.00 0.00 0.00 179.25 180.80 3hjt h LYS 159 N 1.12 0.33 -0.84 0.00 1.57 -1.26 0.28 116.57 117.77 3hjt h LYS 159 Ca 0.33 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 59.05 3hjt h LYS 159 Cb -0.05 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.16 3hjt h LYS 159 CO -0.10 0.37 0.50 1.49 -0.57 0.00 0.00 179.45 181.14 3hjt h GLU 160 N 0.22 1.13 -0.32 3.15 4.57 -1.09 0.54 114.58 122.79 3hjt h GLU 160 Ca 0.08 -0.10 -0.04 0.00 -1.18 0.00 0.00 59.36 58.12 3hjt h GLU 160 Cb 0.15 -0.24 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 3hjt h GLU 160 CO -0.01 0.79 0.05 -0.07 -1.18 0.00 0.00 179.01 178.59 3hjt h LEU 161 N 1.15 0.52 -0.66 1.64 3.38 -0.38 -2.41 115.31 118.55 3hjt h LEU 161 Ca 0.30 -0.26 -0.11 0.00 0.09 0.00 0.00 57.88 57.90 3hjt h LEU 161 Cb -0.05 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.55 3hjt h LEU 161 CO -0.06 0.65 -0.15 1.23 0.09 0.00 0.00 178.44 180.21 3hjt h GLY 162 N 0.37 0.96 1.92 0.83 0.00 0.26 -2.27 103.07 105.15 3hjt h GLY 162 Ca 0.10 -0.78 -0.03 0.00 0.00 0.00 0.00 47.33 46.61 3hjt h GLY 162 CO 0.01 0.72 -0.11 0.84 0.00 0.00 0.00 176.54 178.00 3hjt h HIS 163 N 0.79 0.10 0.00 5.60 -0.00 0.22 -1.48 115.15 120.39 3hjt h HIS 163 Ca 0.12 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.48 3hjt h HIS 163 Cb 0.68 -0.03 0.00 0.00 -0.00 0.00 0.00 27.41 28.06 3hjt h HIS 163 CO 0.04 0.21 -1.07 1.28 -0.00 0.00 0.00 177.93 178.39 3hjt n LEU 164 N -4.36 0.71 -3.19 0.26 4.77 -0.92 -4.53 117.00 109.74 3hjt n LEU 164 Ca -0.02 0.23 -0.23 0.00 -0.03 0.00 0.00 56.01 55.96 3hjt n LEU 164 Cb 0.21 -0.07 -0.07 0.00 -2.33 0.00 0.00 43.42 41.16 3hjt n LEU 164 CO 0.36 -0.12 -0.29 -0.67 -1.33 0.00 0.00 177.39 175.34 3hjt n ASP 165 N -2.47 0.23 0.21 -1.43 2.03 -0.86 -4.97 116.55 109.30 3hjt n ASP 165 Ca 0.00 -2.72 0.18 0.00 0.52 0.00 0.00 54.79 52.77 3hjt n ASP 165 Cb 0.52 -0.64 0.83 0.00 -0.72 0.00 0.00 41.12 41.11 3hjt n ASP 165 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 3hjt h PRO 166 N 3.90 0.00 0.00 -0.67 0.11 -1.52 -1.52 132.00 132.31 3hjt h PRO 166 Ca 0.07 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.18 3hjt h PRO 166 Cb 0.89 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.00 3hjt h PRO 166 CO 0.46 0.00 -0.02 1.57 -0.21 0.00 0.00 178.00 179.80 3hjt h LYS 167 N 0.00 0.00 0.00 1.05 -0.00 -1.93 -2.64 116.57 113.05 3hjt h LYS 167 Ca 0.09 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.74 3hjt h LYS 167 Cb 0.69 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 32.92 3hjt h LYS 167 CO -0.00 0.02 0.00 0.72 -0.00 0.00 0.00 179.45 180.19 3hjt n HIS 168 N -3.24 0.00 0.22 0.07 8.25 -0.60 -4.81 115.22 115.11 3hjt n HIS 168 Ca -0.02 -0.34 0.04 0.00 -0.26 0.00 0.00 57.72 57.14 3hjt n HIS 168 Cb 0.16 -0.03 0.19 0.00 1.12 0.00 0.00 29.99 31.43 3hjt n HIS 168 CO 0.00 0.00 0.00 -0.22 0.64 0.00 0.00 176.34 176.76 3hjt h LYS 169 N 0.00 0.00 0.00 -0.41 3.64 -1.14 0.60 116.57 119.27 3hjt h LYS 169 Ca 0.00 0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3hjt h LYS 169 Cb 0.53 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 3hjt h LYS 169 CO 0.00 0.00 -0.00 -0.44 -2.27 0.00 0.00 179.45 176.74 3hjt h ASP 170 N 0.00 -0.00 -0.67 4.20 3.32 -1.87 -2.86 116.42 118.54 3hjt h ASP 170 Ca 0.00 -0.88 0.06 0.00 0.02 0.00 0.00 57.03 56.23 3hjt h ASP 170 Cb 1.29 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.80 3hjt h ASP 170 CO 0.00 0.90 0.44 -1.28 -1.72 0.00 0.00 179.24 177.58 3hjt h SER 171 N -0.93 0.61 0.40 6.45 0.87 -1.26 0.65 113.55 120.33 3hjt h SER 171 Ca -0.00 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.54 3hjt h SER 171 Cb 0.88 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.71 3hjt h SER 171 CO 0.00 0.40 -0.19 1.88 -0.53 0.00 0.00 176.83 178.39 3hjt h TYR 172 N 0.70 -0.50 -0.22 2.24 0.05 -1.62 -2.20 116.97 115.43 3hjt h TYR 172 Ca 0.28 -0.01 -0.05 0.00 0.05 0.00 0.00 58.73 59.00 3hjt h TYR 172 Cb 0.23 0.16 -0.01 0.00 1.01 0.00 0.00 36.73 38.12 3hjt h TYR 172 CO -0.00 -0.17 -0.09 1.79 -1.05 0.00 0.00 178.16 178.64 3hjt h THR 173 N -0.92 1.19 -0.59 -2.88 1.35 -1.25 -0.59 112.91 109.23 3hjt h THR 173 Ca -0.05 -0.79 -0.07 0.00 -0.55 0.00 0.00 66.41 64.94 3hjt h THR 173 Cb 0.55 1.12 -0.02 0.00 -1.73 0.00 0.00 68.15 68.07 3hjt h THR 173 CO 0.09 0.26 0.09 0.50 -0.25 0.00 0.00 175.52 176.21 3hjt h LYS 174 N 0.33 0.98 0.07 4.72 3.64 0.29 -2.34 116.57 124.26 3hjt h LYS 174 Ca 0.07 -0.26 -0.25 0.00 -1.27 0.00 0.00 60.65 58.94 3hjt h LYS 174 Cb 0.37 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 3hjt h LYS 174 CO 0.02 0.93 -1.10 0.87 -2.27 0.00 0.00 179.45 177.90 3hjt h LYS 175 N 0.88 0.32 0.00 1.90 1.57 -1.16 -3.13 116.57 116.94 3hjt h LYS 175 Ca 0.18 -0.44 -0.01 0.00 -1.87 0.00 0.00 60.65 58.50 3hjt h LYS 175 Cb 0.42 0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 3hjt h LYS 175 CO 0.01 1.16 -0.07 0.00 -0.57 0.00 0.00 179.45 179.98 3hjt h ALA 176 N 0.67 1.09 -0.25 3.86 0.00 -1.02 -1.67 119.26 121.94 3hjt h ALA 176 Ca -0.11 -0.06 -0.19 0.00 0.00 0.00 0.00 54.91 54.55 3hjt h ALA 176 Cb 1.78 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.57 3hjt h ALA 176 CO 0.18 0.09 -0.60 0.87 0.00 0.00 0.00 179.25 179.79 3hjt h LYS 177 N 0.00 0.85 0.31 