#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hjt n GLY 32 N 0.00 1.26 3.77 1.69 0.00 -1.26 -4.79 105.19 105.86 3hjt n GLY 32 Ca 0.00 -1.62 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 3hjt n GLY 32 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 3hjt s MET 33 N -4.27 4.15 -0.05 1.61 0.23 -1.26 -4.71 119.30 114.99 3hjt s MET 33 Ca 0.00 1.73 -0.30 0.00 -1.03 0.00 0.00 55.69 56.10 3hjt s MET 33 Cb 0.00 -2.69 -0.02 0.00 -1.53 0.00 0.00 34.83 30.58 3hjt s MET 33 CO 0.00 -0.20 1.02 -1.12 -2.03 0.00 0.00 175.02 172.68 3hjt s SER 34 N -1.24 7.28 0.08 -1.18 0.01 -1.26 -2.79 113.70 114.59 3hjt s SER 34 Ca 0.56 1.62 0.08 0.00 1.31 0.00 0.00 55.95 59.52 3hjt s SER 34 Cb -0.28 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.35 3hjt s SER 34 CO 0.35 -0.38 -0.19 -0.69 0.41 0.00 0.00 173.24 172.75 3hjt s VAL 35 N 1.58 2.77 -0.01 3.43 1.01 -0.17 -1.17 120.40 127.85 3hjt s VAL 35 Ca 0.51 -1.36 0.01 0.00 0.00 0.00 0.00 61.98 61.14 3hjt s VAL 35 Cb -0.20 -2.21 0.01 0.00 0.00 0.00 0.00 36.38 33.97 3hjt s VAL 35 CO 0.23 0.22 -0.02 -0.69 0.00 0.00 0.00 175.10 174.84 3hjt s VAL 36 N -1.02 0.17 0.17 2.92 1.01 -0.16 -2.43 120.40 121.07 3hjt s VAL 36 Ca 0.16 -0.05 0.08 0.00 0.00 0.00 0.00 61.98 62.17 3hjt s VAL 36 Cb -0.10 -0.18 -0.04 0.00 0.00 0.00 0.00 36.38 36.05 3hjt s VAL 36 CO 0.07 0.07 -0.18 0.42 0.00 0.00 0.00 175.10 175.49 3hjt s THR 37 N 0.20 1.82 0.00 3.92 -4.23 -0.11 -0.13 115.64 117.11 3hjt s THR 37 Ca -0.02 -1.98 -0.07 0.00 -1.18 0.00 0.00 61.69 58.45 3hjt s THR 37 Cb -0.04 -1.89 -0.04 0.00 1.34 0.00 0.00 72.50 71.88 3hjt s THR 37 CO -0.01 -0.37 0.72 0.77 -0.54 0.00 0.00 174.62 175.20 3hjt h SER 38 N 3.10 -0.20 -2.00 3.99 4.64 -1.66 -0.45 113.55 120.98 3hjt h SER 38 Ca -0.41 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 3hjt h SER 38 Cb 1.21 0.05 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 3hjt h SER 38 CO 0.53 -0.09 0.00 2.22 -0.87 0.00 0.00 176.83 178.62 3hjt n PHE 39 N -2.92 0.00 -0.05 4.77 -1.74 -1.26 -1.29 117.46 114.97 3hjt n PHE 39 Ca -0.03 0.00 -0.08 0.00 -0.56 0.00 0.00 57.45 56.78 3hjt n PHE 39 Cb 0.09 0.00 -0.02 0.00 1.52 0.00 0.00 39.48 41.07 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 0.89 -0.68 -0.18 2.97 3.20 -1.77 -1.85 116.97 119.54 3hjt h TYR 40 Ca 0.00 0.04 0.05 0.00 3.14 0.00 0.00 58.73 61.96 3hjt h TYR 40 Cb 0.00 0.34 -0.01 0.00 1.54 0.00 0.00 36.73 38.60 3hjt h TYR 40 CO 0.00 -0.33 0.17 -1.35 -1.64 0.00 0.00 178.16 175.01 3hjt h PRO 41 N -0.26 0.00 0.19 1.82 0.11 -1.91 -0.33 132.00 131.62 3hjt h PRO 41 Ca 0.14 0.00 -0.29 0.00 0.11 0.00 0.00 66.00 65.96 3hjt h PRO 41 Cb 0.47 0.00 0.02 0.00 0.11 0.00 0.00 31.00 31.60 3hjt h PRO 41 CO -0.40 0.00 -1.32 0.52 -0.21 0.00 0.00 178.00 176.59 3hjt h MET 42 N 0.00 0.39 0.21 1.05 2.86 -1.84 -2.89 114.93 114.71 3hjt h MET 42 Ca 0.09 -0.67 -0.00 0.00 -2.06 0.00 0.00 59.70 57.05 3hjt h MET 42 Cb 0.42 0.25 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 3hjt h MET 42 CO -0.00 1.32 -0.17 -0.92 1.06 0.00 0.00 176.91 178.20 3hjt h TYR 43 N -0.09 -0.44 0.13 -0.22 3.20 -0.81 -1.73 116.97 117.01 3hjt h TYR 43 Ca -0.25 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 61.64 3hjt h TYR 43 Cb 1.93 0.17 -0.03 0.00 1.54 0.00 0.00 36.73 40.34 3hjt h TYR 43 CO 0.14 -0.26 -0.26 0.00 -1.64 0.00 0.00 178.16 176.15 3hjt h ALA 44 N 0.37 -0.45 0.45 1.82 0.00 -1.20 -0.81 119.26 119.43 3hjt h ALA 44 Ca -0.01 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 3hjt h ALA 44 Cb 0.35 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 3hjt h ALA 44 CO -0.02 -0.80 -0.29 0.52 0.00 0.00 0.00 179.25 178.66 3hjt h MET 45 N -0.48 -0.68 -0.44 0.00 2.86 -1.45 0.03 114.93 114.76 3hjt h MET 45 Ca 0.03 0.05 -0.04 0.00 -2.06 0.00 0.00 59.70 57.68 3hjt h MET 45 Cb 0.50 0.16 -0.02 0.00 0.06 0.00 0.00 31.60 32.29 3hjt h MET 45 CO -0.14 -0.46 0.12 1.79 1.06 0.00 0.00 176.91 179.29 3hjt h THR 46 N -0.71 1.19 -0.17 2.22 1.35 -1.32 -1.87 112.91 113.59 3hjt h THR 46 Ca -0.05 -0.66 -0.03 0.00 -0.55 0.00 0.00 66.41 65.13 3hjt h THR 46 Cb 0.59 0.72 -0.01 0.00 -1.73 0.00 0.00 68.15 67.72 3hjt h THR 46 CO 0.04 0.24 -0.01 0.50 -0.25 0.00 0.00 175.52 176.05 3hjt h LYS 47 N 0.64 0.31 0.00 4.72 1.63 -0.91 0.13 116.57 123.09 3hjt h LYS 47 Ca 0.15 -0.10 -0.06 0.00 -0.85 0.00 0.00 60.65 59.79 3hjt h LYS 47 Cb 0.22 -0.03 -0.01 0.00 -0.60 0.00 0.00 32.23 31.81 3hjt h LYS 47 CO -0.01 0.54 -0.26 0.93 -3.45 0.00 0.00 179.45 177.20 3hjt h GLU 48 N 0.06 0.00 0.26 1.90 5.08 -0.83 0.51 114.58 121.56 3hjt h GLU 48 Ca 0.05 0.00 -0.34 0.00 -1.00 0.00 0.00 59.36 58.07 3hjt h GLU 48 Cb 0.40 0.00 0.04 0.00 0.50 0.00 0.00 28.75 29.69 3hjt h GLU 48 CO 0.01 0.26 -1.49 0.28 -1.00 0.00 0.00 179.01 177.08 3hjt h VAL 49 N 0.00 1.28 -0.13 3.13 2.07 -1.22 -3.31 116.25 118.06 3hjt h VAL 49 Ca -0.00 -2.71 -0.18 0.00 0.82 0.00 0.00 66.70 64.63 3hjt h VAL 49 Cb 0.48 3.05 -0.00 0.00 -1.52 0.00 0.00 31.29 33.30 3hjt h VAL 49 CO 0.03 0.81 -0.65 -1.28 0.02 0.00 0.00 177.57 176.50 3hjt h SER 50 N 0.15 0.59 0.00 0.57 0.87 -0.50 -3.40 113.55 111.83 3hjt h SER 50 Ca -0.26 -0.35 0.00 0.00 -1.23 0.00 0.00 61.79 59.95 3hjt h SER 50 Cb 2.17 -0.17 0.00 0.00 -0.44 0.00 0.00 62.40 63.96 3hjt h SER 50 CO 0.28 1.08 0.00 0.61 -0.53 0.00 0.00 176.83 178.27 3hjt n GLY 51 N 0.43 1.93 0.00 5.77 0.00 0.15 -2.99 105.19 110.49 3hjt n GLY 51 Ca -0.04 -0.49 0.10 0.00 0.00 0.00 0.00 46.02 45.59 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 8.57 0.58 -0.13 1.61 8.00 -1.26 -4.71 116.55 129.21 3hjt n ASP 52 Ca 0.00 -0.47 -0.12 0.00 0.71 0.00 0.00 54.79 54.91 3hjt n ASP 52 Cb 0.00 1.49 -0.09 0.00 -0.02 0.00 0.00 41.12 42.50 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 -1.66 0.00 0.64 3.38 -1.93 -3.45 115.31 112.29 3hjt h LEU 53 Ca 0.00 0.22 0.00 0.00 0.09 0.00 0.00 57.88 58.19 3hjt h LEU 53 Cb 0.72 0.68 0.00 0.00 0.09 0.00 0.00 40.66 42.15 3hjt h LEU 53 CO 0.00 -0.35 0.00 0.59 0.09 0.00 0.00 178.44 178.77 3hjt n ASN 54 N -5.06 0.57 -4.07 -0.43 3.02 -1.26 -4.57 115.26 103.46 3hjt n ASN 54 Ca -0.03 -0.88 -0.33 0.00 -0.03 0.00 0.00 54.58 53.31 3hjt n ASN 54 Cb 0.30 0.00 -0.14 0.00 -0.61 0.00 0.00 39.78 39.33 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 -0.93 4.91 -0.13 6.41 2.15 -1.12 -4.99 116.67 122.97 3hjt s ASP 55 Ca 0.00 -1.97 -0.14 0.00 0.43 0.00 0.00 52.55 50.87 3hjt s ASP 55 Cb 0.00 -1.70 -0.05 0.00 -0.30 0.00 0.00 42.92 40.88 3hjt s ASP 55 CO 0.00 -0.41 0.32 -0.69 -0.17 0.00 0.00 175.17 174.23 3hjt s VAL 56 N 1.03 5.27 0.23 1.11 1.01 -1.26 -1.00 120.40 126.79 3hjt s VAL 56 Ca 0.07 0.62 0.04 0.00 0.00 0.00 0.00 61.98 62.71 3hjt s VAL 56 Cb -0.20 -3.65 -0.05 0.00 0.00 0.00 0.00 36.38 32.47 3hjt s VAL 56 CO -0.06 0.42 -0.01 -0.13 0.00 0.00 0.00 175.10 175.32 3hjt s ARG 57 N 0.21 1.35 0.01 2.72 1.81 -1.02 -5.00 118.95 119.03 3hjt s ARG 57 Ca 0.19 -1.68 0.04 0.00 -1.72 0.00 0.00 55.73 52.56 3hjt s ARG 57 Cb -0.14 -0.67 -0.01 0.00 -0.45 0.00 0.00 34.95 33.68 3hjt s ARG 57 CO 0.06 -0.08 -0.13 1.41 -0.68 0.00 0.00 175.30 175.88 3hjt s MET 58 N -3.85 1.00 -0.05 3.54 -2.45 -1.26 -0.94 119.30 115.29 3hjt s MET 58 Ca 0.28 -0.59 -0.02 0.00 -1.25 0.00 0.00 55.69 54.12 3hjt s MET 58 Cb 0.05 -0.98 -0.01 0.00 1.25 0.00 0.00 34.83 35.14 3hjt s MET 58 CO 0.09 0.26 0.11 0.82 1.05 0.00 0.00 175.02 177.35 3hjt h ILE 59 N 4.69 0.00 -3.52 10.11 1.08 -1.07 -3.45 117.51 125.36 3hjt h ILE 59 Ca -0.35 -0.53 -0.70 0.00 -0.39 0.00 0.00 64.86 62.89 3hjt h ILE 59 Cb 1.17 0.00 -0.31 0.00 -3.07 0.00 0.00 36.82 34.61 3hjt h ILE 59 CO 0.47 0.00 -0.54 -1.58 -0.69 0.00 0.00 178.15 175.81 3hjt s GLN 60 N -1.59 2.33 0.00 2.37 2.00 -0.41 -4.93 119.66 119.42 3hjt s GLN 60 Ca -0.01 -1.58 0.25 0.00 -2.00 0.00 0.00 55.36 52.02 3hjt s GLN 60 Cb 0.00 -3.60 0.43 0.00 0.80 0.00 0.00 33.01 30.65 3hjt s GLN 60 CO 0.03 -0.95 1.38 -1.13 -0.50 0.00 0.00 175.29 174.12 3hjt n SER 61 N 4.73 2.24 0.00 6.67 3.41 -1.26 -3.95 113.62 125.46 3hjt n SER 61 Ca -0.07 -1.67 0.00 0.00 -0.26 0.00 0.00 58.87 56.86 3hjt n SER 61 Cb 0.42 0.10 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 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 1.32 4.18 3.87 5.00 0.00 -1.26 -0.31 105.19 117.98 3hjt n GLY 62 Ca 0.14 -2.01 -0.31 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 -2.10 3.19 0.00 4.61 0.00 -1.26 -4.34 121.76 121.87 3hjt s ALA 63 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 51.96 51.87 3hjt s ALA 63 Cb 0.00 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 20.19 3hjt s ALA 63 CO 0.00 -0.33 0.00 0.41 0.00 0.00 0.00 175.76 175.84 3hjt n GLY 64 N -1.95 1.00 0.32 0.00 0.00 -1.26 -4.97 105.19 98.33 3hjt n GLY 64 Ca 0.05 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.23 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 0.50 -0.09 -0.61 6.09 -1.86 0.35 117.51 121.89 3hjt h ILE 65 Ca 0.00 0.00 -0.04 0.00 -1.37 0.00 