#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xks s SER 76 N 0.00 5.63 -0.16 -1.84 0.15 -1.26 -5.04 113.70 111.18 1xks s SER 76 Ca 0.00 1.42 -0.25 0.00 0.70 0.00 0.00 55.95 57.81 1xks s SER 76 Cb 0.00 -2.34 -0.23 0.00 -1.71 0.00 0.00 66.02 61.75 1xks s SER 76 CO 0.00 -1.26 0.56 0.58 1.20 0.00 0.00 173.24 174.32 1xks h VAL 77 N -0.59 1.44 -0.01 4.45 2.07 -2.02 -3.40 116.25 118.18 1xks h VAL 77 Ca -0.44 -2.23 0.00 0.00 0.82 0.00 0.00 66.70 64.84 1xks h VAL 77 Cb 1.22 2.88 0.00 0.00 -1.52 0.00 0.00 31.29 33.86 1xks h VAL 77 CO 0.60 0.49 -0.03 0.59 0.02 0.00 0.00 177.57 179.24 1xks n ASN 78 N -4.56 1.93 -4.00 0.57 3.02 -1.26 -4.99 115.26 105.97 1xks n ASN 78 Ca -0.16 -1.46 -0.16 0.00 -0.03 0.00 0.00 54.58 52.76 1xks n ASN 78 Cb 0.52 0.06 -0.14 0.00 -0.61 0.00 0.00 39.78 39.62 1xks n ASN 78 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 1xks s TYR 79 N -1.09 0.59 -0.05 3.10 1.51 -1.26 -1.47 117.35 118.68 1xks s TYR 79 Ca 0.14 -0.20 -0.18 0.00 -1.01 0.00 0.00 57.07 55.82 1xks s TYR 79 Cb 0.10 -0.37 -0.05 0.00 -0.11 0.00 0.00 41.96 41.53 1xks s TYR 79 CO 0.17 -0.02 0.49 -0.51 -1.11 0.00 0.00 175.55 174.57 1xks s ASP 80 N -0.49 6.82 -0.31 2.29 1.01 0.28 -4.38 116.67 121.88 1xks s ASP 80 Ca -0.00 0.97 0.03 0.00 0.71 0.00 0.00 52.55 54.26 1xks s ASP 80 Cb -0.04 -2.30 0.09 0.00 1.01 0.00 0.00 42.92 41.67 1xks s ASP 80 CO -0.00 0.13 0.00 -0.69 0.21 0.00 0.00 175.17 174.82 1xks s VAL 81 N -0.14 2.19 0.09 -1.27 1.01 -1.26 -1.81 120.40 119.21 1xks s VAL 81 Ca 0.27 -2.09 -0.03 0.00 0.00 0.00 0.00 61.98 60.12 1xks s VAL 81 Cb -0.17 -2.52 -0.03 0.00 0.00 0.00 0.00 36.38 33.66 1xks s VAL 81 CO 0.13 -0.43 0.06 -1.59 0.00 0.00 0.00 175.10 173.27 1xks s LYS 82 N 0.99 0.78 0.00 2.72 -2.85 -1.04 -4.95 119.74 115.40 1xks s LYS 82 Ca 0.05 -1.22 -0.39 0.00 -1.00 0.00 0.00 55.97 53.41 1xks s LYS 82 Cb -0.19 0.26 -0.18 0.00 -2.06 0.00 0.00 37.83 35.65 1xks s LYS 82 CO -0.08 -0.20 1.27 2.41 0.10 0.00 0.00 175.35 178.86 1xks n THR 83 N 0.00 0.02 -4.44 3.79 -1.04 -1.26 -1.06 114.28 110.29 1xks n THR 83 Ca -0.12 -0.00 -0.34 0.00 -2.04 0.00 0.00 64.05 61.56 1xks n THR 83 Cb 0.62 -0.52 -0.12 0.00 -1.82 0.00 0.00 70.33 68.49 1xks n THR 83 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1xks s PHE 84 N 0.60 3.00 0.00 -1.42 5.36 -0.41 -4.74 117.98 120.38 1xks s PHE 84 Ca 0.89 -0.33 0.00 0.00 -0.96 0.00 0.00 56.93 56.52 1xks s PHE 84 Cb -1.11 -1.94 0.00 0.00 -0.34 0.00 0.00 43.02 39.63 1xks s PHE 84 CO 0.53 -0.05 0.00 0.41 -1.46 0.00 0.00 175.22 174.65 1xks n GLY 85 N 3.52 -2.13 3.98 13.12 0.00 -1.26 -4.71 105.19 117.71 1xks n GLY 85 Ca -0.17 -1.54 -0.25 0.00 0.00 0.00 0.00 46.02 44.05 1xks n GLY 85 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xks s SER 86 N -3.62 3.88 0.36 1.61 0.01 -0.47 -5.00 113.70 110.48 1xks s SER 86 Ca 0.00 -0.29 -0.27 0.00 1.31 0.00 0.00 55.95 56.70 1xks s SER 86 Cb 0.00 0.07 -0.12 0.00 0.21 0.00 0.00 66.02 66.19 1xks s SER 86 CO 0.00 -2.19 1.15 -1.20 0.41 0.00 0.00 173.24 171.41 1xks n SER 87 N -3.13 2.01 -4.78 2.44 7.64 -1.26 -4.86 113.62 111.69 1xks n SER 87 Ca 0.16 1.14 -0.33 0.00 1.01 0.00 0.00 58.87 60.85 1xks n SER 87 Cb 0.60 -1.41 0.03 0.00 -1.01 0.00 0.00 64.21 62.42 1xks n SER 87 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1xks s LEU 88 N -0.66 3.46 0.50 -3.43 1.43 -1.26 -4.95 118.68 113.77 1xks s LEU 88 Ca 0.59 1.94 -0.22 0.00 -1.03 0.00 0.00 54.13 55.41 1xks s LEU 88 Cb -0.59 -4.55 -0.07 0.00 0.03 0.00 0.00 46.19 41.01 1xks s LEU 88 CO 0.60 -1.42 1.14 -2.65 0.23 0.00 0.00 176.35 174.25 1xks n PRO 89 N -2.18 1.44 -0.29 1.29 -0.02 -1.26 -4.76 135.00 129.22 1xks n PRO 89 Ca 0.10 0.53 0.04 0.00 -2.02 0.00 0.00 63.50 62.14 1xks n PRO 89 Cb 0.52 -2.29 0.18 0.00 -0.02 0.00 0.00 33.50 31.89 1xks n PRO 89 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1xks h VAL 90 N 1.34 0.87 -0.54 -1.45 2.07 -1.99 0.11 116.25 116.66 1xks h VAL 90 Ca -0.48 -0.25 0.02 0.00 0.82 0.00 0.00 66.70 66.81 1xks h VAL 90 Cb 1.33 0.06 -0.03 0.00 -1.52 0.00 