0.00 1.79 -1.37 -2.25 116.57 115.91 3hjt h LYS 177 Ca -0.00 -0.58 -0.02 0.00 -2.18 0.00 0.00 60.65 57.87 3hjt h LYS 177 Cb 0.39 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.13 3hjt h LYS 177 CO 0.01 1.21 -0.15 0.00 -1.08 0.00 0.00 179.45 179.43 3hjt h ALA 178 N 0.64 -0.42 -0.16 3.86 0.00 -1.33 -0.35 119.26 121.51 3hjt h ALA 178 Ca -0.00 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.80 3hjt h ALA 178 Cb 1.22 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 19.11 3hjt h ALA 178 CO 0.13 -0.64 -0.23 0.35 0.00 0.00 0.00 179.25 178.86 3hjt h PHE 179 N -0.62 -0.61 -0.97 0.00 3.57 -1.40 0.20 116.94 117.10 3hjt h PHE 179 Ca -0.04 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.54 3hjt h PHE 179 Cb 0.45 0.29 -0.06 0.00 2.79 0.00 0.00 35.95 39.42 3hjt h PHE 179 CO -0.00 -0.31 0.63 -0.22 -2.23 0.00 0.00 178.31 176.18 3hjt h LYS 180 N -0.28 1.13 0.22 1.11 3.64 -1.42 -1.44 116.57 119.53 3hjt h LYS 180 Ca 0.11 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.41 3hjt h LYS 180 Cb 0.44 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 3hjt h LYS 180 CO -0.32 0.75 -0.10 -0.22 -2.27 0.00 0.00 179.45 177.29 3hjt h LYS 181 N 1.17 -0.28 0.00 1.90 1.63 0.79 -2.16 116.57 119.62 3hjt h LYS 181 Ca 0.41 0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 60.22 3hjt h LYS 181 Cb 0.11 0.06 -0.00 0.00 -0.60 0.00 0.00 32.23 31.80 3hjt h LYS 181 CO -0.15 -0.11 -0.04 0.93 -3.45 0.00 0.00 179.45 176.64 3hjt h GLU 182 N -0.39 0.00 -0.12 1.90 5.08 -0.35 -2.02 114.58 118.68 3hjt h GLU 182 Ca -0.03 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.15 3hjt h GLU 182 Cb 0.30 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.55 3hjt h GLU 182 CO 0.05 0.04 -0.62 0.00 -1.00 0.00 0.00 179.01 177.48 3hjt h ALA 183 N 1.96 0.24 -0.40 3.43 0.00 -0.92 -2.03 119.26 121.54 3hjt h ALA 183 Ca -0.00 -0.55 -0.05 0.00 0.00 0.00 0.00 54.91 54.31 3hjt h ALA 183 Cb 0.10 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 3hjt h ALA 183 CO 0.00 0.50 0.05 0.93 0.00 0.00 0.00 179.25 180.73 3hjt h GLU 184 N 0.29 0.67 -0.65 0.00 4.39 -0.75 -0.48 114.58 118.05 3hjt h GLU 184 Ca -0.04 -0.19 0.06 0.00 0.34 0.00 0.00 59.36 59.53 3hjt h GLU 184 Cb 1.26 -0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.78 3hjt h GLU 184 CO 0.13 0.73 0.36 1.96 -1.16 0.00 0.00 179.01 181.03 3hjt h GLN 185 N 0.51 0.65 -0.48 2.33 4.20 -1.42 0.25 115.11 121.15 3hjt h GLN 185 Ca 0.12 -0.04 -0.06 0.00 0.06 0.00 0.00 58.65 58.73 3hjt h GLN 185 Cb 0.40 -0.15 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 3hjt h GLN 185 CO 0.01 0.43 0.08 1.25 -0.67 0.00 0.00 178.83 179.93 3hjt h LEU 186 N 0.66 0.75 -0.20 1.46 5.85 -1.17 -0.55 115.31 122.11 3hjt h LEU 186 Ca 0.29 -0.26 0.00 0.00 0.84 0.00 0.00 57.88 58.75 3hjt h LEU 186 Cb 0.18 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.00 3hjt h LEU 186 CO -0.18 0.82 0.14 0.74 -0.34 0.00 0.00 178.44 179.62 3hjt h THR 187 N 0.66 1.05 -0.78 1.05 2.02 -0.15 -1.18 112.91 115.58 3hjt h THR 187 Ca 0.14 -0.10 -0.04 0.00 0.77 0.00 0.00 66.41 67.18 3hjt h THR 187 Cb 0.39 0.76 -0.03 0.00 -1.74 0.00 0.00 68.15 67.52 3hjt h THR 187 CO 0.01 0.05 0.32 -0.33 0.37 0.00 0.00 175.52 175.94 3hjt h GLU 188 N 0.28 1.16 -0.22 6.66 5.08 -0.42 0.19 114.58 127.30 3hjt h GLU 188 Ca 0.07 -0.21 -0.00 0.00 -1.00 0.00 0.00 59.36 58.22 3hjt h GLU 188 Cb -0.03 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 3hjt h GLU 188 CO -0.02 0.94 0.12 1.49 -1.00 0.00 0.00 179.01 180.54 3hjt h GLU 189 N 1.12 0.31 0.00 2.33 4.81 -0.76 -2.80 114.58 119.59 3hjt h GLU 189 Ca 0.26 -0.04 -0.15 0.00 -0.13 0.00 0.00 59.36 59.30 3hjt h GLU 189 Cb 0.21 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 3hjt h GLU 189 CO -0.02 0.29 -0.93 1.88 -0.73 0.00 0.00 179.01 179.49 3hjt h TYR 190 N 0.24 0.00 0.00 0.92 -1.99 -1.08 -2.26 116.97 112.81 3hjt h TYR 190 Ca 0.08 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.80 3hjt h TYR 190 Cb 0.07 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.80 3hjt h TYR 190 CO -0.03 0.62 -0.06 1.79 -0.00 0.00 0.00 178.16 180.48 3hjt h THR 191 N 0.00 0.28 0.14 -2.88 1.35 -0.62 0.51 112.91 111.69 3hjt h THR 191 Ca -0.07 -0.38 -0.29 0.00 -0.55 0.00 0.00 66.41 65.12 3hjt h THR 191 Cb 1.54 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 69.25 3hjt h THR 191 CO 0.07 0.06 -1.43 -0.61 -0.25 0.00 0.00 175.52 173.36 3hjt h GLN 192 N 0.00 0.29 -0.55 4.72 5.75 -1.41 -3.21 115.11 120.70 3hjt h GLN 192 Ca -0.00 -0.50 -0.09 0.00 -0.15 0.00 0.00 58.65 57.91 3hjt h GLN 192 Cb 0.29 0.19 -0.02 0.00 1.07 0.00 0.00 27.48 29.01 3hjt h GLN 192 CO 0.01 1.24 -0.01 0.87 -2.65 0.00 0.00 178.83 178.29 3hjt h LYS 193 N -0.21 0.98 0.00 1.69 1.57 -0.86 -2.94 116.57 116.80 3hjt h LYS 193 Ca -0.29 -0.32 -0.00 0.00 -1.87 0.00 0.00 60.65 58.16 3hjt h LYS 193 Cb 1.84 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 34.06 3hjt h LYS 193 CO 0.10 0.99 -0.02 0.74 -0.57 0.00 0.00 179.45 180.69 3hjt h PHE 194 N 0.86 0.00 0.00 -1.35 0.04 -1.07 -2.58 116.94 112.83 3hjt h PHE 194 Ca 0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.92 3hjt h PHE 194 Cb 0.55 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.70 3hjt h PHE 194 CO 0.04 0.02 0.00 