0.00 64.86 63.45 3hjt h ILE 65 Cb 0.00 0.89 -0.00 0.00 0.47 0.00 0.00 36.82 38.18 3hjt h ILE 65 CO 0.00 0.00 -0.10 0.45 -3.07 0.00 0.00 178.15 175.43 3hjt h HIS 66 N 0.00 0.27 -0.61 2.19 3.86 -1.93 -3.27 115.15 115.66 3hjt h HIS 66 Ca 0.06 -0.08 0.00 0.00 -1.16 0.00 0.00 60.37 59.18 3hjt h HIS 66 Cb 0.32 -0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.73 3hjt h HIS 66 CO 0.00 0.66 0.00 -1.13 0.86 0.00 0.00 177.93 178.32 3hjt n SER 67 N -4.66 4.99 -4.79 2.45 3.41 -0.57 -4.99 113.62 109.46 3hjt n SER 67 Ca -0.07 -2.60 -0.36 0.00 -0.26 0.00 0.00 58.87 55.58 3hjt n SER 67 Cb 0.33 -0.60 -0.06 0.00 -0.26 0.00 0.00 64.21 63.62 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 -2.13 3.44 -0.03 7.33 5.36 0.11 -5.07 117.98 126.99 3hjt s PHE 68 Ca 0.52 1.69 -0.00 0.00 -0.96 0.00 0.00 56.93 58.17 3hjt s PHE 68 Cb 0.35 -2.99 0.03 0.00 -0.34 0.00 0.00 43.02 40.08 3hjt s PHE 68 CO 0.22 -0.19 0.03 -1.21 -1.46 0.00 0.00 175.22 172.60 3hjt s GLU 69 N -2.49 0.06 0.60 10.12 0.41 -1.26 -4.88 118.70 121.26 3hjt s GLU 69 Ca 0.56 0.18 -0.18 0.00 -0.41 0.00 0.00 54.97 55.12 3hjt s GLU 69 Cb -0.18 -0.36 -0.03 0.00 -1.78 0.00 0.00 34.13 31.78 3hjt s GLU 69 CO 0.23 -0.18 1.19 -1.25 -0.49 0.00 0.00 175.26 174.76 3hjt s PRO 70 N 1.22 2.94 0.49 0.39 0.04 -1.26 -5.03 135.00 133.79 3hjt s PRO 70 Ca -0.07 1.77 -0.04 0.00 0.04 0.00 0.00 61.00 62.70 3hjt s PRO 70 Cb -0.13 -1.93 -0.02 0.00 0.04 0.00 0.00 34.50 32.46 3hjt s PRO 70 CO -0.03 -1.22 0.77 -1.54 0.04 0.00 0.00 177.00 175.03 3hjt s SER 71 N -1.70 6.07 0.43 6.66 1.04 -1.26 -4.89 113.70 120.06 3hjt s SER 71 Ca 0.76 0.75 0.18 0.00 0.48 0.00 0.00 55.95 58.12 3hjt s SER 71 Cb -0.29 -2.03 1.10 0.00 0.10 0.00 0.00 66.02 64.91 3hjt s SER 71 CO 0.34 -0.66 1.89 -0.37 0.98 0.00 0.00 173.24 175.41 3hjt h VAL 72 N 0.22 0.72 -0.42 5.02 -1.51 -2.00 0.23 116.25 118.51 3hjt h VAL 72 Ca -0.47 -0.13 -0.07 0.00 -1.23 0.00 0.00 66.70 64.80 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 0.07 -0.03 0.78 -1.23 0.00 0.00 177.57 177.77 3hjt h ASN 73 N 0.38 0.75 0.10 4.19 4.21 -1.99 -2.32 115.58 120.89 3hjt h ASN 73 Ca 0.42 -0.33 0.02 0.00 1.21 0.00 0.00 56.30 57.62 3hjt h ASN 73 Cb 1.06 -0.20 -0.04 0.00 -1.12 0.00 0.00 38.32 38.01 3hjt h ASN 73 CO -0.14 0.90 -0.29 0.44 -1.29 0.00 0.00 177.43 177.05 3hjt h ASP 74 N 0.59 -0.84 -0.11 5.81 3.32 -0.93 -1.32 116.42 122.94 3hjt h ASP 74 Ca 0.11 0.10 0.03 0.00 0.02 0.00 0.00 57.03 57.30 3hjt h ASP 74 Cb 0.53 0.32 -0.00 0.00 0.22 0.00 0.00 39.33 40.40 3hjt h ASP 74 CO 0.03 -0.38 0.09 -0.37 -1.72 0.00 0.00 179.24 176.89 3hjt h VAL 75 N -0.49 0.83 -0.21 -1.35 -1.51 -1.30 -1.79 116.25 110.43 3hjt h VAL 75 Ca 0.04 0.00 -0.08 0.00 -1.23 0.00 0.00 66.70 65.42 3hjt h VAL 75 Cb 0.53 0.94 -0.00 0.00 -2.13 0.00 0.00 31.29 30.63 3hjt h VAL 75 CO -0.19 0.00 -0.20 0.00 -1.23 0.00 0.00 177.57 175.96 3hjt h ALA 76 N 1.93 0.30 0.00 5.19 0.00 -0.74 -0.86 119.26 125.08 3hjt h ALA 76 Ca 0.05 -0.35 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 3hjt h ALA 76 Cb 0.22 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 3hjt h ALA 76 CO -0.00 0.23 -0.14 0.00 0.00 0.00 0.00 179.25 179.34 3hjt h ALA 77 N 0.65 1.64 -0.21 0.00 0.00 -0.47 -0.19 119.26 120.68 3hjt h ALA 77 Ca 0.03 -0.13 -0.20 0.00 0.00 0.00 0.00 54.91 54.62 3hjt h ALA 77 Cb 0.74 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.51 3hjt h ALA 77 CO 0.05 0.18 -0.64 0.82 0.00 0.00 0.00 179.25 179.65 3hjt h ILE 78 N 0.00 1.29 0.00 0.00 2.04 -0.99 -2.78 117.51 117.07 3hjt h ILE 78 Ca -0.00 -1.85 0.00 0.00 1.00 0.00 0.00 64.86 64.00 3hjt h ILE 78 Cb 0.27 1.80 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 3hjt h ILE 78 CO 0.02 0.59 0.00 1.88 0.00 0.00 0.00 178.15 180.64 3hjt h TYR 79 N 0.57 0.00 -0.22 1.37 0.05 -0.17 -3.03 116.97 115.54 3hjt h TYR 79 Ca -0.01 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.77 3hjt h TYR 79 Cb 1.25 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.99 3hjt h TYR 79 CO 0.07 0.00 0.00 -0.25 -1.05 0.00 0.00 178.16 176.93 3hjt n ASP 80 N -2.95 2.93 -4.84 3.88 9.92 -0.18 -4.65 116.55 120.66 3hjt n ASP 80 Ca 0.03 -1.92 -0.31 0.00 -0.53 0.00 0.00 54.79 52.06 3hjt n ASP 80 Cb 0.43 -0.14 -0.05 0.00 -0.64 0.00 0.00 41.12 40.72 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 -1.73 3.76 0.24 2.24 0.00 -1.05 -4.94 121.76 120.27 3hjt s ALA 81 Ca 0.35 -0.93 0.04 0.00 0.00 0.00 0.00 51.96 51.41 3hjt s ALA 81 Cb 0.21 -1.61 0.25 0.00 0.00 0.00 0.00 23.12 21.97 3hjt s ALA 81 CO 0.31 0.78 1.56 -0.44 0.00 0.00 0.00 175.76 177.97 3hjt h ASP 82 N 3.25 0.30 -3.73 0.00 3.32 -1.42 -3.35 116.42 114.80 3hjt h ASP 82 Ca -0.46 -0.17 -0.18 0.00 0.02 0.00 0.00 57.03 56.24 3hjt h ASP 82 Cb 1.16 -0.09 -0.27 0.00 0.22 0.00 0.00 39.33 40.36 3hjt h ASP 82 CO 0.70 0.82 -0.47 -0.22 -1.72 0.00 0.00 179.24 178.34 3hjt s LEU 83 N -7.98 1.05 -0.26 1.55 2.96 -0.96 -1.69 118.68 113.35 3hjt s LEU 83 Ca -0.04 0.44 -0.00 0.00 -0.22 0.00 0.00 54.13 54.31 3hjt s LEU 83 Cb 0.12 0.72 0.07 0.00 0.50 0.00 0.00 46.19 47.61 3hjt s LEU 83 CO 0.80 -0.09 0.01 0.12 -1.32 0.00 0.00 176.35 175.87 3hjt s PHE 84 N 0.33 2.09 -0.20 5.38 5.36 0.15 -0.99 117.98 130.10 3hjt s PHE 84 Ca -0.02 -1.70 -0.09 0.00 -0.96 0.00 0.00 56.93 54.15 3hjt s PHE 84 Cb -0.03 -1.65 -0.05 0.00 -0.34 0.00 0.00 43.02 40.95 3hjt s PHE 84 CO -0.01 -0.79 0.12 0.54 -1.46 0.00 0.00 175.22 173.62 3hjt s VAL 85 N 1.49 5.27 0.15 3.12 0.11 0.82 -1.69 120.40 129.67 3hjt s VAL 85 Ca 0.01 0.14 0.06 0.00 -2.93 0.00 0.00 61.98 59.26 3hjt s VAL 85 Cb -0.18 -3.40 -0.04 0.00 -1.53 0.00 0.00 36.38 31.23 3hjt s VAL 85 CO -0.12 0.44 -0.13 -0.72 -3.33 0.00 0.00 175.10 171.25 3hjt s TYR 86 N 0.41 1.41 -0.00 1.54 1.13 -0.98 -1.77 117.35 119.08 3hjt s TYR 86 Ca 0.07 -0.63 -0.16 0.00 -1.41 0.00 0.00 57.07 54.94 3hjt s TYR 86 Cb -0.11 -0.71 -0.09 0.00 -1.10 0.00 0.00 41.96 39.95 3hjt s TYR 86 CO -0.01 0.16 0.84 1.25 -2.51 0.00 0.00 175.55 175.29 3hjt h HIS 87 N 3.08 -0.54 -3.91 -3.49 -0.00 -1.94 -1.31 115.15 107.04 3hjt h HIS 87 Ca -0.38 -0.01 -0.14 0.00 -0.00 0.00 0.00 60.37 59.84 3hjt h HIS 87 Cb 1.20 0.18 -0.10 0.00 -0.00 0.00 0.00 27.41 28.69 3hjt h HIS 87 CO 0.66 -0.33 -0.21 0.45 -0.00 0.00 0.00 177.93 178.50 3hjt s SER 88 N -3.96 0.19 0.00 3.26 0.15 -1.26 -1.62 113.70 110.46 3hjt s SER 88 Ca -0.08 -1.14 0.25 0.00 0.70 0.00 0.00 55.95 55.67 3hjt s SER 88 Cb 0.01 0.57 0.55 0.00 -1.71 0.00 0.00 66.02 65.44 3hjt s SER 88 CO 0.25 -1.14 1.44 0.00 1.20 0.00 0.00 173.24 175.00 3hjt n HIS 89 N -0.41 0.00 1.25 3.44 1.44 -1.26 -2.06 115.22 117.62 3hjt n HIS 89 Ca -0.00 0.00 0.13 0.00 -2.01 0.00 0.00 57.72 55.83 3hjt n HIS 89 Cb 0.62 -0.20 0.38 0.00 0.12 0.00 0.00 29.99 30.91 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 -1.25 0.00 0.00 0.61 -2.24 -1.26 -4.07 114.28 106.07 3hjt n THR 90 Ca 0.07 -0.14 0.00 0.00 -2.27 0.00 0.00 64.05 61.72 3hjt n THR 90 Cb 0.34 0.42 0.00 0.00 -2.10 0.00 0.00 70.33 68.99 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 -0.59 0.00 -3.69 3.22 7.94 -1.21 -4.82 117.00 117.85 3hjt n LEU 91 Ca 0.12 0.00 -0.43 0.00 -1.11 0.00 0.00 56.01 54.60 3hjt n LEU 91 Cb 0.35 0.00 -0.03 0.00 0.53 0.00 0.00 43.42 44.27 3hjt n LEU 91 CO 0.25 -0.08 2.39 -0.62 -1.11 0.00 0.00 177.39 178.22 3hjt n GLU 92 N -1.24 2.16 0.05 1.96 4.71 -0.87 -4.68 120.64 122.73 3hjt n GLU 92 Ca 0.00 -2.22 0.18 0.00 -0.01 0.00 0.00 57.16 55.11 3hjt n GLU 92 Cb 0.00 -3.11 0.68 0.00 -1.01 0.00 0.00 31.44 28.01 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 6.99 2.40 0.00 0.62 0.00 -1.76 -1.51 119.26 126.00 3hjt h ALA 93 Ca 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.39 3hjt h ALA 93 Cb 0.66 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3hjt h ALA 93 CO 1.92 -0.54 0.00 0.11 0.00 0.00 0.00 179.25 180.75 3hjt h TRP 94 N 0.00 0.00 -0.05 0.00 5.08 -1.90 -2.91 115.95 116.18 3hjt h TRP 94 Ca 0.21 0.00 -0.12 0.00 1.08 0.00 0.00 58.89 60.06 3hjt h TRP 94 Cb 0.83 0.00 -0.01 0.00 -3.00 0.00 0.00 29.16 26.98 3hjt h TRP 94 CO 0.00 0.00 -0.52 0.00 -1.28 0.00 0.00 178.44 176.64 3hjt h ALA 95 N 2.16 1.04 0.00 0.11 0.00 -1.63 -3.08 119.26 117.86 3hjt h ALA 95 Ca 0.00 -0.48 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 3hjt h ALA 95 Cb 0.30 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.00 3hjt h ALA 95 CO 0.00 0.66 -0.07 0.00 0.00 0.00 0.00 179.25 179.84 3hjt h ARG 96 N 0.10 0.00 -2.12 0.00 2.47 -1.69 -3.19 114.38 109.94 3hjt h ARG 96 Ca 0.00 0.00 -0.68 0.00 -1.26 0.00 0.00 59.98 58.04 3hjt h ARG 96 Cb 0.95 0.00 -0.22 0.00 -1.65 0.00 0.00 29.97 29.05 3hjt h ARG 96 CO 0.07 0.07 1.01 -0.25 0.56 0.00 0.00 179.97 181.43 3hjt n ASP 97 N -4.22 7.21 -3.74 7.04 8.00 -1.16 -4.86 116.55 124.81 3hjt n ASP 97 Ca -0.03 -3.50 -0.28 0.00 0.71 0.00 0.00 54.79 51.69 3hjt n ASP 97 Cb 0.15 -1.18 -0.16 0.00 -0.02 0.00 0.00 41.12 39.90 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 -3.19 1.23 -0.51 0.64 1.43 -1.21 -5.09 118.68 111.98 3hjt s LEU 98 Ca 0.53 -0.85 0.03 0.00 -1.03 0.00 0.00 54.13 52.81 3hjt s LEU 98 Cb 0.35 -0.61 0.14 0.00 0.03 0.00 0.00 46.19 46.09 3hjt s LEU 98 CO -0.26 -0.31 0.28 -1.81 0.23 0.00 0.00 176.35 174.48 3hjt s ASP 99 N 1.84 4.07 0.52 2.29 1.01 -1.26 -5.07 116.67 120.07 3hjt s ASP 99 Ca -0.01 -2.97 -0.20 0.00 0.71 0.00 0.00 52.55 50.08 3hjt s ASP 99 Cb -0.17 -1.40 -0.06 0.00 1.01 0.00 0.00 42.92 42.29 3hjt s ASP 99 CO -0.08 -0.23 1.14 -2.16 0.21 0.00 0.00 175.17 174.04 3hjt s PRO 100 N -0.18 3.46 -0.90 8.23 0.04 -1.26 -5.02 135.00 139.36 3hjt s PRO 100 Ca 0.18 1.64 -0.09 0.00 0.04 0.00 0.00 61.00 62.78 3hjt s PRO 100 Cb -0.23 -2.10 0.23 0.00 0.04 0.00 0.00 34.50 32.44 3hjt s PRO 100 CO -0.02 -0.77 0.83 0.15 0.04 0.00 0.00 177.00 177.23 3hjt s LYS 104 N -3.15 3.59 -0.04 4.56 3.01 -1.26 -5.12 119.74 121.34 3hjt s LYS 104 Ca 0.71 -2.85 -0.16 0.00 -1.01 0.00 0.00 55.97 52.65 3hjt s LYS 104 Cb -0.25 -4.29 0.03 0.00 -1.01 0.00 0.00 37.83 32.31 3hjt s LYS 104 CO 0.28 -1.25 0.35 -1.54 0.51 0.00 0.00 175.35 173.70 3hjt s SER 105 N 1.29 -0.27 0.00 2.83 1.04 -1.26 -5.04 113.70 112.29 3hjt s SER 105 Ca 0.23 0.28 0.00 0.00 0.48 0.00 0.00 55.95 56.94 3hjt s SER 105 Cb -0.11 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.44 3hjt s SER 105 CO -0.08 -0.39 1.54 2.29 0.98 0.00 0.00 173.24 177.57 3hjt n LYS 106 N 1.59 0.82 -3.23 4.02 0.00 -1.26 -4.86 118.16 115.24 3hjt n LYS 106 Ca -0.20 0.00 -0.39 0.00 -0.00 0.00 0.00 58.31 57.73 3hjt n LYS 106 Cb 0.56 -1.09 -0.06 0.00 -0.00 0.00 0.00 35.03 34.45 3hjt n LYS 106 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 3hjt s VAL 107 N 0.34 4.99 -0.22 0.58 0.11 -1.25 -4.71 120.40 120.24 3hjt s VAL 107 Ca 0.00 1.18 -0.09 0.00 -2.93 0.00 0.00 61.98 60.14 3hjt s VAL 107 Cb 0.00 -3.91 -0.04 0.00 -1.53 0.00 0.00 36.38 30.90 3hjt s VAL 107 CO 0.00 0.39 0.12 0.20 -3.33 0.00 0.00 175.10 172.48 3hjt s ASN 108 N 0.05 5.84 -0.25 3.54 -0.87 -0.68 -4.96 114.94 117.61 3hjt s ASN 108 Ca 0.30 0.06 -0.13 0.00 -1.57 0.00 0.00 52.86 51.52 3hjt s ASN 108 Cb -0.17 -2.04 -0.04 0.00 -0.02 0.00 0.00 41.25 38.98 3hjt s ASN 108 CO 0.16 0.08 0.30 -0.69 -2.57 0.00 0.00 177.10 174.38 3hjt s VAL 109 N 0.92 5.24 -0.25 1.60 1.01 -1.26 0.34 120.40 128.01 3hjt s VAL 109 Ca 0.06 0.45 0.02 0.00 0.00 0.00 0.00 61.98 62.51 3hjt s VAL 109 Cb -0.13 -3.63 0.06 0.00 0.00 0.00 0.00 36.38 32.68 3hjt s VAL 109 CO 0.03 0.23 -0.06 0.12 0.00 0.00 0.00 175.10 175.42 3hjt s PHE 110 N 1.63 2.75 -1.00 5.22 5.36 -0.68 -4.97 117.98 126.29 3hjt s PHE 110 Ca 0.13 -2.02 -0.22 0.00 -0.96 0.00 0.00 56.93 53.86 3hjt s PHE 110 Cb -0.15 -1.77 0.06 0.00 -0.34 0.00 0.00 43.02 40.82 3hjt s PHE 110 CO 0.08 -0.82 1.39 -2.00 -1.46 0.00 0.00 175.22 172.41 3hjt s GLU 111 N 1.27 3.59 0.61 10.12 2.12 -1.26 -2.32 118.70 132.83 3hjt s GLU 111 Ca -0.06 -1.23 0.27 0.00 0.36 0.00 0.00 54.97 54.32 3hjt s GLU 111 Cb -0.19 -5.27 1.34 0.00 0.26 0.00 0.00 34.13 30.26 3hjt s GLU 111 CO -0.06 -2.13 1.75 0.00 -0.54 0.00 0.00 175.26 174.28 3hjt h ALA 112 N 9.63 2.18 -0.75 6.30 0.00 -1.32 -2.10 119.26 133.20 3hjt h ALA 112 Ca 0.19 -0.02 -0.23 0.00 0.00 0.00 0.00 54.91 54.86 3hjt h ALA 112 Cb 1.01 0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.70 3hjt h ALA 112 CO 1.37 -0.86 0.29 -1.13 0.00 0.00 0.00 179.25 178.92 3hjt n SER 113 N -3.44 4.78 -0.18 0.00 3.41 -0.64 -4.60 113.62 112.95 3hjt n SER 113 Ca 0.09 -3.20 -0.02 0.00 -0.26 0.00 0.00 58.87 55.48 3hjt n SER 113 Cb 0.80 -0.75 0.08 0.00 -0.26 0.00 0.00 64.21 64.08 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 2.59 0.39 0.46 4.33 1.57 -1.63 -3.18 116.57 121.09 3hjt h LYS 114 Ca 0.28 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.01 3hjt h LYS 114 Cb 2.34 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 34.57 3hjt h LYS 114 CO 0.75 0.26 -0.22 -1.35 -0.57 0.00 0.00 179.45 178.32 3hjt h PRO 115 N 0.40 -0.59 -6.20 3.15 0.11 -1.87 -3.46 132.00 123.53 3hjt h PRO 115 Ca 0.26 0.04 -0.59 0.00 0.11 0.00 0.00 66.00 65.82 3hjt h PRO 115 Cb 0.27 0.13 0.18 0.00 0.11 0.00 0.00 31.00 31.70 3hjt h PRO 115 CO -0.25 -0.32 -0.85 1.28 -0.21 0.00 0.00 178.00 177.65 3hjt n LEU 116 N -5.29 -1.91 -4.11 2.35 4.32 -1.20 -4.94 117.00 106.22 3hjt n LEU 116 Ca -0.11 0.69 -0.37 0.00 -0.02 0.00 0.00 56.01 56.20 3hjt n LEU 116 Cb 0.29 -0.98 -0.10 0.00 -1.62 0.00 0.00 43.42 41.01 3hjt n LEU 116 CO 0.33 -4.10 -0.04 0.42 -1.22 0.00 0.00 177.39 172.78 3hjt s THR 117 N -1.89 3.61 0.23 -5.08 -4.23 -1.26 -5.07 115.64 101.95 3hjt s THR 117 Ca 0.62 -2.56 -0.30 0.00 -1.18 0.00 0.00 61.69 58.27 3hjt s THR 117 Cb -0.47 -3.39 -0.10 0.00 1.34 0.00 0.00 72.50 69.87 3hjt s THR 117 CO 0.61 -0.81 1.46 -0.76 -0.54 0.00 0.00 174.62 174.59 3hjt s LEU 118 N 0.46 4.38 0.57 4.79 1.43 -1.26 -5.00 118.68 124.05 3hjt s LEU 118 Ca 0.13 2.65 -0.18 0.00 -1.03 0.00 0.00 54.13 55.71 3hjt s LEU 118 Cb -0.21 -3.62 -0.05 0.00 0.03 0.00 0.00 46.19 42.34 3hjt s LEU 118 CO -0.04 -0.72 1.08 -1.81 0.23 0.00 0.00 176.35 175.10 3hjt s ASP 119 N 0.49 5.77 0.58 2.29 1.01 -1.26 -4.85 116.67 120.70 3hjt s ASP 119 Ca 0.61 1.98 -0.15 0.00 0.71 0.00 0.00 52.55 55.70 3hjt s ASP 119 Cb -0.42 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 40.91 3hjt s ASP 119 CO 0.41 -1.18 1.03 -0.60 0.21 0.00 0.00 175.17 175.04 3hjt s ARG 120 N -3.66 3.51 -0.08 8.23 3.52 -1.26 -1.38 118.95 127.83 3hjt s ARG 120 Ca 0.68 1.03 -0.23 0.00 -0.13 0.00 0.00 55.73 57.07 3hjt s ARG 120 Cb -0.19 -2.07 -0.04 0.00 -1.56 0.00 0.00 34.95 31.10 3hjt s ARG 120 CO 0.31 -0.64 0.70 0.08 -0.81 0.00 0.00 175.30 174.94 3hjt s VAL 121 N -2.68 5.04 0.69 7.11 1.01 0.11 -4.63 120.40 127.06 3hjt s VAL 121 Ca 0.60 1.43 -0.06 0.00 0.00 0.00 0.00 61.98 63.96 3hjt s VAL 121 Cb -0.13 -4.04 0.06 0.00 0.00 0.00 0.00 36.38 32.27 3hjt s VAL 121 CO 0.40 0.24 0.99 -1.59 0.00 0.00 0.00 175.10 175.14 3hjt s LYS 122 N 0.89 2.21 0.00 2.72 0.00 -1.26 -4.78 119.74 119.53 3hjt s LYS 122 Ca 0.37 -0.32 0.00 0.00 0.00 0.00 0.00 55.97 56.02 3hjt s LYS 122 Cb -0.18 -2.20 0.00 0.00 0.00 0.00 0.00 37.83 35.46 3hjt s LYS 122 CO 0.17 -1.20 0.00 0.41 0.00 0.00 0.00 175.35 174.73 3hjt n GLY 123 N -2.87 3.18 2.87 0.59 0.00 -1.26 -5.15 105.19 102.54 3hjt n GLY 123 Ca 0.08 -1.01 -0.13 0.00 0.00 0.00 0.00 46.02 44.96 3hjt n GLY 123 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3hjt s THR 137 N -0.17 -0.02 0.30 2.61 -1.32 -1.26 -5.34 115.64 110.44 3hjt s THR 137 Ca 0.00 0.08 0.07 0.00 -1.21 0.00 0.00 61.69 60.63 3hjt s THR 137 Cb 0.00 -0.08 -0.03 0.00 -1.51 0.00 0.00 72.50 70.88 3hjt s THR 137 CO 0.00 0.03 0.28 -0.76 -2.21 0.00 0.00 174.62 171.97 3hjt s LEU 138 N 0.43 3.75 0.15 9.08 1.02 -1.26 -4.99 118.68 126.85 3hjt s LEU 138 Ca -0.03 -0.35 0.11 0.00 0.02 0.00 0.00 54.13 53.87 3hjt s LEU 138 Cb -0.05 -2.35 -0.04 0.00 0.02 0.00 0.00 46.19 43.77 3hjt s LEU 138 CO -0.01 -0.24 -0.23 -0.31 0.02 0.00 0.00 176.35 175.58 3hjt s TYR 139 N -2.22 2.38 -0.43 0.29 2.02 -1.26 0.07 117.35 118.20 3hjt s TYR 139 Ca 0.38 -0.33 -0.26 0.00 -0.37 0.00 0.00 57.07 56.49 3hjt s TYR 139 Cb -0.07 -1.24 0.02 0.00 -0.40 0.00 0.00 41.96 40.28 3hjt s TYR 139 CO 0.27 0.42 0.96 0.34 -1.57 0.00 0.00 175.55 175.97 3hjt s ASP 140 N -2.35 6.58 0.21 2.29 -1.08 -0.48 -4.83 116.67 117.02 3hjt s ASP 140 Ca 0.18 0.33 0.26 0.00 -0.52 0.00 0.00 52.55 52.80 3hjt s ASP 140 Cb -0.09 -2.47 0.82 0.00 -1.46 0.00 0.00 42.92 39.72 3hjt s ASP 140 CO 0.09 -1.02 1.77 -0.81 0.52 0.00 0.00 175.17 175.72 3hjt n PRO 141 N 7.16 0.26 0.00 4.34 -0.04 -1.26 -4.34 135.00 141.11 3hjt n PRO 141 Ca 0.07 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.77 3hjt n PRO 141 Cb 0.48 -1.81 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 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 -2.26 0.00 -0.01 0.54 8.25 -1.26 -4.41 115.22 116.07 3hjt n HIS 142 Ca 0.05 0.00 -0.11 0.00 -0.26 0.00 0.00 57.72 57.40 3hjt n HIS 142 Cb 0.41 -0.27 0.02 0.00 1.12 0.00 0.00 29.99 31.28 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 2.13 1.32 0.00 1.59 1.35 -1.92 -3.30 112.91 114.07 3hjt h THR 143 Ca 0.00 -1.87 0.00 0.00 -0.55 0.00 0.00 66.41 63.99 3hjt h THR 143 Cb 0.00 1.83 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 3hjt h THR 143 CO 0.08 0.58 0.15 -2.67 -0.25 0.00 0.00 175.52 173.41 3hjt n TRP 144 N -3.94 0.41 1.20 4.73 2.14 -1.26 -1.08 117.44 119.64 3hjt n TRP 144 Ca -0.04 0.21 0.10 0.00 2.07 0.00 0.00 57.50 59.84 3hjt n TRP 144 Cb 0.64 -0.73 0.35 0.00 -0.81 0.00 0.00 31.31 30.76 3hjt n TRP 144 CO 0.00 0.00 0.00 0.25 2.07 0.00 0.00 177.69 180.01 3hjt n THR 145 N -1.93 0.24 -3.72 -1.67 -2.24 -1.24 -4.64 114.28 99.08 3hjt n THR 145 Ca -0.01 -0.36 -0.38 0.00 -2.27 0.00 0.00 64.05 61.04 3hjt n THR 145 Cb 0.17 0.33 -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 -1.49 5.38 0.28 3.42 -1.08 -0.24 -4.33 116.67 118.62 3hjt s ASP 