0.00 31.29 31.13 1xks h VAL 90 CO 0.56 0.13 0.36 0.11 0.02 0.00 0.00 177.57 178.75 1xks h LYS 91 N 0.74 0.64 -0.02 1.57 1.57 -2.00 -0.47 116.57 118.60 1xks h LYS 91 Ca 0.41 -0.04 -0.16 0.00 -1.87 0.00 0.00 60.65 58.99 1xks h LYS 91 Cb 0.42 -0.14 0.01 0.00 0.08 0.00 0.00 32.23 32.60 1xks h LYS 91 CO -0.27 0.42 -0.60 0.28 -0.57 0.00 0.00 179.45 178.71 1xks h VAL 92 N 0.66 1.41 -0.24 0.50 2.07 -1.38 -2.88 116.25 116.38 1xks h VAL 92 Ca 0.21 -2.04 0.06 0.00 0.82 0.00 0.00 66.70 65.75 1xks h VAL 92 Cb 0.04 2.52 -0.08 0.00 -1.52 0.00 0.00 31.29 32.25 1xks h VAL 92 CO -0.05 0.60 -0.38 0.24 0.02 0.00 0.00 177.57 178.00 1xks h MET 93 N -0.06 -0.37 0.01 1.57 2.86 -0.77 -1.22 114.93 116.96 1xks h MET 93 Ca -0.07 0.03 0.01 0.00 -2.06 0.00 0.00 59.70 57.61 1xks h MET 93 Cb 1.29 0.08 -0.03 0.00 0.06 0.00 0.00 31.60 33.01 1xks h MET 93 CO 0.12 -0.25 -0.27 0.93 1.06 0.00 0.00 176.91 178.51 1xks h GLU 94 N -0.39 -0.33 -0.99 1.72 5.08 -1.15 0.41 114.58 118.94 1xks h GLU 94 Ca 0.11 0.02 0.36 0.00 -1.00 0.00 0.00 59.36 58.86 1xks h GLU 94 Cb 0.58 0.07 -0.17 0.00 0.50 0.00 0.00 28.75 29.74 1xks h GLU 94 CO -0.45 -0.22 0.48 0.00 -1.00 0.00 0.00 179.01 177.82 1xks h ALA 95 N -0.98 1.94 0.07 3.43 0.00 -1.36 0.93 119.26 123.29 1xks h ALA 95 Ca 0.00 0.25 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 1xks h ALA 95 Cb 0.36 0.30 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1xks h ALA 95 CO -0.17 -0.76 -0.04 -0.07 0.00 0.00 0.00 179.25 178.21 1xks h LEU 96 N 0.12 -0.08 -1.13 0.00 4.07 -0.60 0.13 115.31 117.82 1xks h LEU 96 Ca 0.77 -0.52 0.04 0.00 0.08 0.00 0.00 57.88 58.24 1xks h LEU 96 Cb 1.88 0.02 -0.05 0.00 1.08 0.00 0.00 40.66 43.59 1xks h LEU 96 CO -0.72 0.59 0.60 0.74 -1.08 0.00 0.00 178.44 178.57 1xks h THR 97 N -0.88 1.14 -0.13 0.22 2.02 0.16 -2.57 112.91 112.86 1xks h THR 97 Ca -0.01 -0.38 -0.11 0.00 0.77 0.00 0.00 66.41 66.67 1xks h THR 97 Cb 0.60 -0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 1xks h THR 97 CO 0.02 0.20 -0.37 0.25 0.37 0.00 0.00 175.52 175.99 1xks h LEU 98 N 1.12 0.54 -9.21 2.58 5.85 0.76 -3.47 115.31 113.49 1xks h LEU 98 Ca 0.37 -0.59 -0.67 0.00 0.84 0.00 0.00 57.88 57.82 1xks h LEU 98 Cb 0.05 -0.16 0.08 0.00 0.37 0.00 0.00 40.66 41.01 1xks h LEU 98 CO -0.12 1.04 0.02 0.00 -0.34 0.00 0.00 178.44 179.05 1xks n ALA 99 N -2.51 -1.75 -2.61 1.25 0.00 0.44 -5.00 120.51 110.35 1xks n ALA 99 Ca -0.07 0.47 -0.34 0.00 0.00 0.00 0.00 53.44 53.50 1xks n ALA 99 Cb 0.52 -1.88 -0.11 0.00 0.00 0.00 0.00 19.45 17.98 1xks n ALA 99 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1xks s GLU 100 N -0.59 2.78 0.00 0.00 2.02 -1.26 -4.98 118.70 116.67 1xks s GLU 100 Ca 0.72 -0.53 0.00 0.00 0.02 0.00 0.00 54.97 55.18 1xks s GLU 100 Cb -0.93 -2.62 0.00 0.00 0.10 0.00 0.00 34.13 30.68 1xks s GLU 100 CO 0.55 0.67 0.60 1.55 0.02 0.00 0.00 175.26 178.65 1xks n VAL 101 N 2.14 0.65 0.05 2.63 3.14 -1.26 0.53 118.33 126.20 1xks n VAL 101 Ca -0.18 0.40 -0.09 0.00 -2.96 0.00 0.00 64.34 61.52 1xks n VAL 101 Cb 0.53 -1.40 0.05 0.00 -1.06 0.00 0.00 33.84 31.96 1xks n VAL 101 CO 0.00 0.00 0.00 -0.78 -6.46 0.00 0.00 176.83 169.59 1xks h ASP 102 N 0.00 0.44 -2.91 6.55 1.82 -2.02 -3.46 116.42 116.84 1xks h ASP 102 Ca 0.00 -0.28 -0.53 0.00 -0.39 0.00 0.00 57.03 55.83 1xks h ASP 102 Cb 0.49 -0.13 0.02 0.00 0.68 0.00 0.00 39.33 40.38 1xks h ASP 102 CO 0.00 1.00 0.81 -1.81 -1.61 0.00 0.00 179.24 177.63 1xks s ASP 103 N -6.95 6.78 -0.38 2.28 1.01 2.03 -4.99 116.67 116.46 1xks s ASP 103 Ca -0.05 2.30 -0.26 0.00 0.71 0.00 0.00 52.55 55.24 1xks s ASP 103 Cb 0.11 -2.57 0.02 0.00 1.01 0.00 0.00 42.92 41.48 1xks s ASP 103 CO 0.83 -0.72 0.94 -1.58 0.21 0.00 0.00 175.17 174.85 1xks s GLN 104 N 1.76 3.81 -0.04 8.23 0.74 -1.26 -4.84 119.66 128.05 1xks s GLN 104 Ca 0.66 0.55 0.04 0.00 0.05 0.00 0.00 55.36 56.67 1xks s GLN 104 Cb -0.36 -3.82 -0.03 0.00 1.10 0.00 0.00 33.01 29.91 1xks s GLN 104 CO 0.29 -1.00 -0.16 -0.51 -0.55 0.00 0.00 175.29 173.37 1xks s LEU 105 N 3.56 2.65 0.08 3.68 1.43 -1.26 -4.64 118.68 124.18 1xks s LEU 105 Ca 0.39 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 53.27 1xks s LEU 105 Cb -0.11 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.54 1xks s LEU 105 CO 0.20 0.34 -0.07 0.42 0.23 0.00 0.00 176.35 177.47 1xks s THR 106 N -0.72 0.63 -0.03 5.49 -4.23 -1.22 -4.87 115.64 110.68 1xks s THR 106 Ca 0.11 -1.61 -0.04 0.00 -1.18 0.00 0.00 61.69 58.97 1xks s THR 106 Cb -0.11 -1.27 0.01 0.00 1.34 0.00 0.00 72.50 72.47 1xks s THR 106 CO 0.00 -0.69 0.11 -0.51 -0.54 0.00 0.00 174.62 172.99 1xks s ILE 107 N -2.78 0.02 -0.31 2.99 2.07 -1.25 -1.01 121.20 120.92 1xks s ILE 107 Ca 0.03 -0.16 -0.06 0.00 -1.41 0.00 0.00 60.65 59.06 1xks s ILE 107 Cb -0.00 -0.21 0.02 0.00 0.13 0.00 0.00 42.46 42.39 1xks s ILE 107 CO -0.03 -0.09 0.07 0.21 -1.91 0.00 0.00 174.94 173.20 1xks s ASN 108 N -0.25 5.12 -0.39 4.50 2.47 0.16 -4.77 114.94 121.79 1xks s ASN 108 Ca -0.03 -0.91 -0.16 0.00 0.42 0.00 0.00 52.86 52.18 1xks s ASN 108 Cb -0.02 -1.85 0.01 0.00 -1.45 0.00 0.00 41.25 37.93 1xks s ASN 108 CO 0.00 -0.24 0.36 -0.63 -3.72 0.00 0.00 177.10 172.87 1xks s ILE 109 N 1.44 5.17 -0.01 -5.21 1.01 -1.26 -0.83 121.20 121.52 1xks s ILE 109 Ca 0.00 -0.31 -0.14 0.00 0.00 0.00 0.00 60.65 60.21 1xks s ILE 109 Cb -0.18 -3.92 -0.06 0.00 0.01 0.00 0.00 42.46 38.32 1xks s ILE 109 CO 0.02 -0.26 0.39 -0.62 0.00 0.00 0.00 174.94 174.47 1xks s ASP 110 N 1.75 6.78 0.56 3.58 -1.08 0.28 -4.66 116.67 123.88 1xks s ASP 110 Ca 0.10 0.93 0.32 0.00 -0.52 0.00 0.00 52.55 53.37 1xks s ASP 110 Cb -0.17 -2.24 1.47 0.00 -1.46 0.00 0.00 42.92 40.52 1xks s ASP 110 CO 0.12 0.33 1.85 1.05 0.52 0.00 0.00 175.17 179.04 1xks h GLU 111 N 4.71 0.00 0.00 4.34 -0.00 -1.86 0.79 114.58 122.57 1xks h GLU 111 Ca -0.52 0.00 0.00 0.00 -0.00 0.00 0.00 59.36 58.84 1xks h GLU 111 Cb 1.22 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 29.97 1xks h GLU 111 CO 0.61 0.00 0.00 0.41 -0.00 0.00 0.00 179.01 180.03 1xks n GLY 112 N -1.67 -1.25 0.00 1.06 0.00 -1.26 -4.79 105.19 97.28 1xks n GLY 112 Ca 0.18 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.24 1xks n GLY 112 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xks n GLY 113 N 0.12 1.02 3.58 -0.02 0.00 0.27 -5.04 105.19 105.12 1xks n GLY 113 Ca 0.03 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1xks n GLY 113 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1xks s TRP 114 N -2.00 2.81 0.07 1.61 0.52 -1.23 0.31 118.94 121.03 1xks s TRP 114 Ca 0.00 -0.10 0.10 0.00 0.02 0.00 0.00 56.10 56.12 1xks s TRP 114 Cb 0.00 -1.52 -0.03 0.00 -1.15 0.00 0.00 33.47 30.76 1xks s TRP 114 CO 0.00 0.39 -0.26 0.00 0.02 0.00 0.00 176.95 177.10 1xks s ALA 115 N -1.10 2.31 -0.15 0.98 0.00 0.52 -0.55 121.76 123.77 1xks s ALA 115 Ca 0.19 -1.33 0.01 0.00 0.00 0.00 0.00 51.96 50.83 1xks s ALA 115 Cb -0.11 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.57 1xks s ALA 115 CO 0.11 0.54 -0.17 0.00 0.00 0.00 0.00 175.76 176.23 1xks s LEU 117 N 1.30 3.57 -0.40 0.00 2.96 0.86 -0.67 118.68 126.30 1xks s LEU 117 Ca 0.03 -0.35 -0.17 0.00 -0.22 0.00 0.00 54.13 53.41 1xks s LEU 117 Cb -0.13 -1.91 0.01 0.00 0.50 0.00 0.00 46.19 44.65 1xks s LEU 117 CO -0.10 -0.08 0.46 -0.69 -1.32 0.00 0.00 176.35 174.62 1xks s VAL 118 N 1.59 5.06 -0.25 1.68 1.01 -0.18 -1.15 120.40 128.15 1xks s VAL 118 Ca 0.05 -0.12 -0.02 0.00 0.00 0.00 0.00 61.98 61.90 1xks s VAL 118 Cb -0.16 -4.01 0.08 0.00 0.00 0.00 0.00 36.38 32.29 1xks s VAL 118 CO 0.03 -0.35 0.05 0.00 0.00 0.00 0.00 175.10 174.83 1xks n LYS 120 N 4.92 0.00 -0.56 0.00 5.02 -1.26 -1.87 118.16 124.41 1xks n LYS 120 Ca -0.07 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.30 1xks n LYS 120 Cb 0.45 0.00 0.31 0.00 -0.02 0.00 0.00 35.03 35.77 1xks n LYS 120 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 1xks n GLU 121 N 14.00 3.45 -4.26 1.97 0.28 -1.26 -4.75 120.64 130.07 1xks n GLU 121 Ca 0.00 -2.47 -0.14 0.00 -0.16 0.00 0.00 57.16 54.39 1xks n GLU 121 Cb 0.00 -1.85 -0.10 0.00 1.43 0.00 0.00 31.44 30.92 1xks n GLU 