0.87 -0.60 0.00 0.00 178.31 178.64 3hjt h LYS 195 N 0.00 0.00 0.00 1.51 1.57 -1.51 -2.80 116.57 115.34 3hjt h LYS 195 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3hjt h LYS 195 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 3hjt h LYS 195 CO 0.00 0.00 -0.77 1.63 -0.57 0.00 0.00 179.45 179.74 3hjt n LYS 196 N -2.84 0.21 -3.61 3.15 5.02 -0.98 -4.89 118.16 114.23 3hjt n LYS 196 Ca 0.02 0.03 -0.36 0.00 -2.02 0.00 0.00 58.31 55.97 3hjt n LYS 196 Cb 0.36 -1.60 -0.07 0.00 -0.02 0.00 0.00 35.03 33.70 3hjt n LYS 196 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 3hjt s VAL 197 N -3.13 5.32 0.03 -0.18 -7.23 -1.06 -5.01 120.40 109.14 3hjt s VAL 197 Ca 0.06 0.49 -0.20 0.00 -1.81 0.00 0.00 61.98 60.52 3hjt s VAL 197 Cb 0.15 -3.59 -0.16 0.00 0.56 0.00 0.00 36.38 33.34 3hjt s VAL 197 CO 0.75 0.45 1.29 0.03 -0.31 0.00 0.00 175.10 177.31 3hjt h ARG 198 N 6.20 0.40 -6.70 4.82 3.08 -1.85 -3.43 114.38 116.89 3hjt h ARG 198 Ca -0.44 -0.26 -0.52 0.00 0.07 0.00 0.00 59.98 58.82 3hjt h ARG 198 Cb 1.18 0.03 0.05 0.00 0.08 0.00 0.00 29.97 31.30 3hjt h ARG 198 CO 0.72 0.86 0.72 -1.12 -1.07 0.00 0.00 179.97 180.07 3hjt s SER 199 N -6.31 6.75 0.00 7.04 0.01 -1.26 -4.88 113.70 115.06 3hjt s SER 199 Ca -0.14 2.55 0.00 0.00 1.31 0.00 0.00 55.95 59.67 3hjt s SER 199 Cb 0.05 -2.61 0.00 0.00 0.21 0.00 0.00 66.02 63.67 3hjt s SER 199 CO 0.78 -0.64 0.45 0.29 0.41 0.00 0.00 173.24 174.53 3hjt n LYS 200 N 2.60 -0.09 -5.02 12.44 4.01 -1.26 -4.93 118.16 125.90 3hjt n LYS 200 Ca 0.07 -0.52 -0.32 0.00 -0.51 0.00 0.00 58.31 57.03 3hjt n LYS 200 Cb 0.41 -0.84 -0.15 0.00 -0.51 0.00 0.00 35.03 33.94 3hjt n LYS 200 CO 0.00 0.00 0.00 0.99 -1.11 0.00 0.00 177.40 177.28 3hjt s THR 201 N -0.15 2.63 0.04 -0.18 2.01 -1.26 0.13 115.64 118.86 3hjt s THR 201 Ca 0.00 -0.85 0.01 0.00 0.31 0.00 0.00 61.69 61.16 3hjt s THR 201 Cb 0.00 -2.03 -0.02 0.00 0.01 0.00 0.00 72.50 70.46 3hjt s THR 201 CO 0.00 0.56 -0.05 0.72 -0.69 0.00 0.00 174.62 175.16 3hjt s PHE 202 N -0.19 0.50 -0.22 4.92 -0.71 -0.24 -4.84 117.98 117.20 3hjt s PHE 202 Ca -0.01 -0.59 -0.01 0.00 -1.04 0.00 0.00 56.93 55.28 3hjt s PHE 202 Cb -0.13 -0.32 0.01 0.00 -1.21 0.00 0.00 43.02 41.37 3hjt s PHE 202 CO 0.03 -0.16 -0.11 0.08 -1.34 0.00 0.00 175.22 173.73 3hjt s VAL 203 N -1.78 2.72 0.23 -2.49 1.01 -1.26 -1.48 120.40 117.36 3hjt s VAL 203 Ca -0.10 -0.84 0.06 0.00 0.00 0.00 0.00 61.98 61.11 3hjt s VAL 203 Cb -0.07 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.01 3hjt s VAL 203 CO -0.01 0.39 0.20 0.42 0.00 0.00 0.00 175.10 176.09 3hjt s THR 204 N 1.36 4.54 0.22 3.92 -4.23 -0.30 -0.84 115.64 120.31 3hjt s THR 204 Ca 0.03 -1.30 -0.11 0.00 -1.18 0.00 0.00 61.69 59.13 3hjt s THR 204 Cb -0.15 -3.43 0.26 0.00 1.34 0.00 0.00 72.50 70.53 3hjt s THR 204 CO -0.07 -0.30 1.62 -0.61 -0.54 0.00 0.00 174.62 174.72 3hjt h GLN 205 N 1.64 0.03 -4.45 3.99 5.75 -1.34 -0.70 115.11 120.04 3hjt h GLN 205 Ca -0.49 -0.00 -0.23 0.00 -0.15 0.00 0.00 58.65 57.79 3hjt h GLN 205 Cb 1.23 -0.01 -0.14 0.00 1.07 0.00 0.00 27.48 29.64 3hjt h GLN 205 CO 0.61 0.02 -0.52 -3.38 -2.65 0.00 0.00 178.83 172.91 3hjt s HIS 206 N -6.20 1.07 -1.06 3.99 -3.43 -1.26 -1.17 115.29 107.23 3hjt s HIS 206 Ca -0.14 -1.29 -0.22 0.00 -0.80 0.00 0.00 55.06 52.61 3hjt s HIS 206 Cb 0.21 -0.44 -0.09 0.00 -1.43 0.00 0.00 32.58 30.82 3hjt s HIS 206 CO 0.74 -0.72 1.92 2.41 -2.00 0.00 0.00 174.74 177.10 3hjt n THR 207 N -0.31 2.14 -0.04 -5.38 -1.04 -0.32 -4.49 114.28 104.85 3hjt n THR 207 Ca 0.02 -2.10 0.00 0.00 -2.04 0.00 0.00 64.05 59.93 3hjt n THR 207 Cb 0.65 -2.26 0.00 0.00 -1.82 0.00 0.00 70.33 66.90 3hjt n THR 207 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3hjt n ALA 208 N 11.01 2.10 -1.62 2.41 0.00 -1.26 -4.39 120.51 128.77 3hjt n ALA 208 Ca 0.47 -0.25 -0.06 0.00 0.00 0.00 0.00 53.44 53.60 3hjt n ALA 208 Cb 0.44 0.00 0.16 0.00 0.00 0.00 0.00 19.45 20.05 3hjt n ALA 208 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3hjt n PHE 209 N -0.42 1.15 -0.21 0.00 3.01 -1.26 -4.76 117.46 114.96 3hjt n PHE 209 Ca 0.00 -1.77 -0.08 0.00 1.01 0.00 0.00 57.45 56.62 3hjt n PHE 209 Cb 0.01 -0.43 0.03 0.00 -0.01 0.00 0.00 39.48 39.08 3hjt n PHE 209 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 3hjt h SER 210 N 1.28 0.85 0.26 4.37 4.64 -1.86 -0.00 113.55 123.09 3hjt h SER 210 Ca 0.20 -0.19 -0.22 0.00 -0.47 0.00 0.00 61.79 61.10 3hjt h SER 210 Cb 1.37 -0.22 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 3hjt h SER 210 CO 0.39 0.82 -0.90 1.88 -0.87 0.00 0.00 176.83 178.15 3hjt h TYR 211 N 0.84 0.67 -0.22 4.77 0.05 -1.86 -1.62 116.97 119.61 3hjt h TYR 211 Ca 0.20 -0.35 -0.07 0.00 0.05 0.00 0.00 58.73 58.56 3hjt h TYR 211 Cb 0.25 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.91 3hjt h TYR 211 CO 0.02 1.16 -0.13 1.25 -1.05 0.00 0.00 178.16 179.40 3hjt h LEU 212 N 0.28 0.49 -1.02 3.88 6.46 -1.73 -1.29 115.31 122.38 3hjt h LEU 212 Ca -0.07 -0.43 -0.03 0.00 -0.12 0.00 0.00 57.88 57.23 3hjt h LEU 212 Cb 1.53 -0.14 -0.03 0.00 -0.73 0.00 0.00 40.66 41.29 3hjt h LEU 212 CO 0.16 0.81 0.34 0.00 -0.62 0.00 0.00 178.44 179.13 3hjt h ALA 213 N 0.69 1.23 0.10 1.25 0.00 -1.04 -2.80 119.26 118.69 3hjt h ALA 213 Ca 0.05 -0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3hjt h ALA 213 Cb 0.64 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.14 3hjt h ALA 213 CO 0.04 0.58 -0.05 -0.22 0.00 0.00 0.00 179.25 179.60 3hjt h LYS 214 N 1.03 -0.12 0.00 0.00 3.64 -1.11 0.38 116.57 120.39 3hjt h LYS 214 Ca 0.25 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.64 3hjt h LYS 214 Cb 0.12 0.03 0.00 0.00 -0.41 0.00 0.00 32.23 31.97 3hjt h LYS 214 CO -0.03 -0.05 0.00 -0.09 -2.27 0.00 0.00 179.45 177.01 3hjt h ARG 215 N -0.17 0.00 -0.19 1.90 2.43 -1.06 -2.99 114.38 114.30 3hjt h ARG 215 Ca -0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3hjt h ARG 215 Cb 0.13 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.68 3hjt h ARG 215 CO 0.02 0.00 0.00 1.19 -1.51 0.00 0.00 179.97 179.67 3hjt n PHE 216 N -2.55 0.46 -3.36 2.20 3.72 -1.07 -4.93 117.46 111.94 3hjt n PHE 216 Ca 0.01 -0.72 -0.19 0.00 -0.05 0.00 0.00 57.45 56.50 3hjt n PHE 216 Cb 0.22 -0.15 0.06 0.00 -0.94 0.00 0.00 39.48 38.67 3hjt n PHE 216 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hjt n GLY 217 N -0.36 -0.24 3.75 1.37 0.00 -0.93 -4.82 105.19 103.96 3hjt n GLY 217 Ca 0.14 0.06 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 3hjt n GLY 217 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hjt s LEU 218 N -6.00 3.01 -0.04 0.99 1.43 0.13 -4.92 118.68 113.27 3hjt s LEU 218 Ca 0.46 -1.16 0.04 0.00 -1.03 0.00 0.00 54.13 52.44 3hjt s LEU 218 Cb -0.20 -1.33 0.00 0.00 0.03 0.00 0.00 46.19 44.69 3hjt s LEU 218 CO 0.57 -0.61 -0.15 -0.54 0.23 0.00 0.00 176.35 175.85 3hjt s LYS 219 N -3.92 1.64 0.09 1.70 1.02 0.34 -4.33 119.74 116.27 3hjt s LYS 219 Ca 0.37 -0.52 0.07 0.00 0.02 0.00 0.00 55.97 55.91 3hjt s LYS 219 Cb 0.04 -1.42 -0.03 0.00 -0.52 0.00 0.00 37.83 35.90 3hjt s LYS 219 CO 0.21 0.18 -0.19 1.14 -0.92 0.00 0.00 175.35 175.77 3hjt s GLN 220 N 0.18 1.05 -0.05 1.68 1.03 -1.26 -1.08 119.66 121.22 3hjt s GLN 220 Ca -0.06 -1.07 -0.00 0.00 0.04 0.00 0.00 55.36 54.28 3hjt s GLN 220 Cb -0.12 -1.22 0.03 0.00 0.03 0.00 0.00 33.01 31.72 3hjt s GLN 220 CO 0.02 0.29 -0.02 -1.17 -2.54 0.00 0.00 175.29 171.87 3hjt s LEU 221 N -1.76 0.99 -0.03 2.60 2.96 -0.55 -4.97 118.68 117.92 3hjt s LEU 221 Ca 0.04 -0.09 -0.12 0.00 -0.22 0.00 0.00 54.13 53.75 3hjt s LEU 221 Cb -0.10 -0.39 -0.05 0.00 0.50 0.00 0.00 46.19 46.15 3hjt s LEU 221 CO 0.03 -0.12 0.32 -0.83 -1.32 0.00 0.00 176.35 174.43 3hjt s GLY 222 N 1.36 2.36 0.20 7.98 0.00 -1.26 -1.15 107.32 116.81 3hjt s GLY 222 Ca -0.04 -0.38 -0.07 0.00 0.00 0.00 0.00 44.72 44.23 3hjt s GLY 222 CO -0.02 -0.07 1.65 -2.22 0.00 0.00 0.00 173.10 172.44 3hjt h ILE 223 N 3.70 1.26 -1.96 0.90 2.04 -0.90 -3.44 117.51 119.12 3hjt h ILE 223 Ca -0.52 -1.20 -0.55 0.00 1.00 0.00 0.00 64.86 63.58 3hjt h ILE 223 Cb 1.22 0.94 -0.08 0.00 -0.74 0.00 0.00 36.82 38.16 3hjt h ILE 223 CO 0.61 0.42 -0.57 -0.44 0.00 0.00 0.00 178.15 178.18 3hjt s SER 224 N -6.65 4.65 0.00 1.72 0.01 -0.32 -4.05 113.70 109.06 3hjt s SER 224 Ca -0.11 -0.74 0.00 0.00 1.31 0.00 0.00 55.95 56.41 3hjt s SER 224 Cb 0.13 -0.76 0.00 0.00 0.21 0.00 0.00 66.02 65.60 3hjt s SER 224 CO 0.85 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.89 3hjt n GLY 225 N -1.08 -1.36 0.41 3.44 0.00 -0.03 -1.17 105.19 105.41 3hjt n GLY 225 Ca -0.04 -1.42 0.22 0.00 0.00 0.00 0.00 46.02 44.78 3hjt n GLY 225 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hjt h ILE 226 N -0.25 0.67 -3.79 -0.61 1.08 -1.90 -1.11 117.51 111.60 3hjt h ILE 226 Ca 0.00 -0.07 -0.68 0.00 -0.39 0.00 0.00 64.86 63.73 3hjt h ILE 226 Cb 0.00 0.46 -0.20 0.00 -3.07 0.00 0.00 36.82 34.02 3hjt h ILE 226 CO 0.00 0.03 -0.77 -0.55 -0.69 0.00 0.00 178.15 176.18 3hjt s SER 227 N -5.82 4.12 0.06 1.72 0.15 -1.26 -4.70 113.70 107.97 3hjt s SER 227 Ca -0.06 -0.35 0.12 0.00 0.70 0.00 0.00 55.95 56.36 3hjt s SER 227 Cb 0.21 -0.77 0.54 0.00 -1.71 0.00 0.00 66.02 64.29 3hjt s SER 227 CO 0.77 0.25 1.39 -2.65 1.20 0.00 0.00 173.24 174.19 3hjt n PRO 228 N 1.38 0.04 0.09 5.44 -0.02 -1.26 -1.75 135.00 138.91 3hjt n PRO 228 Ca -0.15 0.37 -0.04 0.00 -2.02 0.00 0.00 63.50 61.65 3hjt n PRO 228 Cb 0.52 -1.58 -0.04 0.00 -0.02 0.00 0.00 33.50 32.38 3hjt n PRO 228 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3hjt h GLU 229 N 0.00 0.00 -4.19 -0.52 5.08 -1.94 -3.38 114.58 109.63 3hjt h GLU 229 Ca 0.00 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.67 3hjt h GLU 229 Cb 0.18 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.43 3hjt h GLU 229 CO 0.00 0.84 2.81 1.04 -1.00 0.00 0.00 179.01 182.70 3hjt n GLN 230 N -3.39 2.32 -2.68 2.33 6.02 -0.72 -4.94 117.38 116.33 3hjt n GLN 230 Ca 0.00 -2.30 -0.34 0.00 -0.01 0.00 0.00 57.00 54.34 3hjt n GLN 230 Cb 0.85 -3.14 -0.05 0.00 1.02 0.00 0.00 30.24 28.91 3hjt n GLN 230 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 177.06 174.84 3hjt s GLU 231 N 3.90 4.12 0.58 -1.09 2.02 -1.26 -0.85 118.70 126.13 3hjt s GLU 231 Ca 0.51 1.30 -0.16 0.00 0.02 0.00 0.00 54.97 56.64 3hjt s GLU 231 Cb 0.14 -2.29 -0.04 0.00 0.10 0.00 0.00 34.13 32.03 3hjt s GLU 231 CO -0.01 -0.14 1.04 -1.25 0.02 0.00 0.00 175.26 174.92 3hjt s PRO 232 N -2.93 3.43 0.66 0.39 0.04 -1.26 -4.95 135.00 130.38 3hjt s PRO 232 Ca 0.61 1.16 -0.04 0.00 0.04 0.00 0.00 61.00 