146 Ca 0.31 -1.32 -0.00 0.00 -0.52 0.00 0.00 52.55 51.01 3hjt s ASP 146 Cb 0.17 -1.89 0.66 0.00 -1.46 0.00 0.00 42.92 40.39 3hjt s ASP 146 CO 0.25 -0.40 1.47 -2.65 0.52 0.00 0.00 175.17 174.35 3hjt n PRO 147 N 4.81 -0.08 0.29 4.34 -0.02 -1.26 -0.51 135.00 142.56 3hjt n PRO 147 Ca -0.11 1.42 -0.15 0.00 -2.02 0.00 0.00 63.50 62.64 3hjt n PRO 147 Cb 0.44 -2.22 -0.08 0.00 -0.02 0.00 0.00 33.50 31.62 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 0.37 -0.21 -1.45 2.07 -1.94 0.64 116.25 115.74 3hjt h VAL 148 Ca 0.54 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.75 3hjt h VAL 148 Cb 1.07 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.31 3hjt h VAL 148 CO -0.90 0.04 0.10 -0.07 0.02 0.00 0.00 177.57 176.77 3hjt h LEU 149 N -0.95 0.25 -0.12 2.57 3.38 -1.65 0.66 115.31 119.45 3hjt h LEU 149 Ca -0.07 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.82 3hjt h LEU 149 Cb 0.63 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.32 3hjt h LEU 149 CO 0.12 0.22 -0.16 0.00 0.09 0.00 0.00 178.44 178.71 3hjt h ALA 150 N 1.83 0.18 -0.54 1.53 0.00 -0.74 -2.17 119.26 119.36 3hjt h ALA 150 Ca 0.08 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.61 3hjt h ALA 150 Cb 0.03 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 3hjt h ALA 150 CO -0.01 0.08 0.16 0.78 0.00 0.00 0.00 179.25 180.26 3hjt h GLY 151 N -0.09 0.86 1.86 0.00 0.00 -0.09 -1.57 103.07 104.05 3hjt h GLY 151 Ca 0.01 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 46.88 3hjt h GLY 151 CO 0.04 0.44 -0.08 -1.84 0.00 0.00 0.00 176.54 175.09 3hjt n GLU 152 N -4.30 0.11 0.02 4.80 0.28 0.15 -2.25 120.64 119.45 3hjt n GLU 152 Ca 0.04 0.08 -0.11 0.00 -0.16 0.00 0.00 57.16 57.01 3hjt n GLU 152 Cb 0.20 -1.61 -0.14 0.00 1.43 0.00 0.00 31.44 31.32 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 0.08 -0.00 3.44 4.81 -0.90 -3.02 114.58 118.99 3hjt h GLU 153 Ca 0.00 -0.14 -0.08 0.00 -0.13 0.00 0.00 59.36 59.01 3hjt h GLU 153 Cb 0.60 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.02 3hjt h GLU 153 CO 0.00 0.83 -0.38 0.00 -0.73 0.00 0.00 179.01 178.73 3hjt h ALA 154 N 0.81 1.37 -0.24 2.92 0.00 -1.15 -2.22 119.26 120.74 3hjt h ALA 154 Ca -0.21 -0.35 -0.18 0.00 0.00 0.00 0.00 54.91 54.17 3hjt h ALA 154 Cb 1.95 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.69 3hjt h ALA 154 CO 0.12 0.48 -0.55 0.28 0.00 0.00 0.00 179.25 179.57 3hjt h VAL 155 N 0.00 1.29 -0.17 0.00 2.07 -1.48 -2.62 116.25 115.34 3hjt h VAL 155 Ca -0.00 -1.75 -0.02 0.00 0.82 0.00 0.00 66.70 65.75 3hjt h VAL 155 Cb 0.67 1.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.19 3hjt h VAL 155 CO 0.05 0.56 0.02 -1.13 0.02 0.00 0.00 177.57 177.09 3hjt h ASN 156 N 0.55 0.21 0.16 0.57 -0.00 -1.28 -1.48 115.58 114.31 3hjt h ASN 156 Ca -0.00 -0.02 -0.20 0.00 -0.00 0.00 0.00 56.30 56.08 3hjt h ASN 156 Cb 1.16 -0.05 0.00 0.00 -0.00 0.00 0.00 38.32 39.43 3hjt h ASN 156 CO 0.12 0.24 -0.77 0.40 -0.00 0.00 0.00 177.43 177.42 3hjt h ILE 157 N 0.24 1.35 -0.95 2.57 2.04 -1.33 -2.77 117.51 118.67 3hjt h ILE 157 Ca 0.06 -2.14 0.00 0.00 1.00 0.00 0.00 64.86 63.79 3hjt h ILE 157 Cb 0.13 2.12 -0.05 0.00 -0.74 0.00 0.00 36.82 38.28 3hjt h ILE 157 CO -0.00 0.65 0.61 0.00 0.00 0.00 0.00 178.15 179.41 3hjt h ALA 158 N 0.81 1.21 -0.05 1.87 0.00 -0.90 0.23 119.26 122.42 3hjt h ALA 158 Ca -0.04 -0.08 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3hjt h ALA 158 Cb 1.37 -0.38 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 3hjt h ALA 158 CO 0.14 0.62 0.02 0.87 0.00 0.00 0.00 179.25 180.91 3hjt h LYS 159 N 1.30 0.08 -0.76 0.00 1.57 -1.34 0.40 116.57 117.81 3hjt h LYS 159 Ca 0.35 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 59.11 3hjt h LYS 159 Cb -0.12 -0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.14 3hjt h LYS 159 CO -0.07 0.22 0.46 1.49 -0.57 0.00 0.00 179.45 180.97 3hjt h GLU 160 N -0.07 1.03 -0.37 3.15 4.57 -1.16 0.83 114.58 122.56 3hjt h GLU 160 Ca 0.02 -0.09 -0.06 0.00 -1.18 0.00 0.00 59.36 58.05 3hjt h GLU 160 Cb 0.16 -0.22 -0.01 0.00 -0.16 0.00 0.00 28.75 28.52 3hjt h GLU 160 CO -0.00 0.73 0.01 -0.07 -1.18 0.00 0.00 179.01 178.50 3hjt h LEU 161 N 1.05 0.62 -0.79 1.64 3.38 -0.21 -2.46 115.31 118.53 3hjt h LEU 161 Ca 0.27 -0.30 -0.11 0.00 0.09 0.00 0.00 57.88 57.84 3hjt h LEU 161 Cb -0.04 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.53 3hjt h LEU 161 CO -0.05 0.77 -0.27 1.23 0.09 0.00 0.00 178.44 180.20 3hjt h GLY 162 N 0.46 0.65 1.83 0.83 0.00 0.58 -2.28 103.07 105.13 3hjt h GLY 162 Ca 0.11 -0.56 -0.07 0.00 0.00 0.00 0.00 47.33 46.80 3hjt h GLY 162 CO 0.02 0.51 -0.24 0.84 0.00 0.00 0.00 176.54 177.67 3hjt h HIS 163 N 0.52 0.22 0.00 5.60 -0.00 0.78 -2.20 115.15 120.08 3hjt h HIS 163 Ca 0.07 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.40 3hjt h HIS 163 Cb 0.74 -0.06 0.00 0.00 -0.00 0.00 0.00 27.41 28.09 3hjt h HIS 163 CO 0.03 0.44 -0.90 -0.07 -0.00 0.00 0.00 177.93 177.42 3hjt h LEU 164 N 0.19 0.00 -6.00 0.26 3.38 -1.32 -3.40 115.31 108.42 3hjt h LEU 164 Ca 0.03 -0.06 -0.55 0.00 0.09 0.00 0.00 57.88 57.39 3hjt h LEU 164 Cb 0.53 0.00 -0.39 0.00 0.09 0.00 0.00 40.66 40.89 3hjt h LEU 164 CO 0.04 0.03 -1.11 -0.67 0.09 0.00 0.00 178.44 176.82 3hjt n ASP 165 N -2.54 0.39 0.24 -0.43 2.03 -0.87 -4.96 116.55 110.41 3hjt n ASP 165 Ca 0.01 -2.77 0.18 0.00 0.52 0.00 0.00 54.79 52.72 3hjt n ASP 165 Cb 0.52 -0.64 0.81 0.00 -0.72 0.00 0.00 41.12 41.09 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 3.82 0.00 -0.47 -0.67 0.11 -1.63 -1.33 132.00 131.82 3hjt h PRO 166 Ca 0.08 0.00 0.02 0.00 0.11 0.00 0.00 66.00 66.21 3hjt h PRO 166 Cb 0.89 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.97 3hjt h PRO 166 CO 0.48 0.00 0.31 0.87 -0.21 0.00 0.00 178.00 179.45 3hjt h LYS 167 N 0.00 0.54 -0.10 1.05 1.57 -1.93 -2.84 116.57 114.85 3hjt h LYS 167 Ca 0.08 -0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3hjt h LYS 167 Cb 0.77 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.96 3hjt h LYS 167 CO -0.00 0.36 0.00 0.72 -0.57 0.00 0.00 179.45 179.95 3hjt n HIS 168 N -4.47 0.21 0.26 -1.35 8.25 -0.52 -4.78 115.22 112.81 3hjt n HIS 168 Ca 0.05 -0.67 0.05 0.00 -0.26 0.00 0.00 57.72 56.89 3hjt n HIS 168 Cb 0.12 -0.10 0.27 0.00 1.12 0.00 0.00 29.99 31.40 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 0.64 0.00 0.03 -0.41 3.64 -1.28 -0.13 116.57 119.05 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 0.79 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.61 3hjt h LYS 169 CO 0.03 0.00 -0.01 -0.44 -2.27 0.00 0.00 179.45 176.75 3hjt h ASP 170 N 0.00 -0.03 -0.54 4.20 3.32 -1.86 -2.81 116.42 118.70 3hjt h ASP 170 Ca 0.00 -0.68 0.06 0.00 0.02 0.00 0.00 57.03 56.44 3hjt h ASP 170 Cb 1.26 0.01 -0.03 0.00 0.22 0.00 0.00 39.33 40.79 3hjt h ASP 170 CO 0.00 0.75 0.36 -1.28 -1.72 0.00 0.00 179.24 177.36 3hjt h SER 171 N -0.92 0.44 0.36 6.45 0.87 -1.41 0.62 113.55 119.97 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 0.71 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 62.58 3hjt h SER 171 CO 0.01 0.29 -0.17 1.88 -0.53 0.00 0.00 176.83 178.30 3hjt h TYR 172 N 0.50 -0.45 -0.12 2.24 0.05 -1.61 -2.06 116.97 115.52 3hjt h TYR 172 Ca 0.24 -0.01 -0.06 0.00 0.05 0.00 0.00 58.73 58.94 3hjt h TYR 172 Cb 0.29 0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.17 3hjt h TYR 172 CO -0.00 -0.12 -0.20 1.79 -1.05 0.00 0.00 178.16 178.58 3hjt h THR 173 N -0.89 1.21 -0.39 -2.88 1.35 -1.21 -0.65 112.91 109.44 3hjt h THR 173 Ca -0.05 -0.94 -0.05 0.00 -0.55 0.00 0.00 66.41 64.82 3hjt h THR 173 Cb 0.54 1.34 -0.02 0.00 -1.73 0.00 0.00 68.15 68.28 3hjt h THR 173 CO 0.08 0.29 0.06 0.50 -0.25 0.00 0.00 175.52 176.20 3hjt h LYS 174 N 0.19 0.66 -0.00 4.72 3.64 0.25 -2.18 116.57 123.84 3hjt h LYS 174 Ca 0.04 -0.18 -0.20 0.00 -1.27 0.00 0.00 60.65 59.03 3hjt h LYS 174 Cb 0.47 -0.07 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 3hjt h LYS 174 CO 0.03 0.71 -0.87 0.87 -2.27 0.00 0.00 179.45 177.92 3hjt h LYS 175 N 0.50 0.26 0.00 1.90 1.57 -1.19 -3.00 116.57 116.61 3hjt h LYS 175 Ca 0.12 -0.28 -0.02 0.00 -1.87 0.00 0.00 60.65 58.60 3hjt h LYS 175 Cb 0.38 0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.76 3hjt h LYS 175 CO 0.01 0.99 -0.09 0.00 -0.57 0.00 0.00 179.45 179.79 3hjt h ALA 176 N 0.92 1.08 -0.27 3.86 0.00 -1.01 -1.52 119.26 122.32 3hjt h ALA 176 Ca -0.05 -0.08 -0.19 0.00 0.00 0.00 0.00 54.91 54.59 3hjt h ALA 176 Cb 1.50 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.27 3hjt h ALA 176 CO 0.14 0.11 -0.58 0.87 0.00 0.00 0.00 179.25 179.79 3hjt h LYS 177 N 0.00 0.86 0.31 0.00 1.79 -1.25 -2.35 116.57 115.93 3hjt h LYS 177 Ca -0.00 -0.57 -0.02 0.00 -2.18 0.00 0.00 60.65 57.89 3hjt h LYS 177 Cb 0.45 0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.18 3hjt h LYS 177 CO 0.01 1.20 -0.15 0.00 -1.08 0.00 0.00 179.45 179.43 3hjt h ALA 178 N 0.68 -0.41 -0.13 3.86 0.00 -1.28 -0.56 119.26 121.42 3hjt h ALA 178 Ca 0.00 -0.17 0.05 0.00 0.00 0.00 0.00 54.91 54.80 3hjt h ALA 178 Cb 1.19 0.16 -0.06 0.00 0.00 0.00 0.00 17.79 19.09 3hjt h ALA 178 CO 0.13 -0.61 -0.25 0.35 0.00 0.00 0.00 179.25 178.87 3hjt h PHE 179 N -0.66 -0.67 -0.98 0.00 3.57 -1.37 0.18 116.94 117.01 3hjt h PHE 179 Ca -0.04 0.03 0.06 0.00 3.53 0.00 0.00 57.97 61.55 3hjt h PHE 179 Cb 0.47 0.32 -0.06 0.00 2.79 0.00 0.00 35.95 39.46 3hjt h PHE 179 CO 0.01 -0.33 0.63 -0.22 -2.23 0.00 0.00 178.31 176.17 3hjt h LYS 180 N -0.31 1.13 0.42 1.11 3.64 -1.46 -1.32 116.57 119.78 3hjt h LYS 180 Ca 0.10 -0.07 -0.02 0.00 -1.27 0.00 0.00 60.65 59.39 3hjt h LYS 180 Cb 0.47 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 3hjt h LYS 180 CO -0.31 0.75 -0.20 -0.22 -2.27 0.00 0.00 179.45 177.19 3hjt h LYS 181 N 1.16 -0.54 -0.12 1.90 1.63 0.41 -2.16 116.57 118.86 3hjt h LYS 181 Ca 0.41 0.04 0.03 0.00 -0.85 0.00 0.00 60.65 60.28 3hjt h LYS 181 Cb 0.12 0.12 -0.00 0.00 -0.60 0.00 0.00 32.23 31.87 3hjt h LYS 181 CO -0.16 -0.34 0.10 0.93 -3.45 0.00 0.00 179.45 176.53 3hjt h GLU 182 N -0.61 0.00 -0.22 1.90 5.08 -0.43 -1.38 114.58 118.92 3hjt h GLU 182 Ca -0.06 0.00 -0.18 0.00 -1.00 0.00 0.00 59.36 58.12 3hjt h GLU 182 Cb 0.46 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 3hjt h GLU 182 CO 0.09 0.00 -0.60 0.00 -1.00 0.00 0.00 179.01 177.51 3hjt h ALA 183 N 1.91 0.52 -0.26 3.43 0.00 -0.83 -2.07 119.26 121.96 3hjt h ALA 183 Ca 0.05 -0.53 -0.09 0.00 0.00 0.00 0.00 54.91 54.34 3hjt h ALA 183 Cb 0.25 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3hjt h ALA 183 CO -0.00 0.69 -0.18 0.93 0.00 0.00 0.00 179.25 180.69 3hjt h GLU 184 N 0.55 0.59 -0.76 0.00 4.39 -0.65 -1.48 114.58 117.21 3hjt h GLU 184 Ca -0.00 -0.28 0.07 0.00 0.34 0.00 0.00 59.36 59.49 3hjt h GLU 184 Cb 1.19 -0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.77 3hjt h GLU 184 CO 0.12 0.86 0.44 1.96 -1.16 0.00 0.00 179.01 181.23 3hjt h GLN 185 N 0.31 0.75 -0.51 2.33 4.20 -1.37 0.22 115.11 121.05 3hjt h GLN 185 Ca 0.05 -0.05 -0.10 0.00 0.06 0.00 0.00 58.65 58.62 3hjt h GLN 185 Cb 0.72 -0.17 -0.02 0.00 0.30 0.00 0.00 27.48 28.31 3hjt h GLN 185 CO 0.05 0.50 -0.08 1.25 -0.67 0.00 0.00 178.83 179.88 3hjt h LEU 186 N 0.77 0.95 -0.27 1.46 5.85 -1.28 -0.33 115.31 122.46 3hjt h LEU 186 Ca 0.35 -0.34 -0.01 0.00 0.84 0.00 0.00 57.88 58.72 3hjt h LEU 186 Cb 0.26 -0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 3hjt h LEU 186 CO -0.21 1.07 0.12 0.74 -0.34 0.00 0.00 178.44 179.82 3hjt h THR 187 N 0.81 1.16 -0.58 1.05 2.02 -0.37 -1.39 112.91 115.62 3hjt h THR 187 Ca 0.13 -0.48 -0.05 0.00 0.77 0.00 0.00 66.41 66.79 3hjt h THR 187 Cb 0.63 0.97 -0.02 0.00 -1.74 0.00 0.00 68.15 67.99 3hjt h THR 187 CO 0.04 0.17 0.18 -0.33 0.37 0.00 0.00 175.52 175.95 3hjt h GLU 188 N 0.30 0.90 -0.32 6.66 5.08 -0.49 0.18 114.58 126.90 3hjt h GLU 188 Ca 0.09 -0.19 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 3hjt h GLU 188 Cb 0.15 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 3hjt h GLU 188 CO -0.01 0.81 0.18 1.49 -1.00 0.00 0.00 179.01 180.48 3hjt h GLU 189 N 0.81 0.37 0.00 2.33 4.81 -0.86 -2.76 114.58 119.28 3hjt h GLU 189 Ca 0.19 -0.02 -0.18 0.00 -0.13 0.00 0.00 59.36 59.21 3hjt h GLU 189 Cb 0.28 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.55 3hjt h GLU 189 CO -0.01 0.24 -1.04 1.88 -0.73 0.00 0.00 179.01 179.35 3hjt h TYR 190 N 0.38 0.00 0.00 0.92 -1.99 -1.10 -2.40 116.97 112.78 3hjt h TYR 190 Ca 0.13 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.84 3hjt h TYR 190 Cb 0.00 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.73 3hjt h TYR 190 CO -0.08 0.75 -0.06 1.79 -0.00 0.00 0.00 178.16 180.56 3hjt h THR 191 N 0.00 0.37 0.09 -2.88 1.35 -0.63 0.33 112.91 111.54 3hjt h THR 191 Ca -0.08 -0.35 -0.20 0.00 -0.55 0.00 0.00 66.41 65.23 3hjt h THR 191 Cb 1.65 1.25 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 3hjt h THR 191 CO 0.08 0.06 -0.97 -0.61 -0.25 0.00 0.00 175.52 173.84 3hjt h GLN 192 N 0.00 0.20 -0.62 4.72 5.75 -1.43 -3.14 115.11 120.58 3hjt h GLN 192 Ca -0.00 -0.34 -0.06 0.00 -0.15 0.00 0.00 58.65 58.10 3hjt h GLN 192 Cb 0.24 0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.89 3hjt h GLN 192 CO 0.01 1.16 0.16 0.87 -2.65 0.00 0.00 178.83 178.38 3hjt h LYS 193 N -0.51 0.99 0.00 1.69 1.57 -0.97 -2.63 116.57 116.71 3hjt h LYS 193 Ca -0.21 -0.23 -0.00 0.00 -1.87 0.00 0.00 60.65 58.34 3hjt h LYS 193 Cb 1.55 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 33.73 3hjt h LYS 193 CO 0.05 0.90 -0.01 0.74 -0.57 0.00 0.00 179.45 180.56 3hjt h PHE 194 N 0.91 0.00 0.00 -1.35 0.04 -1.10 -2.65 116.94 112.79 3hjt h PHE 194 Ca 0.20 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.97 3hjt h PHE 194 Cb 0.35 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.50 3hjt h PHE 194 CO 0.03 0.01 0.00 0.87 -0.60 0.00 0.00 178.31 178.61 3hjt h LYS 195 N 0.00 0.00 0.00 1.51 1.57 -1.41 -2.70 116.57 115.53 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 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 3hjt h LYS 195 CO 0.00 0.00 -0.78 1.63 -0.57 0.00 0.00 179.45 179.74 3hjt n LYS 196 N -2.67 0.18 -3.38 3.15 5.02 -1.00 -4.91 118.16 114.55 3hjt n LYS 196 Ca 0.03 0.02 -0.38 0.00 -2.02 0.00 0.00 58.31 55.96 3hjt n LYS 196 Cb 0.35 -1.58 -0.07 0.00 -0.02 0.00 0.00 35.03 33.71 3hjt n LYS 196 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3hjt s VAL 197 N -3.12 5.22 -0.06 -0.18 1.01 -1.02 -5.02 120.40 117.24 3hjt s VAL 197 Ca 0.07 0.80 -0.19 0.00 0.00 0.00 0.00 61.98 62.66 3hjt s VAL 197 Cb 0.15 -3.75 -0.13 0.00 0.00 0.00 0.00 36.38 32.65 3hjt s VAL 197 CO 0.76 0.32 0.75 0.03 0.00 0.00 0.00 175.10 176.96 3hjt h ARG 198 N 6.89 -0.25 -6.41 2.72 3.08 -1.86 -3.43 114.38 115.12 3hjt h ARG 198 Ca -0.40 0.02 -0.53 0.00 0.07 0.00 0.00 59.98 59.14 3hjt h ARG 198 Cb 1.17 0.06 0.03 0.00 0.08 0.00 0.00 29.97 31.30 3hjt h ARG 198 CO 0.75 0.12 1.17 -1.54 -1.07 0.00 0.00 179.97 179.40 3hjt s SER 199 N -5.39 6.46 0.00 7.04 1.04 -1.26 -4.87 113.70 116.72 3hjt s SER 199 Ca -0.11 2.68 0.00 0.00 0.48 0.00 0.00 55.95 59.00 3hjt s SER 199 Cb 0.00 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.58 3hjt s SER 199 CO 0.40 -1.02 0.68 0.29 0.98 0.00 0.00 173.24 174.57 3hjt n LYS 200 N 6.76 0.56 -4.71 4.02 4.01 -1.26 -4.85 118.16 122.69 3hjt n LYS 200 Ca 0.19 -0.87 -0.33 0.00 -0.51 0.00 0.00 58.31 56.78 3hjt n LYS 200 Cb 0.40 -0.99 -0.12 0.00 -0.51 0.00 0.00 35.03 33.81 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 -0.38 3.43 0.02 -0.18 2.01 -1.26 0.01 115.64 119.29 3hjt s THR 201 Ca 0.00 -0.57 -0.00 0.00 0.31 0.00 0.00 61.69 61.43 3hjt s THR 201 Cb 0.00 -2.40 -0.02 0.00 0.01 0.00 0.00 72.50 70.09 3hjt s THR 201 CO 0.00 0.57 -0.03 0.72 -0.69 0.00 0.00 174.62 175.20 3hjt s PHE 202 N -0.48 0.28 -0.23 4.92 -0.71 0.03 -4.85 117.98 116.93 3hjt s PHE 202 Ca 0.07 -0.57 -0.02 0.00 -1.04 0.00 0.00 56.93 55.37 3hjt s PHE 202 Cb -0.12 -0.21 0.02 0.00 -1.21 0.00 0.00 43.02 41.50 3hjt s PHE 202 CO 0.02 -0.21 -0.08 0.08 -1.34 0.00 0.00 175.22 173.69 3hjt s VAL 203 N -1.67 2.85 0.29 -2.49 1.01 -1.26 -1.38 120.40 117.76 3hjt s VAL 203 Ca -0.14 -0.91 0.07 0.00 0.00 0.00 0.00 61.98 60.99 3hjt s VAL 203 Cb -0.08 -2.38 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 3hjt s VAL 203 CO -0.02 0.29 0.31 0.42 0.00 0.00 0.00 175.10 176.10 3hjt s THR 204 N 1.35 4.32 0.19 3.92 -4.23 -0.44 -0.75 115.64 119.99 3hjt s THR 204 Ca 0.02 -1.23 -0.13 0.00 -1.18 0.00 0.00 61.69 59.17 3hjt s THR 204 Cb -0.16 -3.45 0.14 0.00 1.34 0.00 0.00 72.50 70.37 3hjt s THR 204 CO -0.05 -0.26 1.68 -0.61 -0.54 0.00 0.00 174.62 174.83 3hjt h GLN 205 N 1.25 0.11 -4.53 3.99 5.75 -1.38 -1.36 115.11 118.94 3hjt h GLN 205 Ca -0.48 -0.01 -0.24 0.00 -0.15 0.00 0.00 58.65 57.78 3hjt h GLN 205 Cb 1.24 -0.03 -0.14 0.00 1.07 0.00 0.00 27.48 29.62 3hjt h GLN 205 CO 0.59 0.07 -0.57 -3.38 -2.65 0.00 0.00 178.83 172.89 3hjt s HIS 206 N -6.17 1.13 -1.18 3.99 -3.43 -1.26 -1.21 115.29 107.17 3hjt s HIS 206 Ca -0.13 -1.35 -0.21 0.00 -0.80 0.00 0.00 55.06 52.57 3hjt s HIS 206 Cb 0.16 -0.51 -0.05 0.00 -1.43 0.00 0.00 32.58 30.75 3hjt s HIS 206 CO 0.72 -0.68 1.90 2.41 -2.00 0.00 0.00 174.74 177.09 3hjt n THR 207 N -0.30 2.48 -0.09 -5.38 -1.04 -0.36 -4.49 114.28 105.10 3hjt n THR 207 Ca 0.02 -2.53 0.00 0.00 -2.04 0.00 0.00 64.05 59.50 3hjt n THR 207 Cb 0.65 -2.25 0.00 0.00 -1.82 0.00 0.00 70.33 66.91 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 11.78 2.11 -1.59 2.41 0.00 -1.26 -4.36 120.51 129.60 3hjt n ALA 208 Ca 0.47 -0.34 0.05 0.00 0.00 0.00 0.00 53.44 53.61 3hjt n ALA 208 Cb 0.45 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.11 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 -0.20 0.15 -0.31 0.00 3.01 -1.26 -4.78 117.46 114.07 3hjt n PHE 209 Ca 0.00 -1.52 -0.05 0.00 1.01 0.00 0.00 57.45 56.89 