121 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 1xks s LYS 122 N -1.88 1.15 -0.16 3.44 0.00 -0.78 -2.79 119.74 118.72 1xks s LYS 122 Ca 0.44 -1.55 -0.01 0.00 0.00 0.00 0.00 55.97 54.85 1xks s LYS 122 Cb 0.29 -0.37 -0.01 0.00 0.00 0.00 0.00 37.83 37.74 1xks s LYS 122 CO 0.20 -0.10 -0.13 -1.17 0.00 0.00 0.00 175.35 174.15 1xks s LEU 123 N -3.20 2.62 -0.17 2.77 0.20 -0.77 -0.06 118.68 120.07 1xks s LEU 123 Ca 0.24 -0.41 -0.03 0.00 0.69 0.00 0.00 54.13 54.62 1xks s LEU 123 Cb 0.06 -1.61 -0.02 0.00 -0.43 0.00 0.00 46.19 44.19 1xks s LEU 123 CO 0.04 0.09 -0.07 -0.63 -0.29 0.00 0.00 176.35 175.50 1xks s ILE 124 N 0.79 3.51 -0.08 6.68 1.01 -0.30 -0.37 121.20 132.43 1xks s ILE 124 Ca -0.05 -0.48 0.04 0.00 0.00 0.00 0.00 60.65 60.16 1xks s ILE 124 Cb -0.15 -2.53 -0.01 0.00 0.01 0.00 0.00 42.46 39.77 1xks s ILE 124 CO 0.01 0.48 -0.22 -0.63 0.00 0.00 0.00 174.94 174.58 1xks s ILE 125 N 0.66 2.35 0.04 2.92 1.01 0.10 -0.10 121.20 128.18 1xks s ILE 125 Ca -0.04 -0.95 -0.10 0.00 0.00 0.00 0.00 60.65 59.56 1xks s ILE 125 Cb -0.15 -1.89 0.01 0.00 0.01 0.00 0.00 42.46 40.44 1xks s ILE 125 CO 0.02 0.56 0.22 -1.66 0.00 0.00 0.00 174.94 174.09 1xks s TRP 126 N -0.05 0.01 -0.08 3.97 -2.14 0.37 -0.03 118.94 120.99 1xks s TRP 126 Ca -0.06 -0.19 -0.26 0.00 2.66 0.00 0.00 56.10 58.25 1xks s TRP 126 Cb -0.15 0.00 -0.03 0.00 -3.10 0.00 0.00 33.47 30.20 1xks s TRP 126 CO 0.05 -0.43 0.83 0.21 -2.66 0.00 0.00 176.95 174.94 1xks s LYS 127 N -2.42 4.43 0.04 3.25 2.20 -0.82 -0.35 119.74 126.07 1xks s LYS 127 Ca -0.06 1.08 -0.30 0.00 -0.36 0.00 0.00 55.97 56.33 1xks s LYS 127 Cb -0.02 -3.49 -0.08 0.00 -1.51 0.00 0.00 37.83 32.74 1xks s LYS 127 CO -0.03 -0.09 1.66 0.42 -0.36 0.00 0.00 175.35 176.95 1xks s ILE 128 N 1.29 3.17 -0.63 5.43 1.01 0.15 -4.75 121.20 126.87 1xks s ILE 128 Ca 0.42 0.52 -0.20 0.00 0.00 0.00 0.00 60.65 61.39 1xks s ILE 128 Cb -0.18 -3.34 0.10 0.00 0.01 0.00 0.00 42.46 39.05 1xks s ILE 128 CO 0.19 -0.01 0.80 0.00 0.00 0.00 0.00 174.94 175.92 1xks s ALA 129 N 3.02 3.34 0.26 9.38 0.00 -1.26 -4.76 121.76 131.73 1xks s ALA 129 Ca 0.74 -2.17 0.03 0.00 0.00 0.00 0.00 51.96 50.57 1xks s ALA 129 Cb -0.38 -3.65 0.32 0.00 0.00 0.00 0.00 23.12 19.41 1xks s ALA 129 CO 0.32 -2.51 1.63 -0.07 0.00 0.00 0.00 175.76 175.13 1xks h LEU 130 N 10.36 0.38 -9.60 0.00 4.07 -1.95 -1.25 115.31 117.33 1xks h LEU 130 Ca -0.26 -0.18 -0.66 0.00 0.08 0.00 0.00 57.88 56.86 1xks h LEU 130 Cb 1.08 -0.11 -0.08 0.00 1.08 0.00 0.00 40.66 42.64 1xks h LEU 130 CO 1.12 0.79 -0.47 -0.55 -1.08 0.00 0.00 178.44 178.24 1xks s SER 131 N -6.88 6.38 0.14 -0.43 0.15 -1.26 -4.60 113.70 107.21 1xks s SER 131 Ca -0.05 0.46 0.20 0.00 0.70 0.00 0.00 55.95 57.25 1xks s SER 131 Cb 0.13 -2.08 0.83 0.00 -1.71 0.00 0.00 66.02 63.19 1xks s SER 131 CO 0.80 0.38 1.61 -0.81 1.20 0.00 0.00 173.24 176.42 1xks n PRO 132 N 2.15 0.11 -1.99 5.44 -0.04 -1.26 -4.80 135.00 134.60 1xks n PRO 132 Ca -0.19 0.33 -0.42 0.00 -0.04 0.00 0.00 63.50 63.18 1xks n PRO 132 Cb 0.55 -1.70 -0.03 0.00 -0.04 0.00 0.00 33.50 32.28 1xks n PRO 132 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1xks s ILE 133 N -3.17 3.08 0.27 0.52 1.01 -1.26 -4.92 121.20 116.74 1xks s ILE 133 Ca 0.06 0.61 -0.03 0.00 0.00 0.00 0.00 60.65 61.29 1xks s ILE 133 Cb 0.10 -3.39 0.20 0.00 0.01 0.00 0.00 42.46 39.37 1xks s ILE 133 CO 0.35 0.01 1.87 0.71 0.00 0.00 0.00 174.94 177.88 1xks h THR 134 N 4.63 1.23 0.00 2.92 1.35 -1.98 -2.17 112.91 118.89 1xks h THR 134 Ca -0.42 -0.65 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1xks h THR 134 Cb 1.20 0.33 0.00 0.00 -1.73 0.00 0.00 68.15 67.95 1xks h THR 134 CO 0.92 0.27 0.00 2.29 -0.25 0.00 0.00 175.52 178.75 1xks n LYS 135 N -4.33 0.12 0.01 4.72 2.85 -1.26 -0.72 118.16 119.56 1xks n LYS 135 Ca 0.07 0.33 0.12 0.00 -1.05 0.00 0.00 58.31 57.77 1xks n LYS 135 Cb 0.14 -1.72 0.19 0.00 -0.65 0.00 0.00 35.03 32.99 1xks n LYS 135 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1xks n LEU 136 N -1.95 0.57 -4.69 -5.58 4.77 -0.82 -4.95 117.00 104.34 1xks n LEU 136 Ca 0.03 -0.01 -0.42 0.00 -0.03 0.00 0.00 56.01 55.58 1xks n LEU 136 Cb 0.23 -0.21 -0.03 0.00 -2.33 0.00 0.00 43.42 41.09 1xks n LEU 136 CO 0.19 0.10 1.09 -0.55 -1.33 0.00 0.00 177.39 176.89 1xks s SER 137 N -3.25 6.89 -0.06 -1.43 0.15 0.10 -5.02 113.70 111.08 1xks s SER 137 Ca 0.09 2.05 0.01 0.00 0.70 0.00 0.00 55.95 58.81 1xks s SER 137 Cb 0.17 -2.56 0.02 0.00 -1.71 0.00 0.00 66.02 61.93 1xks s SER 137 CO 0.73 -0.69 -0.08 -0.69 1.20 0.00 0.00 173.24 173.70 1xks s VAL 138 N 2.39 0.81 -0.21 4.45 1.01 -1.26 -5.07 120.40 122.52 1xks s VAL 138 Ca 0.62 -0.28 -0.04 0.00 0.00 0.00 0.00 61.98 62.28 1xks s VAL 138 Cb -0.30 -0.79 0.11 0.00 0.00 0.00 0.00 36.38 35.40 1xks s VAL 138 CO 0.25 0.29 0.36 0.00 0.00 0.00 0.00 175.10 176.00 1xks s LYS 140 N 2.52 1.73 -0.15 0.00 -0.14 0.96 -4.96 119.74 119.70 1xks s LYS 140 Ca 0.06 -1.17 -0.03 0.00 -1.36 0.00 0.00 55.97 53.48 1xks s LYS 140 Cb -0.14 -2.02 -0.02 0.00 -1.68 0.00 0.00 37.83 33.97 1xks s LYS 140 CO -0.13 0.49 -0.07 -2.00 -0.76 0.00 0.00 175.35 172.89 1xks s GLU 141 N -1.67 3.55 0.05 1.68 2.12 -1.26 0.02 118.70 123.19 1xks s GLU 141 Ca 0.14 -0.58 0.08 0.00 0.36 0.00 0.00 54.97 54.97 1xks s GLU 141 Cb -0.10 -2.84 -0.03 0.00 0.26 0.00 0.00 34.13 31.42 1xks s GLU 141 CO 0.05 0.18 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.22 1xks s LEU 142 N 0.48 2.41 -0.20 2.70 1.43 0.50 -4.97 118.68 121.04 1xks s LEU 142 Ca -0.05 -0.52 -0.26 0.00 -1.03 0.00 0.00 54.13 52.27 1xks s LEU 142 Cb -0.15 -1.40 -0.01 0.00 0.03 0.00 0.00 46.19 44.66 1xks s LEU 142 CO 0.03 0.25 0.86 -1.58 0.23 0.00 0.00 176.35 176.14 1xks s GLN 143 N -1.42 4.26 0.43 1.70 2.00 -1.26 -1.85 119.66 123.52 1xks s GLN 143 Ca 0.13 1.04 -0.23 0.00 -2.00 0.00 0.00 55.36 54.31 1xks s GLN 143 Cb -0.10 -3.60 -0.09 0.00 0.80 0.00 0.00 33.01 30.01 1xks s GLN 143 CO 0.04 -0.42 1.03 -0.51 -0.50 0.00 0.00 175.29 174.93 1xks s LEU 144 N 2.47 4.03 0.06 3.68 1.43 -1.12 -4.98 118.68 124.26 1xks s LEU 144 Ca 0.38 1.96 -0.31 0.00 -1.03 0.00 0.00 54.13 55.13 1xks s LEU 144 Cb -0.16 -4.34 -0.08 0.00 0.03 0.00 0.00 46.19 41.64 1xks s LEU 144 CO 0.10 -0.56 1.56 -2.16 0.23 0.00 0.00 176.35 175.52 1xks s PRO 145 N -2.79 4.23 0.42 1.29 0.04 -1.26 -4.96 135.00 131.97 1xks s PRO 145 Ca 0.61 2.22 -0.22 0.00 0.04 0.00 0.00 61.00 63.65 1xks s PRO 145 Cb -0.19 -3.52 -0.12 0.00 0.04 0.00 0.00 34.50 30.71 1xks s PRO 145 CO 0.23 -0.66 0.61 -0.35 0.04 0.00 0.00 177.00 176.87 1xks n PRO 146 N 5.25 0.66 -3.77 0.56 -0.04 -1.26 -4.98 135.00 131.42 1xks n PRO 146 Ca 0.15 0.24 -0.10 0.00 -0.04 0.00 0.00 63.50 63.75 1xks n PRO 146 Cb 0.41 -1.58 -0.06 0.00 -0.04 0.00 0.00 33.50 32.24 1xks n PRO 146 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1xks s SER 147 N -0.93 -0.07 0.18 3.54 0.15 -1.26 -5.03 113.70 110.28 1xks s SER 147 Ca 0.64 -0.54 0.24 0.00 0.70 0.00 0.00 55.95 56.99 1xks s SER 147 Cb -0.59 0.43 0.25 0.00 -1.71 0.00 0.00 66.02 64.40 1xks s SER 147 CO 0.58 -0.83 1.28 0.44 1.20 0.00 0.00 173.24 175.90 1xks h ASP 148 N 2.51 0.00 -3.07 5.45 3.32 -2.05 -3.46 116.42 119.13 1xks h ASP 148 Ca -0.33 -0.11 -0.53 0.00 0.02 0.00 0.00 57.03 56.07 1xks h ASP 148 Cb 1.23 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.76 1xks h ASP 148 CO 0.49 0.06 -0.24 -0.36 -1.72 0.00 0.00 179.24 177.48 1xks s PHE 149 N -3.23 3.48 0.33 4.55 0.40 -1.26 -5.06 117.98 117.18 1xks s PHE 149 Ca 0.04 0.52 -0.28 0.00 -0.60 0.00 0.00 56.93 56.62 1xks s PHE 149 Cb 0.11 -2.00 -0.13 0.00 0.51 0.00 0.00 43.02 41.52 1xks s PHE 149 CO 0.73 0.29 1.22 0.72 0.70 0.00 0.00 175.22 178.88 1xks n HIS 150 N -0.67 2.03 -2.17 0.36 8.25 -1.26 -4.99 115.22 116.78 1xks n HIS 150 Ca -0.03 0.59 -0.32 0.00 -0.26 0.00 0.00 57.72 57.71 1xks n HIS 150 Cb 0.54 -2.37 -0.01 0.00 1.12 0.00 0.00 29.99 29.26 1xks n HIS 150 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1xks s TRP 151 N -1.09 3.49 -0.03 4.41 0.51 -1.26 -4.80 118.94 120.17 1xks s TRP 151 Ca 0.56 1.40 0.01 0.00 -2.12 0.00 0.00 56.10 55.96 1xks