62.77 3hjt s PRO 232 Cb -0.15 -2.05 0.05 0.00 0.04 0.00 0.00 34.50 32.39 3hjt s PRO 232 CO 0.19 -0.71 0.95 -1.54 0.04 0.00 0.00 177.00 175.93 3hjt s SER 233 N -2.85 4.93 0.49 6.66 1.04 -1.26 -4.85 113.70 117.87 3hjt s SER 233 Ca 0.63 0.31 0.19 0.00 0.48 0.00 0.00 55.95 57.55 3hjt s SER 233 Cb -0.15 -1.02 1.23 0.00 0.10 0.00 0.00 66.02 66.19 3hjt s SER 233 CO 0.36 -1.47 2.04 -0.65 0.98 0.00 0.00 173.24 174.49 3hjt h PRO 234 N -0.41 0.14 0.11 4.02 0.11 -1.99 -0.33 132.00 133.65 3hjt h PRO 234 Ca -0.44 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.66 3hjt h PRO 234 Cb 1.31 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3hjt h PRO 234 CO 0.58 0.09 -0.05 -0.09 -0.21 0.00 0.00 178.00 178.31 3hjt h ARG 235 N 0.14 -0.14 0.00 1.05 2.43 -2.00 -2.51 114.38 113.34 3hjt h ARG 235 Ca 0.18 0.01 -0.06 0.00 -0.81 0.00 0.00 59.98 59.31 3hjt h ARG 235 Cb 0.54 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.12 3hjt h ARG 235 CO -0.02 0.01 -0.27 1.96 -1.51 0.00 0.00 179.97 180.14 3hjt h GLN 236 N -0.27 0.00 -0.73 0.20 4.20 -1.68 -1.89 115.11 114.93 3hjt h GLN 236 Ca -0.02 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 3hjt h GLN 236 Cb 0.22 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.97 3hjt h GLN 236 CO 0.03 0.27 0.29 -0.07 -0.67 0.00 0.00 178.83 178.67 3hjt h LEU 237 N 0.00 1.00 -0.41 1.46 3.38 -0.76 -0.53 115.31 119.45 3hjt h LEU 237 Ca -0.00 -0.15 -0.09 0.00 0.09 0.00 0.00 57.88 57.73 3hjt h LEU 237 Cb 0.58 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3hjt h LEU 237 CO 0.03 0.89 -0.08 0.11 0.09 0.00 0.00 178.44 179.48 3hjt h LYS 238 N 1.06 0.78 -0.72 1.13 1.57 -0.94 -1.14 116.57 118.31 3hjt h LYS 238 Ca 0.24 -0.29 -0.00 0.00 -1.87 0.00 0.00 60.65 58.73 3hjt h LYS 238 Cb 0.21 -0.05 -0.04 0.00 0.08 0.00 0.00 32.23 32.44 3hjt h LYS 238 CO -0.02 0.90 0.43 0.93 -0.57 0.00 0.00 179.45 181.12 3hjt h GLU 239 N 0.59 0.97 -0.40 3.15 5.08 -0.94 -0.83 114.58 122.21 3hjt h GLU 239 Ca 0.11 -0.08 -0.14 0.00 -1.00 0.00 0.00 59.36 58.24 3hjt h GLU 239 Cb 0.60 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 29.64 3hjt h GLU 239 CO 0.04 0.68 -0.30 0.82 -1.00 0.00 0.00 179.01 179.25 3hjt h ILE 240 N 0.99 1.28 -0.10 3.13 2.04 -0.75 -1.18 117.51 122.91 3hjt h ILE 240 Ca 0.26 -1.46 -0.08 0.00 1.00 0.00 0.00 64.86 64.57 3hjt h ILE 240 Cb -0.04 1.33 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 3hjt h ILE 240 CO -0.05 0.49 -0.32 1.56 0.00 0.00 0.00 178.15 179.83 3hjt h GLN 241 N 0.72 0.20 0.00 2.37 4.20 -0.73 -0.86 115.11 121.00 3hjt h GLN 241 Ca 0.08 -0.08 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 3hjt h GLN 241 Cb 0.88 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.63 3hjt h GLN 241 CO 0.08 0.50 -0.58 -0.44 -0.67 0.00 0.00 178.83 177.72 3hjt h ASP 242 N 0.18 0.00 -0.07 1.46 3.32 -0.92 -2.33 116.42 118.05 3hjt h ASP 242 Ca 0.02 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 3hjt h ASP 242 Cb 0.66 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.21 3hjt h ASP 242 CO 0.05 0.58 -0.12 0.15 -1.72 0.00 0.00 179.24 178.18 3hjt h PHE 243 N 0.00 0.26 -0.57 4.55 3.04 -0.68 -0.64 116.94 122.89 3hjt h PHE 243 Ca -0.01 -0.09 0.04 0.00 3.98 0.00 0.00 57.97 61.90 3hjt h PHE 243 Cb 1.10 -0.05 -0.03 0.00 2.56 0.00 0.00 35.95 39.53 3hjt h PHE 243 CO 0.00 0.71 0.38 0.28 -2.02 0.00 0.00 178.31 177.66 3hjt h VAL 244 N -0.26 1.04 0.04 1.41 2.07 -1.07 -1.14 116.25 118.34 3hjt h VAL 244 Ca 0.01 -0.21 -0.11 0.00 0.82 0.00 0.00 66.70 67.20 3hjt h VAL 244 Cb 0.68 0.37 0.01 0.00 -1.52 0.00 0.00 31.29 30.83 3hjt h VAL 244 CO 0.03 0.11 -0.46 0.11 0.02 0.00 0.00 177.57 177.38 3hjt h LYS 245 N 0.62 0.23 0.70 1.57 1.57 -1.38 0.54 116.57 120.43 3hjt h LYS 245 Ca 0.24 -0.31 -0.03 0.00 -1.87 0.00 0.00 60.65 58.68 3hjt h LYS 245 Cb 0.17 0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 3hjt h LYS 245 CO -0.07 1.07 -0.45 1.49 -0.57 0.00 0.00 179.45 180.92 3hjt h GLU 246 N -0.46 -1.05 0.00 3.15 4.81 -0.83 -2.23 114.58 117.98 3hjt h GLU 246 Ca -0.07 0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3hjt h GLU 246 Cb 1.27 0.24 0.00 0.00 0.63 0.00 0.00 28.75 30.89 3hjt h GLU 246 CO 0.09 -0.70 0.00 0.66 -0.73 0.00 0.00 179.01 178.33 3hjt n TYR 247 N -5.58 0.00 -3.67 0.92 4.01 -0.46 -4.91 117.16 107.47 3hjt n TYR 247 Ca -0.14 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.36 3hjt n TYR 247 Cb 0.47 0.00 0.06 0.00 -0.31 0.00 0.00 39.34 39.56 3hjt n TYR 247 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 3hjt n ASN 248 N -0.99 -4.59 -4.76 7.72 5.15 -0.84 -4.93 115.26 112.01 3hjt n ASN 248 Ca 0.22 -0.65 -0.41 0.00 -0.60 0.00 0.00 54.58 53.14 3hjt n ASN 248 Cb 0.10 -4.61 -0.03 0.00 -0.53 0.00 0.00 39.78 34.72 3hjt n ASN 248 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 3hjt s VAL 249 N -3.36 2.90 0.00 3.44 1.01 0.18 -4.93 120.40 119.63 3hjt s VAL 249 Ca 0.44 0.85 0.00 0.00 0.00 0.00 0.00 61.98 63.27 3hjt s VAL 249 Cb -0.21 -3.54 0.00 0.00 0.00 0.00 0.00 36.38 32.63 3hjt s VAL 249 CO 0.77 0.18 0.77 0.29 0.00 0.00 0.00 175.10 177.11 3hjt n LYS 250 N 1.32 1.18 -3.73 2.72 4.76 -1.26 -4.77 118.16 118.38 3hjt n LYS 250 Ca 0.02 -1.05 -0.16 0.00 -2.87 0.00 0.00 58.31 54.25 3hjt n LYS 250 Cb 0.42 -1.00 -0.16 0.00 -1.84 0.00 0.00 35.03 32.45 3hjt n LYS 250 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3hjt s THR 251 N -0.55 -0.09 -0.29 -0.18 2.01 -1.26 -2.04 115.64 113.25 3hjt s THR 251 Ca 0.00 0.26 -0.06 0.00 0.31 0.00 0.00 61.69 62.21 3hjt s THR 251 Cb 0.00 -0.16 0.01 0.00 0.01 0.00 0.00 72.50 72.36 3hjt s THR 251 CO 0.00 0.11 0.05 -0.63 -0.69 0.00 0.00 174.62 173.46 3hjt s ILE 252 N 1.45 3.76 -0.69 1.82 1.01 -0.57 -4.04 121.20 123.94 3hjt s ILE 252 Ca -0.05 -0.77 -0.25 0.00 0.00 0.00 0.00 60.65 59.59 3hjt s ILE 252 Cb -0.12 -2.94 0.05 0.00 0.01 0.00 0.00 42.46 39.46 3hjt s ILE 252 CO -0.04 0.09 1.10 -0.36 0.00 0.00 0.00 174.94 175.73 3hjt s PHE 253 N 1.46 2.50 1.02 3.97 0.08 -0.02 -2.14 117.98 124.86 3hjt s PHE 253 Ca 0.02 -0.33 -0.16 0.00 0.12 0.00 0.00 56.93 56.58 3hjt s PHE 253 Cb -0.17 -4.44 0.21 0.00 -0.57 0.00 0.00 43.02 38.05 3hjt s PHE 253 CO 0.01 -1.83 1.24 0.00 -0.10 0.00 0.00 175.22 174.53 3hjt s ALA 254 N 4.79 1.74 0.02 5.36 0.00 0.17 -0.94 121.76 132.90 3hjt s ALA 254 Ca 0.28 -1.04 -0.03 0.00 0.00 0.00 0.00 51.96 51.17 3hjt s ALA 254 Cb -0.13 -2.84 -0.02 0.00 0.00 0.00 0.00 23.12 20.13 3hjt s ALA 254 CO 0.12 -2.73 0.03 -1.83 0.00 0.00 0.00 175.76 171.35 3hjt s GLU 255 N -5.68 0.41 0.25 0.00 -1.05 -1.26 -1.55 118.70 109.82 3hjt s GLU 255 Ca 0.72 -0.63 -0.05 0.00 -0.15 0.00 0.00 54.97 54.85 3hjt s GLU 255 Cb -0.07 0.16 0.29 0.00 -0.44 0.00 0.00 34.13 34.07 3hjt s GLU 255 CO 0.54 -0.08 1.92 -0.44 0.95 0.00 0.00 175.26 178.14 3hjt h ASP 256 N 4.30 1.11 0.04 0.83 3.32 -1.98 -2.84 116.42 121.20 3hjt h ASP 256 Ca -0.32 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 56.71 3hjt h ASP 256 Cb 1.20 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.48 3hjt h ASP 256 CO 0.44 0.78 0.00 0.59 -1.72 0.00 0.00 179.24 179.34 3hjt n ASN 257 N -4.42 0.25 -3.85 6.45 3.02 -1.26 -4.73 115.26 110.73 3hjt n ASN 257 Ca 0.13 0.61 -0.12 0.00 -0.03 0.00 0.00 54.58 55.17 3hjt n ASN 257 Cb 0.05 -0.65 -0.11 0.00 -0.61 0.00 0.00 39.78 38.47 3hjt n ASN 257 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3hjt s VAL 258 N -3.24 0.05 -0.15 2.41 0.11 -1.07 -4.85 120.40 113.65 3hjt s VAL 258 Ca -0.01 -0.42 -0.37 0.00 -2.93 0.00 0.00 61.98 58.25 3hjt s VAL 258 Cb 0.03 -0.35 -0.14 0.00 -1.53 0.00 0.00 36.38 34.39 3hjt s VAL 258 CO 0.10 -0.23 1.79 -3.20 -3.33 0.00 0.00 175.10 170.23 3hjt n ASN 259 N 2.05 2.91 -0.27 3.54 2.85 -1.26 -4.49 115.26 120.59 3hjt n ASN 259 Ca -0.19 1.03 0.06 0.00 -0.11 0.00 0.00 54.58 55.37 3hjt n ASN 259 Cb 0.57 -1.27 0.29 0.00 1.24 0.00 0.00 39.78 40.61 3hjt n ASN 259 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3hjt n PRO 260 N 5.80 1.34 -0.02 1.20 -0.04 -1.26 -4.27 135.00 137.75 3hjt n PRO 260 Ca 0.24 -0.52 -0.12 0.00 -0.04 0.00 0.00 63.50 63.06 3hjt n PRO 260 Cb 0.22 -1.24 -0.06 0.00 -0.04 0.00 0.00 33.50 32.38 3hjt n PRO 260 CO 0.00 0.00 0.00 -0.22 -0.04 0.00 0.00 175.50 175.24 3hjt h LYS 261 N 0.95 -0.45 -0.49 0.54 3.64 -1.99 0.86 116.57 119.64 3hjt h LYS 261 Ca 0.00 0.03 -0.08 0.00 -1.27 0.00 0.00 60.65 59.33 3hjt h LYS 261 Cb 0.21 0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 32.12 3hjt h LYS 261 CO 0.00 -0.30 -0.04 0.97 -2.27 0.00 0.00 179.45 177.81 3hjt h ILE 262 N -0.47 1.25 -0.70 2.00 2.10 -2.00 -1.29 117.51 118.40 3hjt h ILE 262 Ca 0.08 -1.09 0.05 0.00 1.08 0.00 0.00 64.86 64.99 3hjt h ILE 262 Cb 0.62 0.92 -0.05 0.00 -1.09 0.00 0.00 36.82 37.21 3hjt h ILE 262 CO -0.43 0.38 0.41 0.00 -1.08 0.00 0.00 178.15 177.44 3hjt h ALA 263 N 1.18 0.93 -0.16 0.18 0.00 -1.39 -2.03 119.26 117.98 3hjt h ALA 263 Ca 0.14 -0.00 -0.12 0.00 0.00 0.00 0.00 54.91 54.93 3hjt h ALA 263 Cb 0.52 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3hjt h ALA 263 CO 0.03 0.13 -0.43 0.45 0.00 0.00 0.00 179.25 179.43 3hjt h HIS 264 N 0.78 0.44 -0.16 0.00 3.86 0.12 -2.50 115.15 117.67 3hjt h HIS 264 Ca 0.30 -0.13 -0.01 0.00 -1.16 0.00 0.00 60.37 59.37 3hjt h HIS 264 Cb 0.13 -0.09 -0.01 0.00 1.06 0.00 0.00 27.41 28.50 3hjt h HIS 264 CO -0.06 0.74 0.07 0.00 0.86 0.00 0.00 177.93 179.54 3hjt h ALA 265 N 1.24 0.21 -0.93 2.45 0.00 -0.58 -0.18 119.26 121.48 3hjt h ALA 265 Ca 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3hjt h ALA 265 Cb 0.88 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.57 3hjt h ALA 265 CO 0.07 -0.20 0.54 0.82 0.00 0.00 0.00 179.25 180.48 3hjt h ILE 266 N 0.11 1.26 -0.19 0.00 2.04 -1.38 -1.39 117.51 117.96 3hjt h ILE 266 Ca 0.05 -0.60 0.00 0.00 1.00 0.00 0.00 64.86 65.31 3hjt h ILE 266 Cb 0.17 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.21 3hjt h ILE 266 CO -0.00 0.28 0.12 0.00 0.00 0.00 0.00 178.15 178.55 3hjt h ALA 267 N 1.30 0.24 -0.77 1.87 0.00 -1.10 -0.31 119.26 120.48 3hjt h ALA 267 Ca 0.33 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 55.19 3hjt h ALA 267 Cb -0.02 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3hjt h ALA 267 CO -0.06 -0.28 0.35 0.87 0.00 0.00 0.00 179.25 180.14 3hjt h LYS 268 N 0.25 1.13 0.00 0.00 1.57 -0.48 -0.27 116.57 118.77 3hjt h LYS 268 Ca 0.07 -0.18 0.00 0.00 -1.87 0.00 0.00 60.65 58.67 3hjt h LYS 268 Cb -0.03 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 32.09 3hjt h LYS 268 CO -0.01 0.89 0.00 0.66 -0.57 