3hjt n PHE 209 Cb 0.02 -0.28 0.07 0.00 -0.01 0.00 0.00 39.48 39.28 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 1.00 1.09 0.21 4.37 4.64 -1.86 -0.37 113.55 122.63 3hjt h SER 210 Ca 0.03 -0.13 -0.26 0.00 -0.47 0.00 0.00 61.79 60.96 3hjt h SER 210 Cb 1.08 -0.28 0.01 0.00 -0.31 0.00 0.00 62.40 62.91 3hjt h SER 210 CO 0.05 0.91 -1.07 1.88 -0.87 0.00 0.00 176.83 177.74 3hjt h TYR 211 N 1.18 0.83 -0.39 4.77 0.05 -1.87 -1.83 116.97 119.71 3hjt h TYR 211 Ca 0.29 -0.48 -0.07 0.00 0.05 0.00 0.00 58.73 58.52 3hjt h TYR 211 Cb 0.11 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 37.76 3hjt h TYR 211 CO 0.01 1.31 -0.02 1.25 -1.05 0.00 0.00 178.16 179.67 3hjt h LEU 212 N 0.28 0.68 -0.89 3.88 6.46 -1.72 -0.49 115.31 123.51 3hjt h LEU 212 Ca -0.12 -0.32 -0.06 0.00 -0.12 0.00 0.00 57.88 57.26 3hjt h LEU 212 Cb 1.72 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 41.44 3hjt h LEU 212 CO 0.20 0.84 0.12 0.00 -0.62 0.00 0.00 178.44 178.97 3hjt h ALA 213 N 0.87 1.09 -0.04 1.25 0.00 -1.12 -2.76 119.26 118.55 3hjt h ALA 213 Ca 0.11 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 3hjt h ALA 213 Cb 0.50 -0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 3hjt h ALA 213 CO 0.02 0.60 0.02 -0.22 0.00 0.00 0.00 179.25 179.67 3hjt h LYS 214 N 0.89 0.05 0.00 0.00 3.64 -1.04 0.40 116.57 120.52 3hjt h LYS 214 Ca 0.19 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.56 3hjt h LYS 214 Cb 0.36 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.17 3hjt h LYS 214 CO 0.00 0.17 0.00 -0.09 -2.27 0.00 0.00 179.45 177.26 3hjt h ARG 215 N -0.07 0.00 -0.17 1.90 2.43 -0.92 -2.96 114.38 114.59 3hjt h ARG 215 Ca 0.01 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.18 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 -0.00 0.00 0.00 1.19 -1.51 0.00 0.00 179.97 179.65 3hjt n PHE 216 N -2.59 0.40 -3.18 2.20 3.72 -1.06 -4.92 117.46 112.03 3hjt n PHE 216 Ca 0.00 -0.70 -0.17 0.00 -0.05 0.00 0.00 57.45 56.53 3hjt n PHE 216 Cb 0.20 -0.14 0.05 0.00 -0.94 0.00 0.00 39.48 38.66 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 -0.39 -0.14 3.73 1.37 0.00 -0.89 -4.82 105.19 104.05 3hjt n GLY 217 Ca 0.13 -0.03 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 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 -5.41 3.02 -0.05 0.99 1.43 0.14 -4.95 118.68 113.84 3hjt s LEU 218 Ca 0.38 -1.16 0.04 0.00 -1.03 0.00 0.00 54.13 52.36 3hjt s LEU 218 Cb -0.17 -1.31 -0.00 0.00 0.03 0.00 0.00 46.19 44.74 3hjt s LEU 218 CO 0.47 -0.58 -0.18 -0.54 0.23 0.00 0.00 176.35 175.75 3hjt s LYS 219 N -3.90 1.92 0.06 1.70 1.02 0.10 -4.34 119.74 116.31 3hjt s LYS 219 Ca 0.38 -0.63 0.06 0.00 0.02 0.00 0.00 55.97 55.80 3hjt s LYS 219 Cb 0.04 -1.63 -0.03 0.00 -0.52 0.00 0.00 37.83 35.69 3hjt s LYS 219 CO 0.21 0.22 -0.17 1.14 -0.92 0.00 0.00 175.35 175.83 3hjt s GLN 220 N 0.12 1.06 -0.06 1.68 1.03 -1.26 -0.79 119.66 121.45 3hjt s GLN 220 Ca -0.06 -0.94 0.01 0.00 0.04 0.00 0.00 55.36 54.40 3hjt s GLN 220 Cb -0.13 -1.16 0.02 0.00 0.03 0.00 0.00 33.01 31.77 3hjt s GLN 220 CO 0.03 0.28 -0.05 -1.17 -2.54 0.00 0.00 175.29 171.84 3hjt s LEU 221 N -1.46 1.22 -0.05 2.60 2.96 -0.48 -4.96 118.68 118.51 3hjt s LEU 221 Ca 0.03 -0.15 -0.12 0.00 -0.22 0.00 0.00 54.13 53.67 3hjt s LEU 221 Cb -0.09 -0.52 -0.05 0.00 0.50 0.00 0.00 46.19 46.03 3hjt s LEU 221 CO 0.02 -0.07 0.31 -0.83 -1.32 0.00 0.00 176.35 174.45 3hjt s GLY 222 N 1.13 2.35 0.18 7.98 0.00 -1.26 -1.33 107.32 116.37 3hjt s GLY 222 Ca -0.07 -0.38 -0.08 0.00 0.00 0.00 0.00 44.72 44.18 3hjt s GLY 222 CO -0.01 -0.02 1.60 -2.22 0.00 0.00 0.00 173.10 172.45 3hjt h ILE 223 N 3.87 1.27 -2.00 0.90 2.04 -1.04 -3.44 117.51 119.10 3hjt h ILE 223 Ca -0.52 -1.31 -0.56 0.00 1.00 0.00 0.00 64.86 63.47 3hjt h ILE 223 Cb 1.22 1.07 -0.09 0.00 -0.74 0.00 0.00 36.82 38.28 3hjt h ILE 223 CO 0.61 0.45 -0.60 -0.44 0.00 0.00 0.00 178.15 178.18 3hjt s SER 224 N -6.70 4.48 0.00 1.72 0.01 -0.35 -4.03 113.70 108.83 3hjt s SER 224 Ca -0.11 -0.80 0.00 0.00 1.31 0.00 0.00 55.95 56.35 3hjt s SER 224 Cb 0.13 -0.70 0.00 0.00 0.21 0.00 0.00 66.02 65.65 3hjt s SER 224 CO 0.86 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.94 3hjt n GLY 225 N -1.00 -1.79 0.43 3.44 0.00 0.21 -1.22 105.19 105.26 3hjt n GLY 225 Ca -0.04 -1.41 0.24 0.00 0.00 0.00 0.00 46.02 44.81 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 -0.38 0.61 -3.81 -0.61 1.08 -1.90 -1.08 117.51 111.43 3hjt h ILE 226 Ca 0.00 -0.05 -0.68 0.00 -0.39 0.00 0.00 64.86 63.74 3hjt h ILE 226 Cb 0.00 0.45 -0.20 0.00 -3.07 0.00 0.00 36.82 34.00 3hjt h ILE 226 CO 0.00 0.03 -0.76 -0.55 -0.69 0.00 0.00 178.15 176.18 3hjt s SER 227 N -5.69 4.15 0.21 1.72 0.15 -1.26 -4.69 113.70 108.29 3hjt s SER 227 Ca -0.06 -0.32 0.18 0.00 0.70 0.00 0.00 55.95 56.45 3hjt s SER 227 Cb 0.22 -0.80 0.85 0.00 -1.71 0.00 0.00 66.02 64.57 3hjt s SER 227 CO 0.77 0.26 1.55 -2.65 1.20 0.00 0.00 173.24 174.37 3hjt n PRO 228 N 1.49 0.12 0.13 5.44 -0.02 -1.26 -1.60 135.00 139.30 3hjt n PRO 228 Ca -0.16 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 61.82 3hjt n PRO 228 Cb 0.52 -1.80 0.05 0.00 -0.02 0.00 0.00 33.50 32.26 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 -4.24 -0.52 5.08 -1.95 -3.37 114.58 109.58 3hjt h GLU 229 Ca 0.00 0.00 -0.70 0.00 -1.00 0.00 0.00 59.36 57.66 3hjt h GLU 229 Cb 0.16 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 3hjt h GLU 229 CO 0.00 0.62 2.94 1.04 -1.00 0.00 0.00 179.01 182.61 3hjt n GLN 230 N -3.35 2.73 -2.66 2.33 6.02 -0.62 -4.95 117.38 116.88 3hjt n GLN 230 Ca 0.01 -2.58 -0.34 0.00 -0.01 0.00 0.00 57.00 54.08 3hjt n GLN 230 Cb 0.74 -3.28 -0.05 0.00 1.02 0.00 0.00 30.24 28.68 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 3.52 4.04 0.49 -1.09 2.02 -1.26 -0.62 118.70 125.81 3hjt s GLU 231 Ca 0.49 1.29 -0.20 0.00 0.02 0.00 0.00 54.97 56.57 3hjt s GLU 231 Cb 0.13 -2.21 -0.08 0.00 0.10 0.00 0.00 34.13 32.07 3hjt s GLU 231 CO -0.05 -0.22 1.03 -1.25 0.02 0.00 0.00 175.26 174.79 3hjt s PRO 232 N -3.07 3.79 0.73 0.39 0.04 -1.26 -4.94 135.00 130.68 3hjt s PRO 232 Ca 0.63 1.29 -0.07 0.00 0.04 0.00 0.00 61.00 62.89 3hjt s PRO 232 Cb -0.14 -2.10 0.07 0.00 0.04 0.00 0.00 34.50 32.37 3hjt s PRO 232 CO 0.18 -0.43 1.04 -1.54 0.04 0.00 0.00 177.00 176.30 3hjt s SER 233 N -2.16 4.67 0.47 6.66 1.04 -1.26 -4.83 113.70 118.28 3hjt s SER 233 Ca 0.66 0.42 0.17 0.00 0.48 0.00 0.00 55.95 57.68 3hjt s SER 233 Cb -0.15 -1.01 1.16 0.00 0.10 0.00 0.00 66.02 66.12 3hjt s SER 233 CO 0.22 -1.70 2.01 -0.65 0.98 0.00 0.00 173.24 174.10 3hjt h PRO 234 N -0.69 0.23 0.11 4.02 0.11 -1.99 -0.76 132.00 133.04 3hjt h PRO 234 Ca -0.44 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.65 3hjt h PRO 234 Cb 1.31 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.37 3hjt h PRO 234 CO 0.58 0.16 -0.05 -0.09 -0.21 0.00 0.00 178.00 178.38 3hjt h ARG 235 N 0.24 -0.14 0.00 1.05 2.43 -2.00 -2.51 114.38 113.44 3hjt h ARG 235 Ca 0.22 0.01 -0.04 0.00 -0.81 0.00 0.00 59.98 59.36 3hjt h ARG 235 Cb 0.56 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.14 3hjt h ARG 235 CO -0.04 0.01 -0.18 1.96 -1.51 0.00 0.00 179.97 180.20 3hjt h GLN 236 N -0.27 0.00 -0.51 0.20 4.20 -1.68 -1.90 115.11 115.16 3hjt h GLN 236 Ca -0.02 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.62 3hjt h GLN 236 Cb 0.22 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 27.97 3hjt h GLN 236 CO 0.02 0.18 0.01 -0.07 -0.67 0.00 0.00 178.83 178.31 3hjt h LEU 237 N 0.00 0.82 -0.35 1.46 3.38 -0.81 -0.99 115.31 118.81 3hjt h LEU 237 Ca -0.00 -0.20 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 3hjt h LEU 237 Cb 0.51 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 3hjt h LEU 237 CO 0.02 0.88 -0.11 0.11 0.09 0.00 0.00 178.44 179.42 3hjt h LYS 238 N 0.79 0.70 -0.48 1.13 1.57 -0.94 -1.50 116.57 117.84 3hjt h LYS 238 Ca 0.15 -0.28 -0.01 0.00 -1.87 0.00 0.00 60.65 58.64 3hjt h LYS 238 Cb 0.46 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 3hjt h LYS 238 CO 0.02 0.88 0.24 0.93 -0.57 0.00 0.00 179.45 180.95 3hjt h GLU 239 N 0.49 0.66 -0.18 3.15 5.08 -1.06 -0.53 114.58 122.19 3hjt h GLU 239 Ca 0.09 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.26 3hjt h GLU 239 Cb 0.63 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.75 3hjt h GLU 239 CO 0.04 0.50 -0.35 0.82 -1.00 0.00 0.00 179.01 179.02 3hjt h ILE 240 N 0.66 1.34 -0.37 3.13 2.04 -0.99 -1.65 117.51 121.68 3hjt h ILE 240 Ca 0.17 -1.59 -0.05 0.00 1.00 0.00 0.00 64.86 64.39 3hjt h ILE 240 Cb 0.05 1.92 -0.02 0.00 -0.74 0.00 0.00 36.82 38.03 3hjt h ILE 240 CO -0.03 0.49 0.03 1.56 0.00 0.00 0.00 178.15 180.20 3hjt h GLN 241 N 0.20 0.57 0.00 2.37 4.20 -0.80 0.34 115.11 121.99 3hjt h GLN 241 Ca 0.01 -0.12 -0.11 0.00 0.06 0.00 0.00 58.65 58.49 3hjt h GLN 241 Cb 0.95 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 28.63 3hjt h GLN 241 CO 0.08 0.57 -0.52 -0.44 -0.67 0.00 0.00 178.83 177.85 3hjt h ASP 242 N 0.55 0.00 -0.10 1.46 3.32 -1.02 -2.13 116.42 118.49 3hjt h ASP 242 Ca 0.12 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 3hjt h ASP 242 Cb 0.30 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 3hjt h ASP 242 CO 0.01 0.52 -0.14 0.15 -1.72 0.00 0.00 179.24 178.05 3hjt h PHE 243 N 0.00 0.34 -0.66 4.55 3.04 -0.30 -0.42 116.94 123.50 3hjt h PHE 243 Ca -0.01 -0.11 0.03 0.00 3.98 0.00 0.00 57.97 61.86 3hjt h PHE 243 Cb 0.95 -0.07 -0.04 0.00 2.56 0.00 0.00 35.95 39.36 3hjt h PHE 243 CO 0.00 0.73 0.44 0.28 -2.02 0.00 0.00 178.31 177.74 3hjt h VAL 244 N -0.14 1.10 0.02 1.41 2.07 -0.81 -1.05 116.25 118.85 3hjt h VAL 244 Ca 0.01 -0.28 -0.14 0.00 0.82 0.00 0.00 66.70 67.11 3hjt h VAL 244 Cb 0.69 0.23 0.01 0.00 -1.52 0.00 0.00 31.29 30.70 3hjt h VAL 244 CO 0.03 0.15 -0.57 0.11 0.02 0.00 0.00 177.57 177.31 3hjt h LYS 245 N 0.80 0.35 0.42 1.57 1.57 -1.33 0.52 116.57 120.47 3hjt h LYS 245 Ca 0.26 -0.40 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 3hjt h LYS 245 Cb 0.05 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.49 3hjt h LYS 245 CO -0.07 1.10 -0.20 1.49 -0.57 0.00 0.00 179.45 181.19 3hjt h GLU 246 N -0.23 -0.54 -0.00 3.15 4.81 -0.84 -2.68 114.58 118.26 3hjt h GLU 246 Ca -0.08 0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 3hjt h GLU 246 Cb 1.32 0.12 0.00 0.00 0.63 0.00 0.00 28.75 30.82 3hjt h GLU 246 CO 0.11 -0.31 -0.01 0.66 -0.73 0.00 0.00 179.01 178.73 3hjt n TYR 247 N -5.30 0.00 -3.63 0.92 4.01 -0.42 -4.92 117.16 107.83 3hjt n TYR 247 Ca -0.11 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.40 3hjt n TYR 247 Cb 0.26 -0.06 0.06 0.00 -0.31 0.00 0.00 39.34 39.29 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 -0.95 -3.85 -4.75 7.72 5.15 -0.71 -4.92 115.26 112.95 3hjt n ASN 248 Ca 0.21 -0.66 -0.41 0.00 -0.60 0.00 0.00 54.58 53.12 3hjt n ASN 248 Cb 0.16 -4.67 -0.03 0.00 -0.53 0.00 0.00 39.78 34.71 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 -3.39 3.19 -0.25 3.44 1.01 0.17 -4.93 120.40 119.65 3hjt s VAL 249 Ca 0.32 1.04 0.03 0.00 0.00 0.00 0.00 61.98 63.37 3hjt s VAL 249 Cb -0.15 -3.66 0.07 0.00 0.00 0.00 0.00 36.38 32.63 3hjt s VAL 249 CO 0.76 0.18 0.99 0.29 0.00 0.00 0.00 175.10 177.32 3hjt n LYS 250 N 2.14 2.39 -3.72 2.72 4.76 -1.26 -4.78 118.16 120.42 3hjt n LYS 250 Ca 0.04 -1.48 -0.15 0.00 -2.87 0.00 0.00 58.31 53.85 3hjt n LYS 250 Cb 0.43 -1.06 -0.15 0.00 -1.84 0.00 0.00 35.03 32.41 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 -0.88 -0.13 -0.29 -0.18 2.01 -1.26 -2.20 115.64 112.72 3hjt s THR 251 Ca 0.05 0.25 -0.06 0.00 0.31 0.00 0.00 61.69 62.24 3hjt s THR 251 Cb 0.03 -0.26 0.01 0.00 0.01 0.00 0.00 72.50 72.29 3hjt s THR 251 CO 0.04 0.10 0.07 -0.63 -0.69 0.00 0.00 174.62 173.51 3hjt s ILE 252 N 1.60 3.86 -0.74 1.82 1.01 -0.78 -4.00 121.20 123.98 3hjt s ILE 252 Ca -0.04 -0.73 -0.24 0.00 0.00 0.00 0.00 60.65 59.63 3hjt s ILE 252 Cb -0.12 -2.99 0.06 0.00 0.01 0.00 0.00 42.46 39.42 3hjt s ILE 252 CO -0.06 0.09 1.13 -0.36 0.00 0.00 0.00 174.94 175.74 3hjt s PHE 253 N 1.48 2.54 1.04 3.97 0.08 0.07 -2.44 117.98 124.72 3hjt s PHE 253 Ca 0.02 -0.43 -0.16 0.00 0.12 0.00 0.00 56.93 56.48 3hjt s PHE 253 Cb -0.17 -4.45 0.22 0.00 -0.57 0.00 0.00 43.02 38.04 3hjt s PHE 253 CO 0.02 -1.83 1.18 0.00 -0.10 0.00 0.00 175.22 174.49 3hjt s ALA 254 N 4.69 1.43 0.03 5.36 0.00 0.62 -1.03 121.76 132.86 3hjt s ALA 254 Ca 0.30 -0.89 -0.01 0.00 0.00 0.00 0.00 51.96 51.36 3hjt s ALA 254 Cb -0.11 -2.90 -0.02 0.00 0.00 0.00 0.00 23.12 20.08 3hjt s ALA 254 CO 0.09 -2.86 -0.01 -1.83 0.00 0.00 0.00 175.76 171.16 3hjt s GLU 255 N -5.50 0.42 0.25 0.00 -1.05 -1.26 -1.92 118.70 109.63 3hjt s GLU 255 Ca 0.70 -0.76 -0.06 0.00 -0.15 0.00 0.00 54.97 54.70 3hjt s GLU 255 Cb -0.10 0.15 0.26 0.00 -0.44 0.00 0.00 34.13 34.00 3hjt s GLU 255 CO 0.54 -0.08 1.87 -0.44 0.95 0.00 0.00 175.26 178.11 3hjt h ASP 256 N 4.18 1.08 0.05 0.83 3.32 -1.98 -2.95 116.42 120.95 3hjt h ASP 256 Ca -0.32 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.64 3hjt h ASP 256 Cb 1.19 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.46 3hjt h ASP 256 CO 0.48 0.86 0.00 0.59 -1.72 0.00 0.00 179.24 179.45 3hjt n ASN 257 N -4.34 0.00 -3.73 6.45 5.03 -1.26 -4.73 115.26 112.69 3hjt n ASN 257 Ca 0.09 0.05 -0.14 0.00 0.87 0.00 0.00 54.58 55.45 3hjt n ASN 257 Cb 0.09 -0.16 -0.09 0.00 -1.02 0.00 0.00 39.78 38.60 3hjt n ASN 257 CO 0.00 0.00 0.00 0.54 -1.83 0.00 0.00 177.26 175.97 3hjt s VAL 258 N -2.32 0.03 -0.12 2.41 0.11 -1.11 -4.85 120.40 114.54 3hjt s VAL 258 Ca 0.06 -0.21 -0.37 0.00 -2.93 0.00 0.00 61.98 58.53 3hjt s VAL 258 Cb 0.04 -0.63 -0.14 0.00 -1.53 0.00 0.00 36.38 34.12 3hjt s VAL 258 CO 0.07 -0.12 1.74 -3.20 -3.33 0.00 0.00 175.10 170.26 3hjt n ASN 259 N 1.97 2.79 -0.28 3.54 2.85 -1.26 -4.50 115.26 120.36 3hjt n ASN 259 Ca -0.17 1.04 0.07 0.00 -0.11 0.00 0.00 54.58 55.40 3hjt n ASN 259 Cb 0.57 -1.26 0.29 0.00 1.24 0.00 0.00 39.78 40.62 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 5.35 1.37 -0.03 1.20 -0.04 -1.26 -4.29 135.00 137.31 3hjt n PRO 260 Ca 0.23 -0.56 -0.10 0.00 -0.04 0.00 0.00 63.50 63.03 3hjt n PRO 260 Cb 0.22 -1.25 -0.03 0.00 -0.04 0.00 0.00 33.50 32.39 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 1.02 -0.34 -0.56 0.54 3.64 -1.99 0.80 116.57 119.68 3hjt h LYS 261 Ca 0.00 0.02 -0.10 0.00 -1.27 0.00 0.00 60.65 59.30 3hjt h LYS 261 Cb 0.23 0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 32.11 3hjt h LYS 261 CO 0.00 -0.23 -0.05 0.97 -2.27 0.00 0.00 179.45 177.87 3hjt h ILE 262 N -0.36 1.27 -0.68 2.00 2.10 -2.00 -1.17 117.51 118.67 3hjt h ILE 262 Ca 0.11 -1.19 0.09 0.00 1.08 0.00 0.00 64.86 64.95 3hjt h ILE 262 Cb 0.54 0.91 -0.07 0.00 -1.09 0.00 0.00 36.82 37.10 3hjt h ILE 262 CO -0.39 0.43 0.33 0.00 -1.08 0.00 0.00 178.15 177.43 3hjt h ALA 263 N 0.95 0.93 -0.20 0.18 0.00 -1.43 -1.75 119.26 117.95 3hjt h ALA 263 Ca 0.15 0.06 -0.13 0.00 0.00 0.00 0.00 54.91 54.99 3hjt h ALA 263 Cb 0.61 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 3hjt h ALA 263 CO 0.04 -0.07 -0.42 0.45 0.00 0.00 0.00 179.25 179.26 3hjt h HIS 264 N 0.57 0.55 -0.00 0.00 3.86 0.89 -2.63 115.15 118.38 3hjt h HIS 264 Ca 0.33 -0.16 -0.00 0.00 -1.16 0.00 0.00 60.37 59.39 3hjt h HIS 264 Cb 0.35 -0.12 -0.00 0.00 1.06 0.00 0.00 27.41 28.70 3hjt h HIS 264 CO -0.12 0.81 0.00 0.00 0.86 0.00 0.00 177.93 179.48 3hjt h ALA 265 N 1.17 0.00 -0.86 2.45 0.00 -0.38 -0.23 119.26 121.42 3hjt h ALA 265 Ca 0.03 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 54.93 3hjt h ALA 265 Cb 0.89 -0.00 -0.05 0.00 0.00 0.00 0.00 17.79 18.63 3hjt h ALA 265 CO 0.08 -0.45 0.55 0.82 0.00 0.00 0.00 179.25 180.25 3hjt h ILE 266 N -0.09 1.14 -0.30 0.00 2.04 -1.39 -1.27 117.51 117.63 3hjt h ILE 266 Ca 0.00 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.52 3hjt h ILE 266 Cb 0.10 -0.03 -0.03 0.00 -0.74 0.00 0.00 36.82 36.11 3hjt h ILE 266 CO -0.00 0.20 0.11 0.00 0.00 0.00 0.00 178.15 178.45 3hjt h ALA 267 N 1.36 0.35 -0.69 1.87 0.00 -1.06 0.02 119.26 121.09 3hjt h ALA 267 Ca 0.34 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.25 3hjt h ALA 267 Cb 0.01 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3hjt h ALA 267 CO -0.12 -0.29 0.31 0.87 0.00 0.00 0.00 179.25 180.02 3hjt h LYS 268 N 0.24 1.02 0.00 0.00 1.57 -0.44 0.07 116.57 119.03 3hjt h LYS 268 Ca 0.13 -0.17 -0.03 0.00 -1.87 0.00 0.00 60.65 58.72 3hjt h LYS 268 Cb 0.10 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.23 3hjt h LYS 268 CO -0.14 0.82 -0.13 0.66 -0.57 0.00 0.00 179.45 180.09 3hjt h SER 269 N 0.98 0.00 -0.21 0.86 4.64 -0.85 -3.27 113.55 115.70 3hjt h SER 269 Ca 0.23 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.55 3hjt h SER 269 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3hjt h SER 269 CO -0.02 0.13 0.00 0.35 -0.87 0.00 0.00 176.83 176.42 3hjt n THR 270 N -3.17 0.59 -2.51 2.95 -2.24 -0.04 -5.00 114.28 104.86 3hjt n THR 270 Ca 0.02 -0.80 -0.09 0.00 -2.27 0.00 0.00 64.05 60.91 3hjt n THR 270 Cb 0.50 0.80 0.01 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 0.54 0.15 3.67 3.38 0.00 -0.64 -4.87 105.19 107.42 3hjt n GLY 271 Ca 0.09 -0.42 -0.25 0.00 0.00 0.00 0.00 46.02 45.44 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 -2.74 3.36 0.16 4.61 0.00 -0.08 -4.95 121.76 122.12 3hjt s ALA 272 Ca 0.11 -2.07 0.07 0.00 0.00 0.00 0.00 51.96 50.06 3hjt s ALA 272 Cb -0.05 -0.30 -0.04 0.00 0.00 0.00 0.00 23.12 22.73 3hjt s ALA 272 CO 0.13 -0.05 0.02 0.15 0.00 0.00 0.00 175.76 176.01 3hjt s LYS 273 N -3.79 2.50 -0.12 0.00 1.02 -0.93 -4.36 119.74 114.06 3hjt s LYS 273 Ca 0.37 -1.02 -0.11 0.00 0.02 0.00 0.00 55.97 55.24 3hjt s LYS 273 Cb 0.03 -2.43 -0.05 0.00 -0.52 0.00 0.00 37.83 34.86 3hjt s LYS 273 CO 0.20 0.47 0.22 0.08 -0.92 0.00 0.00 175.35 175.41 3hjt s VAL 274 N -1.65 5.35 0.34 3.17 1.01 -1.26 -1.86 120.40 125.50 3hjt s VAL 274 Ca 0.28 0.40 0.05 0.00 0.00 0.00 0.00 61.98 62.71 3hjt s VAL 274 Cb -0.10 -3.52 -0.03 0.00 0.00 0.00 0.00 36.38 32.73 3hjt s VAL 274 CO 0.19 0.53 0.20 -0.54 0.00 0.00 0.00 175.10 175.48 3hjt s LYS 275 N -0.47 1.73 -0.14 2.72 -0.14 -1.02 -4.96 119.74 117.45 3hjt s LYS 275 Ca 0.16 -2.02 -0.00 0.00 -1.36 0.00 0.00 55.97 52.75 3hjt s LYS 275 Cb -0.13 -0.06 -0.01 0.00 -1.68 0.00 0.00 37.83 35.95 3hjt s LYS 275 CO 0.05 -0.53 -0.13 0.99 -0.76 0.00 0.00 175.35 174.96 3hjt s THR 276 N -3.46 2.94 -0.21 2.17 2.01 -1.26 -0.28 115.64 117.55 3hjt s THR 276 Ca 0.34 -0.69 -0.02 0.00 0.31 0.00 0.00 61.69 61.63 3hjt s THR 276 Cb 0.03 -2.24 0.06 0.00 0.01 0.00 0.00 72.50 70.37 3hjt s THR 276 CO 0.20 0.52 0.01 -0.22 -0.69 0.00 0.00 174.62 174.44 3hjt s LEU 277 N 0.55 1.64 -0.10 4.42 1.98 -0.81 -4.94 118.68 121.41 3hjt s LEU 277 Ca -0.09 -0.96 -0.21 0.00 -2.89 0.00 0.00 54.13 49.99 3hjt s LEU 277 Cb -0.16 -0.78 -0.04 0.00 0.66 0.00 0.00 46.19 45.87 3hjt s LEU 277 CO 0.04 -0.29 0.60 -0.55 -1.89 0.00 0.00 176.35 174.26 3hjt s SER 278 N 1.71 6.84 -0.01 3.68 0.15 -1.26 -4.56 113.70 120.26 3hjt s SER 278 Ca -0.02 1.01 0.03 0.00 0.70 0.00 0.00 55.95 57.67 3hjt s SER 278 Cb -0.18 -2.36 0.10 0.00 -1.71 0.00 0.00 66.02 61.87 3hjt s SER 278 CO -0.08 -0.08 0.98 -0.81 1.20 0.00 0.00 173.24 174.45 3hjt n PRO 279 N 3.83 1.31 -2.51 5.44 -0.04 -1.26 -4.87 135.00 136.89 3hjt n PRO 279 Ca -0.04 -0.39 -0.18 0.00 -0.04 0.00 0.00 63.50 62.86 3hjt n PRO 279 Cb 0.51 -1.20 -0.00 0.00 -0.04 0.00 0.00 33.50 32.77 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 -0.13 -1.70 0.00 1.53 4.77 -1.26 -4.87 117.00 115.34 3hjt n LEU 280 Ca 0.04 0.02 0.12 0.00 -0.03 0.00 0.00 56.01 56.16 3hjt n LEU 280 Cb 0.15 -2.62 0.34 0.00 -2.33 0.00 0.00 43.42 38.96 3hjt n LEU 280 CO 0.03 -0.13 0.57 -0.62 -1.33 0.00 0.00 177.39 175.91 3hjt n GLU 281 N -3.06 0.00 -4.62 3.23 1.02 -1.26 -4.03 120.64 111.92 3hjt n GLU 281 Ca -0.19 0.00 -0.24 0.00 -0.02 0.00 0.00 57.16 56.71 3hjt n GLU 281 Cb 0.65 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.43 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 -3.00 1.50 -0.15 0.62 0.00 -1.26 -4.42 121.76 115.05 3hjt s ALA 282 Ca 0.12 -0.90 -0.32 0.00 0.00 0.00 0.00 51.96 50.86 3hjt s ALA 282 Cb 0.18 -0.31 -0.09 0.00 0.00 0.00 0.00 23.12 22.90 3hjt s ALA 282 CO 0.66 0.34 2.05 0.00 0.00 0.00 0.00 175.76 178.81 3hjt n ALA 283 N 2.12 1.28 -1.76 0.00 0.00 0.57 -4.92 120.51 117.81 3hjt n ALA 283 Ca -0.17 0.06 -0.37 0.00 0.00 0.00 0.00 53.44 52.97 3hjt n ALA 283 Cb 0.54 -2.66 0.02 0.00 0.00 0.00 0.00 19.45 17.35 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 5.17 3.24 0.46 0.00 0.02 -1.26 -4.97 135.00 137.65 3hjt s PRO 284 Ca 0.97 1.90 -0.23 0.00 0.02 0.00 0.00 61.00 63.67 3hjt s PRO 284 Cb -0.58 -2.14 -0.07 0.00 0.02 0.00 0.00 34.50 31.73 3hjt s PRO 284 CO 0.45 -1.01 1.15 -1.54 -0.33 0.00 0.00 177.00 175.72 3hjt s SER 285 N -1.39 6.21 0.00 2.53 1.04 -1.26 -4.84 113.70 116.00 3hjt s SER 285 Ca 0.72 2.26 0.00 0.00 0.48 0.00 0.00 55.95 59.41 3hjt s SER 285 Cb -0.32 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.20 3hjt s SER 285 CO 0.37 -0.88 0.00 0.61 0.98 0.00 0.00 173.24 174.31 3hjt n GLY 286 N 0.39 -0.52 2.81 7.32 0.00 -1.26 -4.79 105.19 109.14 3hjt n GLY 286 Ca 0.07 -1.66 -0.38 0.00 0.00 0.00 0.00 46.02 44.05 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 -1.20 5.66 -4.99 1.61 0.23 -1.26 -5.02 115.26 110.28 3hjt n ASN 287 Ca 0.00 -3.44 -0.19 0.00 -0.53 0.00 0.00 54.58 50.42 3hjt n ASN 287 Cb 0.00 -1.08 -0.00 0.00 -2.08 0.00 0.00 39.78 36.62 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 -2.79 3.07 0.70 -3.83 1.02 -1.26 -5.11 119.74 111.54 3hjt s LYS 288 Ca 0.34 -0.98 -0.11 0.00 0.02 0.00 0.00 55.97 55.25 3hjt s LYS 288 Cb 0.09 -2.78 0.01 0.00 -0.52 0.00 0.00 37.83 34.63 3hjt s LYS 288 CO 0.06 -0.02 1.06 0.99 -0.92 0.00 0.00 175.35 176.52 3hjt s THR 289 N -2.24 3.99 0.16 2.17 2.01 -1.26 -4.85 115.64 115.62 3hjt s THR 289 Ca 0.47 0.65 -0.17 0.00 0.31 0.00 0.00 61.69 62.94 3hjt s THR 289 Cb -0.10 -3.45 0.06 0.00 0.01 0.00 0.00 72.50 69.03 3hjt s THR 289 CO 0.32 -0.84 1.69 0.22 -0.69 0.00 0.00 174.62 175.31 3hjt h TYR 290 N -0.69 -0.10 0.00 4.92 3.20 -1.99 -1.50 116.97 120.80 3hjt h TYR 290 Ca -0.44 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.39 3hjt h TYR 290 Cb 1.22 0.10 -0.01 0.00 1.54 0.00 0.00 36.73 39.58 3hjt h TYR 290 CO 0.60 -0.11 -0.31 -0.07 -1.64 0.00 0.00 178.16 176.62 3hjt h LEU 291 N 0.05 0.00 -0.57 2.82 3.38 -1.98 -1.56 115.31 117.45 3hjt h LEU 291 Ca 0.18 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.00 3hjt h LEU 291 Cb 0.26 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3hjt h LEU 291 CO -0.34 0.31 -0.70 -0.33 0.09 0.00 0.00 178.44 177.47 3hjt h GLU 292 N 0.00 0.00 -0.07 1.13 5.08 -1.70 0.21 114.58 119.22 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 0.63 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.89 3hjt h GLU 292 CO 0.04 0.70 -0.41 -0.91 -1.00 0.00 0.00 179.01 177.43 3hjt h ASN 293 N 0.00 0.49 -0.69 1.42 2.35 -1.02 -0.20 115.58 117.93 3hjt h ASN 293 Ca -0.01 -0.66 -0.02 0.00 -0.55 0.00 0.00 56.30 55.06 3hjt h ASN 293 Cb 1.26 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 39.45 3hjt h ASN 293 CO 0.09 1.07 0.36 0.25 -1.65 0.00 0.00 177.43 177.55 3hjt h LEU 294 N -0.07 0.87 -0.51 1.61 5.85 -1.21 -2.49 115.31 119.37 3hjt h LEU 294 Ca -0.03 -0.11 0.01 0.00 0.84 0.00 0.00 57.88 58.59 3hjt h LEU 294 Cb 1.07 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.85 3hjt h LEU 294 CO 0.08 0.73 0.33 -0.09 -0.34 0.00 0.00 178.44 179.15 3hjt h ARG 295 N 0.95 0.64 -0.52 1.25 2.43 -0.55 -0.61 114.38 117.96 3hjt h ARG 295 Ca 0.24 -0.04 0.09 0.00 -0.81 0.00 0.00 59.98 59.46 3hjt h ARG 295 Cb 0.07 -0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 29.40 3hjt h ARG 295 CO -0.04 0.42 0.11 0.00 -1.51 0.00 0.00 179.97 178.96 3hjt h ALA 296 N 1.21 0.59 0.00 2.80 0.00 -0.59 -1.29 119.26 121.98 3hjt h ALA 296 Ca 0.20 0.11 -0.12 0.00 0.00 0.00 0.00 54.91 55.09 3hjt h ALA 296 Cb -0.03 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3hjt h ALA 296 CO -0.07 -0.30 -0.58 -0.91 0.00 0.00 0.00 179.25 177.39 3hjt h ASN 297 N 0.25 0.00 0.26 0.00 2.35 -1.13 -2.37 115.58 114.93 3hjt h ASN 297 Ca 0.26 0.00 -0.05 0.00 -0.55 0.00 0.00 56.30 55.96 3hjt h ASN 297 Cb 0.35 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.71 3hjt h ASN 297 CO -0.33 0.58 -0.24 -0.07 -1.65 0.00 0.00 177.43 175.72 3hjt h LEU 298 N 0.00 0.00 -0.11 1.61 4.07 -0.05 -1.84 115.31 118.99 3hjt h LEU 298 Ca -0.01 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.79 3hjt h LEU 298 Cb 1.07 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.82 3hjt h LEU 298 CO 0.08 0.24 -0.56 -0.33 -1.08 0.00 0.00 178.44 176.78 3hjt h GLU 299 N 0.00 0.57 -0.11 1.13 4.39 -0.77 -1.19 114.58 118.61 3hjt h GLU 299 Ca -0.00 -0.47 -0.01 0.00 0.34 0.00 0.00 59.36 59.22 3hjt h GLU 299 Cb 0.43 0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 29.17 3hjt h GLU 299 CO 0.03 1.09 0.03 -0.39 -1.16 0.00 0.00 179.01 178.61 3hjt h VAL 300 N 0.20 1.19 -0.17 3.13 -1.51 -1.23 0.25 116.25 118.11 3hjt h VAL 300 Ca -0.04 -0.58 0.05 0.00 -1.23 0.00 0.00 66.70 64.89 3hjt h VAL 300 Cb 1.20 1.37 -0.05 0.00 -2.13 0.00 0.00 31.29 31.68 3hjt h VAL 300 CO 0.12 0.17 -0.16 0.25 -1.23 0.00 0.00 177.57 176.72 3hjt h LEU 301 N -0.02 -0.49 0.10 4.19 5.85 -1.40 0.17 115.31 123.71 3hjt h LEU 301 Ca 0.03 0.10 0.02 0.00 0.84 0.00 0.00 57.88 58.87 3hjt h LEU 301 Cb 0.24 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 3hjt h LEU 301 CO -0.00 -0.20 -0.23 0.22 -0.34 0.00 0.00 178.44 177.89 3hjt h TYR 302 N -0.18 -0.61 -0.56 1.25 3.20 -0.99 0.22 116.97 119.30 3hjt h TYR 302 Ca 0.11 0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.01 3hjt h TYR 302 Cb 0.33 0.26 -0.03 0.00 1.54 0.00 0.00 36.73 38.83 3hjt h TYR 302 CO -0.29 -0.33 0.37 1.96 -1.64 0.00 0.00 178.16 178.23 3hjt h GLN 303 N -0.42 0.69 0.28 1.82 1.08 -0.17 -2.28 115.11 116.12 3hjt h GLN 303 Ca 0.03 -0.04 -0.01 0.00 -1.45 0.00 0.00 58.65 57.18 3hjt h GLN 303 Cb 0.45 -0.16 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 3hjt h GLN 303 CO -0.14 0.46 -0.14 1.96 -0.95 0.00 0.00 178.83 180.02 3hjt h GLN 304 N 0.71 -0.37 0.00 1.46 1.08 -0.18 -3.02 115.11 114.79 3hjt h GLN 304 Ca 0.21 0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.44 3hjt h GLN 304 Cb -0.02 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 3hjt h GLN 304 CO -0.05 -0.02 0.01 1.28 -0.95 0.00 0.00 178.83 179.10 3hjt n LEU 305 N -5.07 0.46 -0.23 1.46 4.77 0.02 -5.04 117.00 113.37 3hjt n LEU 305 Ca -0.09 0.71 0.15 0.00 -0.03 0.00 0.00 56.01 56.75 3hjt n LEU 305 Cb 0.26 -0.77 0.74 0.00 -2.33 0.00 0.00 43.42 41.33 3hjt n LEU 305 CO 0.27 -0.87 0.99 1.17 -1.33 0.00 0.00 177.39 177.63