s TRP 151 Cb -0.60 -2.78 0.02 0.00 -0.81 0.00 0.00 33.47 29.30 1xks s TRP 151 CO 0.62 -0.54 -0.05 0.45 -0.51 0.00 0.00 176.95 176.92 1xks s SER 152 N -3.49 0.84 0.61 2.95 0.15 -1.26 -4.95 113.70 108.53 1xks s SER 152 Ca 0.58 -0.12 0.39 0.00 0.70 0.00 0.00 55.95 57.50 1xks s SER 152 Cb -0.11 -0.35 1.91 0.00 -1.71 0.00 0.00 66.02 65.77 1xks s SER 152 CO 0.41 -0.03 2.18 0.00 1.20 0.00 0.00 173.24 177.00 1xks h ALA 153 N 6.91 1.00 0.00 5.45 0.00 -1.90 0.23 119.26 130.95 1xks h ALA 153 Ca -0.37 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1xks h ALA 153 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1xks h ALA 153 CO 0.48 0.00 0.00 -0.44 0.00 0.00 0.00 179.25 179.29 1xks h ASP 154 N 0.00 0.00 -0.79 0.00 3.32 -1.88 -2.19 116.42 114.87 1xks h ASP 154 Ca 0.00 0.00 -0.41 0.00 0.02 0.00 0.00 57.03 56.64 1xks h ASP 154 Cb 0.24 0.00 -0.24 0.00 0.22 0.00 0.00 39.33 39.55 1xks h ASP 154 CO 0.00 0.00 0.41 0.18 -1.72 0.00 0.00 179.24 178.11 1xks n LEU 155 N -2.87 5.91 -4.01 1.55 4.77 0.80 -1.57 117.00 121.58 1xks n LEU 155 Ca -0.01 -3.70 -0.23 0.00 -0.03 0.00 0.00 56.01 52.05 1xks n LEU 155 Cb 0.17 -0.77 -0.16 0.00 -2.33 0.00 0.00 43.42 40.32 1xks n LEU 155 CO 0.21 1.14 -0.45 -0.69 -1.33 0.00 0.00 177.39 176.27 1xks s VAL 156 N -3.33 0.95 0.01 4.08 1.01 -0.83 -1.45 120.40 120.84 1xks s VAL 156 Ca 0.53 -0.41 0.02 0.00 0.00 0.00 0.00 61.98 62.12 1xks s VAL 156 Cb 0.46 -0.87 -0.01 0.00 0.00 0.00 0.00 36.38 35.96 1xks s VAL 156 CO 0.07 0.30 -0.05 0.00 0.00 0.00 0.00 175.10 175.42 1xks s ALA 157 N 0.47 0.43 -0.04 5.51 0.00 -0.02 -4.88 121.76 123.22 1xks s ALA 157 Ca -0.09 -0.32 -0.02 0.00 0.00 0.00 0.00 51.96 51.53 1xks s ALA 157 Cb -0.13 -0.07 -0.04 0.00 0.00 0.00 0.00 23.12 22.89 1xks s ALA 157 CO 0.02 0.07 0.08 -0.51 0.00 0.00 0.00 175.76 175.42 1xks s LEU 158 N -0.43 3.93 -0.07 0.00 1.43 -1.26 -1.55 118.68 120.74 1xks s LEU 158 Ca -0.01 0.20 0.02 0.00 -1.03 0.00 0.00 54.13 53.31 1xks s LEU 158 Cb -0.04 -2.17 0.01 0.00 0.03 0.00 0.00 46.19 44.03 1xks s LEU 158 CO -0.00 0.31 -0.12 -0.55 0.23 0.00 0.00 176.35 176.23 1xks s SER 159 N -1.48 1.80 -0.09 2.29 0.15 -0.09 -4.68 113.70 111.60 1xks s SER 159 Ca 0.20 -0.30 -0.00 0.00 0.70 0.00 0.00 55.95 56.55 1xks s SER 159 Cb -0.12 -0.82 -0.03 0.00 -1.71 0.00 0.00 66.02 63.34 1xks s SER 159 CO 0.10 0.01 -0.06 -0.31 1.20 0.00 0.00 173.24 174.19 1xks s TYR 160 N 0.79 2.97 0.05 3.44 1.51 -1.26 0.05 117.35 124.89 1xks s TYR 160 Ca -0.12 -0.07 -0.23 0.00 -1.01 0.00 0.00 57.07 55.63 1xks s TYR 160 Cb -0.15 -1.78 -0.06 0.00 -0.11 0.00 0.00 41.96 39.86 1xks s TYR 160 CO 0.02 0.23 0.70 -1.54 -1.11 0.00 0.00 175.55 173.85 1xks s SER 161 N -0.49 7.15 0.00 2.29 1.04 -0.28 -4.96 113.70 118.44 1xks s SER 161 Ca 0.07 1.37 0.00 0.00 0.48 0.00 0.00 55.95 57.87 1xks s SER 161 Cb -0.12 -2.43 0.00 0.00 0.10 0.00 0.00 66.02 63.57 1xks s SER 161 CO 0.02 0.09 0.00 -0.24 0.98 0.00 0.00 173.24 174.09 1xks n SER 162 N 2.54 0.00 -0.36 7.02 2.88 -1.26 -4.88 113.62 119.56 1xks n SER 162 Ca -0.05 0.00 0.26 0.00 -1.33 0.00 0.00 58.87 57.76 1xks n SER 162 Cb 0.50 0.00 0.53 0.00 -0.75 0.00 0.00 64.21 64.49 1xks n SER 162 CO 0.00 0.00 0.00 0.71 -1.23 0.00 0.00 175.04 174.52 1xks h THR 170 N 0.00 0.35 -0.24 2.46 1.35 -1.97 -3.54 112.91 111.32 1xks h THR 170 Ca 0.00 -0.10 -0.00 0.00 -0.55 0.00 0.00 66.41 65.75 1xks h THR 170 Cb 0.00 0.02 -0.01 0.00 -1.73 0.00 0.00 68.15 66.43 1xks h THR 170 CO 0.00 0.06 0.14 -0.61 -0.25 0.00 0.00 175.52 174.85 1xks h GLN 171 N 0.30 0.33 0.00 4.72 5.75 -1.96 -2.78 115.11 121.48 1xks h GLN 171 Ca 0.70 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 59.17 1xks h GLN 171 Cb 1.82 -0.07 0.00 0.00 1.07 0.00 0.00 27.48 30.31 1xks h GLN 171 CO -0.44 0.28 0.35 0.00 -2.65 0.00 0.00 178.83 176.38 1xks h ALA 172 N 1.03 1.29 -2.99 3.38 0.00 -1.95 -3.42 119.26 116.61 1xks h ALA 172 Ca 0.09 0.00 -0.66 0.00 0.00 0.00 0.00 54.91 54.33 1xks h ALA 172 Cb 0.04 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 17.58 1xks h ALA 172 CO -0.01 -0.29 -0.65 0.08 0.00 0.00 0.00 179.25 178.37 1xks s VAL 173 N -3.68 3.95 0.18 0.00 1.01 -1.06 -1.12 120.40 119.68 1xks s VAL 173 Ca -0.02 -0.44 0.04 0.00 0.00 0.00 0.00 61.98 61.56 1xks s VAL 173 Cb 0.06 -2.91 -0.04 0.00 0.00 0.00 0.00 36.38 33.49 1xks s VAL 173 CO 0.18 0.27 0.21 0.00 0.00 0.00 0.00 175.10 175.76 1xks s ALA 174 N 1.54 3.74 -0.04 5.51 0.00 0.11 -0.36 121.76 132.25 1xks s ALA 174 Ca 0.05 -1.18 0.01 0.00 0.00 0.00 0.00 51.96 50.83 1xks s ALA 174 Cb -0.16 -1.53 0.02 0.00 0.00 0.00 0.00 23.12 21.46 1xks s ALA 174 CO 0.01 0.45 -0.04 0.08 0.00 0.00 0.00 175.76 176.27 1xks s VAL 175 N -1.82 0.48 -0.02 0.00 1.01 0.16 -0.91 120.40 119.30 1xks s VAL 175 Ca 0.33 -0.08 0.06 0.00 0.00 0.00 0.00 61.98 62.28 1xks s VAL 175 Cb -0.10 -0.53 -0.01 0.00 0.00 0.00 0.00 36.38 35.74 1xks s VAL 175 CO 0.26 0.22 -0.20 -0.32 0.00 0.00 0.00 175.10 175.06 1xks s MET 176 N 0.99 1.68 0.09 2.72 1.75 -0.59 -0.03 119.30 125.90 1xks s MET 176 Ca -0.10 -0.71 0.06 0.00 -1.25 0.00 0.00 55.69 53.69 1xks s MET 176 Cb -0.14 -1.59 -0.03 0.00 2.84 0.00 0.00 34.83 35.91 1xks s MET 176 CO -0.00 0.41 -0.15 0.08 -0.65 0.00 0.00 175.02 174.70 1xks s VAL 177 N -0.39 1.26 0.10 10.11 1.01 -0.56 -0.85 120.40 131.09 1xks s VAL 177 Ca 0.06 -1.42 0.03 0.00 0.00 0.00 0.00 61.98 60.65 1xks s VAL 177 Cb -0.08 -1.24 -0.04 0.00 0.00 0.00 0.00 36.38 35.01 1xks s VAL 177 CO -0.00 -0.23 -0.09 0.00 0.00 0.00 0.00 175.10 174.78 1xks s ALA 178 N -1.41 1.08 0.34 5.51 0.00 -0.53 -1.49 121.76 125.26 1xks s ALA 178 Ca 0.01 -1.25 0.07 0.00 0.00 0.00 0.00 51.96 50.80 1xks s ALA 178 Cb -0.09 0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.08 1xks s ALA 178 CO 0.03 -0.10 0.35 0.95 0.00 0.00 0.00 175.76 176.99 1xks s THR 179 N -2.83 3.65 0.54 0.00 -4.23 -0.29 -4.81 115.64 107.67 1xks s THR 179 Ca 0.08 -1.26 0.31 0.00 -1.18 0.00 0.00 61.69 59.64 1xks s THR 179 Cb -0.00 -3.24 0.48 0.00 1.34 0.00 0.00 72.50 71.07 1xks s THR 179 CO -0.01 -0.16 1.90 0.03 -0.54 0.00 0.00 174.62 175.83 1xks h ARG 180 N 1.13 0.00 0.00 3.99 2.47 -1.87 0.14 114.38 120.24 1xks h ARG 180 Ca -0.45 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.27 1xks h ARG 180 Cb 1.26 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.58 1xks h ARG 180 CO 0.57 0.00 -0.45 1.05 0.56 0.00 0.00 179.97 181.70 1xks h GLU 181 N 0.00 0.00 0.00 0.04 9.09 -1.92 -1.70 114.58 120.09 1xks h GLU 181 Ca 0.41 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.82 1xks h GLU 181 Cb 1.65 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.75 1xks h GLU 181 CO -0.00 0.00 0.00 0.41 0.05 0.00 0.00 179.01 179.47 1xks n GLY 182 N 1.31 1.57 3.76 1.06 0.00 0.04 -4.82 105.19 108.11 1xks n GLY 182 Ca 0.04 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1xks n GLY 182 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1xks s SER 183 N -2.00 7.14 -0.08 1.61 0.01 -1.26 -1.29 113.70 117.83 1xks s SER 183 Ca 0.00 1.35 0.05 0.00 1.31 0.00 0.00 55.95 58.66 1xks s SER 183 Cb 0.00 -2.43 -0.00 0.00 0.21 0.00 0.00 66.02 63.80 1xks s SER 183 CO 0.00 0.07 -0.24 -0.63 0.41 0.00 0.00 173.24 172.85 1xks s ILE 184 N -0.21 2.02 -0.08 1.44 1.01 -0.23 -1.14 121.20 124.01 1xks s ILE 184 Ca 0.35 -1.01 0.02 0.00 0.00 0.00 0.00 60.65 60.01 1xks s ILE 184 Cb -0.20 -1.73 0.01 0.00 0.01 0.00 0.00 42.46 40.55 1xks s ILE 184 CO 0.21 0.55 -0.15 -0.60 0.00 0.00 0.00 174.94 174.96 1xks s ARG 185 N 0.16 2.01 -0.09 2.79 3.52 -0.56 -2.01 118.95 124.78 1xks s ARG 185 Ca -0.13 -0.51 0.04 0.00 -0.13 0.00 0.00 55.73 55.00 1xks s ARG 185 Cb -0.16 -1.64 0.00 0.00 -1.56 0.00 0.00 34.95 31.59 1xks s ARG 185 CO 0.07 0.03 -0.21 -0.47 -0.81 0.00 0.00 175.30 173.91 1xks s TYR 186 N 0.69 2.25 -0.24 5.12 5.04 0.29 -1.49 117.35 129.00 1xks s TYR 186 Ca -0.14 -0.89 -0.04 0.00 -2.44 0.00 0.00 57.07 53.57 1xks s TYR 186 Cb -0.16 -1.53 0.00 0.00 0.35 0.00 0.00 41.96 40.63 1xks s TYR 186 CO 0.03 -0.36 -0.02 -1.58 -1.34 0.00 0.00 175.55 172.28 1xks s TRP 187 N 0.38 3.03 0.47 4.97 0.51 0.96 -0.31 118.94 128.95 1xks s TRP 