0.00 0.00 179.45 180.42 3hjt h SER 269 N 1.10 0.00 -0.23 0.86 4.64 -1.08 -3.27 113.55 115.58 3hjt h SER 269 Ca 0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.58 3hjt h SER 269 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3hjt h SER 269 CO -0.03 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.28 3hjt n THR 270 N -3.04 0.62 -2.97 2.95 -2.24 -0.14 -5.00 114.28 104.45 3hjt n THR 270 Ca 0.04 -0.81 -0.14 0.00 -2.27 0.00 0.00 64.05 60.87 3hjt n THR 270 Cb 0.49 0.78 0.04 0.00 -2.10 0.00 0.00 70.33 69.54 3hjt n THR 270 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hjt n GLY 271 N 0.58 0.04 3.61 3.38 0.00 -0.61 -4.87 105.19 107.32 3hjt n GLY 271 Ca 0.10 -0.18 -0.27 0.00 0.00 0.00 0.00 46.02 45.66 3hjt n GLY 271 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hjt s ALA 272 N -3.08 3.14 0.17 4.61 0.00 -0.21 -4.94 121.76 121.46 3hjt s ALA 272 Ca 0.28 -2.26 0.07 0.00 0.00 0.00 0.00 51.96 50.05 3hjt s ALA 272 Cb -0.12 0.11 -0.04 0.00 0.00 0.00 0.00 23.12 23.06 3hjt s ALA 272 CO 0.34 -0.08 0.01 0.15 0.00 0.00 0.00 175.76 176.18 3hjt s LYS 273 N -3.70 2.43 -0.09 0.00 1.02 -0.87 -4.38 119.74 114.15 3hjt s LYS 273 Ca 0.35 -1.10 -0.10 0.00 0.02 0.00 0.00 55.97 55.14 3hjt s LYS 273 Cb 0.08 -2.37 -0.05 0.00 -0.52 0.00 0.00 37.83 34.98 3hjt s LYS 273 CO 0.18 0.46 0.23 0.08 -0.92 0.00 0.00 175.35 175.37 3hjt s VAL 274 N -1.73 5.35 0.28 3.17 1.01 -1.26 -1.51 120.40 125.71 3hjt s VAL 274 Ca 0.28 0.41 0.03 0.00 0.00 0.00 0.00 61.98 62.70 3hjt s VAL 274 Cb -0.09 -3.51 -0.04 0.00 0.00 0.00 0.00 36.38 32.74 3hjt s VAL 274 CO 0.19 0.59 0.20 -0.54 0.00 0.00 0.00 175.10 175.53 3hjt s LYS 275 N -0.89 1.52 -0.17 2.72 -0.14 -0.91 -4.95 119.74 116.92 3hjt s LYS 275 Ca 0.17 -1.85 -0.02 0.00 -1.36 0.00 0.00 55.97 52.91 3hjt s LYS 275 Cb -0.13 0.21 -0.01 0.00 -1.68 0.00 0.00 37.83 36.21 3hjt s LYS 275 CO 0.06 -0.51 -0.08 0.99 -0.76 0.00 0.00 175.35 175.05 3hjt s THR 276 N -3.74 3.30 -0.21 2.17 2.01 -1.26 0.45 115.64 118.36 3hjt s THR 276 Ca 0.39 -0.55 -0.00 0.00 0.31 0.00 0.00 61.69 61.84 3hjt s THR 276 Cb 0.05 -2.45 0.06 0.00 0.01 0.00 0.00 72.50 70.17 3hjt s THR 276 CO 0.20 0.48 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.36 3hjt s LEU 277 N 0.81 1.99 -0.09 4.42 1.98 -0.60 -4.93 118.68 122.27 3hjt s LEU 277 Ca -0.03 -0.97 -0.21 0.00 -2.89 0.00 0.00 54.13 50.04 3hjt s LEU 277 Cb -0.15 -0.97 -0.04 0.00 0.66 0.00 0.00 46.19 45.69 3hjt s LEU 277 CO 0.01 -0.24 0.61 -0.55 -1.89 0.00 0.00 176.35 174.29 3hjt s SER 278 N 1.57 6.85 -0.04 3.68 0.15 -1.26 -4.51 113.70 120.13 3hjt s SER 278 Ca -0.03 1.02 0.05 0.00 0.70 0.00 0.00 55.95 57.70 3hjt s SER 278 Cb -0.18 -2.36 0.23 0.00 -1.71 0.00 0.00 66.02 62.01 3hjt s SER 278 CO -0.07 -0.07 1.00 -0.81 1.20 0.00 0.00 173.24 174.49 3hjt n PRO 279 N 3.77 1.93 -3.07 5.44 -0.04 -1.26 -4.88 135.00 136.89 3hjt n PRO 279 Ca -0.04 -0.92 -0.21 0.00 -0.04 0.00 0.00 63.50 62.30 3hjt n PRO 279 Cb 0.51 -1.51 0.01 0.00 -0.04 0.00 0.00 33.50 32.47 3hjt n PRO 279 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 3hjt n LEU 280 N 0.18 -1.78 -0.05 1.53 4.77 -1.26 -4.86 117.00 115.53 3hjt n LEU 280 Ca 0.08 -0.24 0.12 0.00 -0.03 0.00 0.00 56.01 55.94 3hjt n LEU 280 Cb 0.40 -2.37 0.26 0.00 -2.33 0.00 0.00 43.42 39.38 3hjt n LEU 280 CO 0.08 0.11 0.47 -0.62 -1.33 0.00 0.00 177.39 176.10 3hjt n GLU 281 N -3.61 0.16 -4.49 3.23 1.02 -1.26 -4.03 120.64 111.65 3hjt n GLU 281 Ca -0.07 -0.10 -0.22 0.00 -0.02 0.00 0.00 57.16 56.76 3hjt n GLU 281 Cb 0.58 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.36 3hjt n GLU 281 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3hjt s ALA 282 N -2.91 1.27 -0.15 0.62 0.00 -1.26 -4.49 121.76 114.85 3hjt s ALA 282 Ca 0.13 -0.80 -0.33 0.00 0.00 0.00 0.00 51.96 50.96 3hjt s ALA 282 Cb 0.18 -0.24 -0.11 0.00 0.00 0.00 0.00 23.12 22.95 3hjt s ALA 282 CO 0.67 0.27 1.99 0.00 0.00 0.00 0.00 175.76 178.69 3hjt n ALA 283 N 2.14 1.06 -1.76 0.00 0.00 0.50 -4.91 120.51 117.53 3hjt n ALA 283 Ca -0.17 0.14 -0.38 0.00 0.00 0.00 0.00 53.44 53.04 3hjt n ALA 283 Cb 0.55 -2.58 0.01 0.00 0.00 0.00 0.00 19.45 17.43 3hjt n ALA 283 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 3hjt s PRO 284 N 4.80 3.58 0.43 0.00 0.02 -1.26 -4.98 135.00 137.59 3hjt s PRO 284 Ca 0.97 1.94 -0.24 0.00 0.02 0.00 0.00 61.00 63.68 3hjt s PRO 284 Cb -0.66 -2.38 -0.08 0.00 0.02 0.00 0.00 34.50 31.40 3hjt s PRO 284 CO 0.49 -0.74 1.21 -1.54 -0.33 0.00 0.00 177.00 176.09 3hjt s SER 285 N -1.20 6.28 0.00 2.53 1.04 -1.26 -4.82 113.70 116.27 3hjt s SER 285 Ca 0.66 2.44 0.00 0.00 0.48 0.00 0.00 55.95 59.53 3hjt s SER 285 Cb -0.33 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.17 3hjt s SER 285 CO 0.39 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.37 3hjt n GLY 286 N 0.60 -0.11 2.73 7.32 0.00 -1.26 -4.81 105.19 109.66 3hjt n GLY 286 Ca 0.05 -1.78 -0.34 0.00 0.00 0.00 0.00 46.02 43.96 3hjt n GLY 286 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3hjt n ASN 287 N -1.10 5.30 -4.98 1.61 0.23 -1.26 -5.04 115.26 110.02 3hjt n ASN 287 Ca 0.00 -3.54 -0.20 0.00 -0.53 0.00 0.00 54.58 50.30 3hjt n ASN 287 Cb 0.00 -0.89 0.01 0.00 -2.08 0.00 0.00 39.78 36.82 3hjt n ASN 287 CO 0.00 0.00 0.00 -0.54 -0.93 0.00 0.00 177.26 175.79 3hjt s LYS 288 N -3.16 2.99 0.64 -3.83 1.02 -1.26 -5.10 119.74 111.04 3hjt s LYS 288 Ca 0.40 -0.82 -0.12 0.00 0.02 0.00 0.00 55.97 55.44 3hjt s LYS 288 Cb 0.16 -2.68 -0.02 0.00 -0.52 0.00 0.00 37.83 34.78 3hjt s LYS 288 CO -0.03 -0.20 1.05 0.99 -0.92 0.00 0.00 175.35 176.23 3hjt s THR 289 N -2.41 4.19 0.16 2.17 2.01 -1.26 -4.85 115.64 115.65 3hjt s THR 289 Ca 0.49 0.80 -0.20 0.00 0.31 0.00 0.00 61.69 63.09 3hjt s THR 289 Cb -0.10 -3.53 0.08 0.00 0.01 0.00 0.00 72.50 68.95 3hjt s THR 289 CO 0.35 -0.85 1.64 0.22 -0.69 0.00 0.00 174.62 175.29 3hjt h TYR 290 N -0.27 -0.47 0.00 4.92 3.20 -1.99 -1.29 116.97 121.08 3hjt h TYR 290 Ca -0.45 0.04 -0.05 0.00 3.14 0.00 0.00 58.73 61.42 3hjt h TYR 290 Cb 1.20 0.26 -0.01 0.00 1.54 0.00 0.00 36.73 39.73 3hjt h TYR 290 CO 0.62 -0.26 -0.22 -0.07 -1.64 0.00 0.00 178.16 176.59 3hjt h LEU 291 N -0.13 0.00 -0.37 2.82 3.38 -1.98 -1.66 115.31 117.37 3hjt h LEU 291 Ca 0.18 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.99 3hjt h LEU 291 Cb 0.40 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.13 3hjt h LEU 291 CO -0.43 0.22 -0.75 -0.33 0.09 0.00 0.00 178.44 177.24 3hjt h GLU 292 N 0.00 0.00 -0.07 1.13 5.08 -1.64 0.93 114.58 120.01 3hjt h GLU 292 Ca -0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 3hjt h GLU 292 Cb 0.52 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.77 3hjt h GLU 292 CO 0.03 0.75 -0.43 -0.91 -1.00 0.00 0.00 179.01 177.45 3hjt h ASN 293 N 0.00 0.49 -0.69 1.42 2.35 -0.94 -0.61 115.58 117.60 3hjt h ASN 293 Ca -0.01 -0.67 -0.04 0.00 -0.55 0.00 0.00 56.30 55.04 3hjt h ASN 293 Cb 1.40 -0.15 -0.03 0.00 0.05 0.00 0.00 38.32 39.59 3hjt h ASN 293 CO 0.10 1.08 0.29 0.25 -1.65 0.00 0.00 177.43 177.50 3hjt h LEU 294 N -0.06 0.95 -0.48 1.61 5.85 -1.27 -2.17 115.31 119.74 3hjt h LEU 294 Ca -0.03 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.53 3hjt h LEU 294 Cb 1.09 -0.25 -0.02 0.00 0.37 0.00 0.00 40.66 41.85 3hjt h LEU 294 CO 0.09 0.84 0.20 -0.09 -0.34 0.00 0.00 178.44 179.14 3hjt h ARG 295 N 1.02 0.71 -0.50 1.25 2.43 -0.73 -1.22 114.38 117.34 3hjt h ARG 295 Ca 0.24 -0.12 0.09 0.00 -0.81 0.00 0.00 59.98 59.38 3hjt h ARG 295 Cb 0.18 -0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 29.53 3hjt h ARG 295 CO -0.02 0.63 0.05 0.00 -1.51 0.00 0.00 179.97 179.12 3hjt h ALA 296 N 1.05 0.52 -0.02 2.80 0.00 -0.48 -1.12 119.26 122.00 3hjt h ALA 296 Ca 0.16 0.13 -0.12 0.00 0.00 0.00 0.00 54.91 55.08 3hjt h ALA 296 Cb 0.18 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3hjt h ALA 296 CO -0.01 -0.35 -0.55 -0.91 0.00 0.00 0.00 179.25 177.43 3hjt h ASN 297 N 0.17 0.05 0.07 0.00 2.35 -1.16 -2.47 115.58 114.60 3hjt h ASN 297 Ca 0.25 -0.03 -0.05 0.00 -0.55 0.00 0.00 56.30 55.93 3hjt h ASN 297 Cb 0.36 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 3hjt h ASN 297 CO -0.37 0.59 -0.15 -0.07 -1.65 0.00 0.00 177.43 175.77 3hjt h LEU 298 N 0.03 0.16 -0.16 1.61 4.07 -0.06 -1.46 115.31 119.52 3hjt h LEU 298 Ca -0.00 -0.03 -0.12 0.00 0.08 0.00 0.00 57.88 57.80 3hjt h LEU 298 Cb 0.98 -0.04 0.00 0.00 1.08 0.00 0.00 40.66 42.68 3hjt h LEU 298 CO 0.07 0.34 -0.39 -0.33 -1.08 0.00 0.00 178.44 177.05 3hjt h GLU 299 N 0.17 0.54 -0.15 1.13 4.39 -0.84 -0.24 114.58 119.59 3hjt h GLU 299 Ca 0.03 -0.37 -0.01 0.00 0.34 0.00 0.00 59.36 59.35 3hjt h GLU 299 Cb 0.37 0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.07 3hjt h GLU 299 CO 0.02 0.99 0.07 -0.39 -1.16 0.00 0.00 179.01 178.54 3hjt h VAL 300 N 0.18 1.14 -0.14 3.13 -1.51 -1.17 0.19 116.25 118.07 3hjt h VAL 300 Ca -0.00 -0.41 0.03 0.00 -1.23 0.00 0.00 66.70 65.09 3hjt h VAL 300 Cb 1.00 1.14 -0.03 0.00 -2.13 0.00 0.00 31.29 31.26 3hjt h VAL 300 CO 0.08 0.13 -0.07 0.25 -1.23 0.00 0.00 177.57 176.73 3hjt h LEU 301 N 0.10 -0.23 0.29 4.19 5.85 -1.29 0.73 115.31 124.95 3hjt h LEU 301 Ca 0.05 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.83 3hjt h LEU 301 Cb 0.15 0.13 -0.03 0.00 0.37 0.00 0.00 40.66 41.28 3hjt h LEU 301 CO -0.01 -0.09 -0.35 0.22 -0.34 0.00 0.00 178.44 177.87 3hjt h TYR 302 N -0.06 -0.94 -0.73 1.25 3.20 -0.81 0.35 116.97 119.23 3hjt h TYR 302 Ca 0.08 0.01 0.09 0.00 3.14 0.00 0.00 58.73 62.05 3hjt h TYR 302 Cb 0.17 0.37 -0.05 0.00 1.54 0.00 0.00 36.73 38.77 3hjt h TYR 302 CO -0.20 -0.48 0.48 1.96 -1.64 0.00 0.00 178.16 178.28 3hjt h GLN 303 N -0.68 0.62 0.30 1.82 1.08 -0.41 -1.81 115.11 116.03 3hjt h GLN 303 Ca -0.01 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.14 3hjt h GLN 303 Cb 0.64 -0.14 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 3hjt h GLN 303 CO -0.10 0.41 -0.15 1.96 -0.95 0.00 0.00 178.83 180.01 3hjt h GLN 304 N 0.64 -0.39 0.00 1.46 1.08 -0.37 -2.95 115.11 114.57 3hjt h GLN 304 Ca 0.33 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.56 3hjt h GLN 304 Cb 0.46 0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.97 3hjt h GLN 304 CO -0.12 -0.06 0.02 1.28 -0.95 0.00 0.00 178.83 179.01 3hjt n LEU 305 N -5.08 0.27 -0.39 1.46 4.77 0.07 -5.04 117.00 113.07 3hjt n LEU 305 Ca -0.09 0.62 0.14 0.00 -0.03 0.00 0.00 56.01 56.65 3hjt n LEU 305 Cb 0.26 -0.65 0.60 0.00 -2.33 0.00 0.00 43.42 41.31 3hjt n LEU 305 CO 0.26 -0.71 0.91 1.17 -1.33 0.00 0.00 177.39 177.70