187 Ca -0.17 -1.11 0.20 0.00 -2.12 0.00 0.00 56.10 52.90 1xks s TRP 187 Cb -0.17 -2.13 1.25 0.00 -0.81 0.00 0.00 33.47 31.62 1xks s TRP 187 CO 0.07 -0.60 2.07 -1.35 -0.51 0.00 0.00 176.95 176.63 1xks h PRO 188 N 8.11 0.00 -3.11 4.98 0.11 -1.85 0.48 132.00 140.72 1xks h PRO 188 Ca -0.37 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 65.54 1xks h PRO 188 Cb 1.14 0.00 -0.29 0.00 0.11 0.00 0.00 31.00 31.96 1xks h PRO 188 CO 0.60 0.12 -0.50 0.45 -0.21 0.00 0.00 178.00 178.46 1xks s SER 189 N -6.71 -0.23 0.48 -2.05 0.15 -1.26 -4.10 113.70 99.98 1xks s SER 189 Ca -0.04 0.47 0.26 0.00 0.70 0.00 0.00 55.95 57.34 1xks s SER 189 Cb 0.15 0.39 1.20 0.00 -1.71 0.00 0.00 66.02 66.05 1xks s SER 189 CO 0.65 -0.14 1.95 0.25 1.20 0.00 0.00 173.24 177.15 1xks h LEU 190 N 6.80 0.00 -0.56 3.45 5.85 -0.60 -1.90 115.31 128.35 1xks h LEU 190 Ca -0.37 0.00 0.09 0.00 0.84 0.00 0.00 57.88 58.44 1xks h LEU 190 Cb 1.17 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.13 1xks h LEU 190 CO 0.38 0.17 0.18 0.00 -0.34 0.00 0.00 178.44 178.84 1xks h ALA 191 N 1.83 0.70 -2.44 1.25 0.00 -1.79 -3.34 119.26 115.45 1xks h ALA 191 Ca -0.00 0.09 -0.76 0.00 0.00 0.00 0.00 54.91 54.24 1xks h ALA 191 Cb 0.54 0.08 -0.24 0.00 0.00 0.00 0.00 17.79 18.17 1xks h ALA 191 CO 0.02 -0.23 0.13 0.20 0.00 0.00 0.00 179.25 179.37 1xks s GLY 192 N -3.08 2.34 0.47 0.00 0.00 -0.72 -4.89 107.32 101.44 1xks s GLY 192 Ca -0.13 -2.95 0.27 0.00 0.00 0.00 0.00 44.72 41.91 1xks s GLY 192 CO 0.74 1.38 1.79 0.83 0.00 0.00 0.00 173.10 177.85 1xks h GLU 193 N 8.32 0.00 -0.51 2.90 5.08 -1.76 -2.83 114.58 125.79 1xks h GLU 193 Ca -0.02 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1xks h GLU 193 Cb 1.06 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.31 1xks h GLU 193 CO 0.90 0.10 0.00 -0.25 -1.00 0.00 0.00 179.01 178.76 1xks n ASP 194 N -3.18 3.49 -4.28 1.42 9.92 -1.26 -4.78 116.55 117.87 1xks n ASP 194 Ca 0.02 -1.98 -0.38 0.00 -0.53 0.00 0.00 54.79 51.91 1xks n ASP 194 Cb 0.44 -0.33 -0.12 0.00 -0.64 0.00 0.00 41.12 40.47 1xks n ASP 194 CO 0.00 0.00 0.00 -0.89 0.13 0.00 0.00 177.20 176.44 1xks s THR 195 N -1.34 3.93 0.15 -3.53 2.01 -1.07 -5.05 115.64 110.74 1xks s THR 195 Ca 0.42 -1.17 -0.17 0.00 0.31 0.00 0.00 61.69 61.08 1xks s THR 195 Cb 0.23 -3.26 0.04 0.00 0.01 0.00 0.00 72.50 69.52 1xks s THR 195 CO 0.32 -0.25 0.45 -0.72 -0.69 0.00 0.00 174.62 173.72 1xks s TYR 196 N 1.41 -0.21 0.24 4.92 -0.85 -1.26 -4.25 117.35 117.36 1xks s TYR 196 Ca -0.00 -0.10 0.12 0.00 -0.52 0.00 0.00 57.07 56.56 1xks s TYR 196 Cb -0.20 0.32 -0.05 0.00 0.38 0.00 0.00 41.96 42.41 1xks s TYR 196 CO 0.03 -0.77 -0.20 0.95 -1.52 0.00 0.00 175.55 174.04 1xks s THR 197 N -3.82 2.50 0.31 -3.49 -4.23 0.58 -4.92 115.64 102.56 1xks s THR 197 Ca 0.04 -2.23 0.08 0.00 -1.18 0.00 0.00 61.69 58.41 1xks s THR 197 Cb 0.01 -2.27 -0.06 0.00 1.34 0.00 0.00 72.50 71.52 1xks s THR 197 CO -0.10 -0.28 -0.08 -1.61 -0.54 0.00 0.00 174.62 172.01 1xks s GLU 198 N -3.18 1.67 0.05 3.99 2.02 -1.26 0.10 118.70 122.09 1xks s GLU 198 Ca 0.26 -1.85 -0.25 0.00 0.02 0.00 0.00 54.97 53.16 1xks s GLU 198 Cb -0.06 -1.41 0.08 0.00 0.10 0.00 0.00 34.13 32.84 1xks s GLU 198 CO 0.13 0.10 1.14 0.00 0.02 0.00 0.00 175.26 176.65 1xks n ALA 199 N -0.67 -3.13 -3.35 5.21 0.00 -0.85 -4.81 120.51 112.90 1xks n ALA 199 Ca -0.05 -0.85 -0.15 0.00 0.00 0.00 0.00 53.44 52.39 1xks n ALA 199 Cb 0.63 0.30 -0.08 0.00 0.00 0.00 0.00 19.45 20.30 1xks n ALA 199 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1xks s PHE 200 N -2.14 -0.41 -0.04 0.00 -0.12 -1.26 -1.07 117.98 112.93 1xks s PHE 200 Ca 0.26 0.81 -0.06 0.00 -0.05 0.00 0.00 56.93 57.90 1xks s PHE 200 Cb -0.01 0.20 -0.02 0.00 -0.63 0.00 0.00 43.02 42.56 1xks s PHE 200 CO 0.02 -0.40 -0.11 0.28 -0.05 0.00 0.00 175.22 174.95 1xks n VAL 201 N 1.67 0.61 0.00 -2.49 0.31 -0.41 -5.01 118.33 113.01 1xks n VAL 201 Ca -0.18 0.30 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1xks n VAL 201 Cb 0.56 -1.70 0.00 0.00 -0.91 0.00 0.00 33.84 31.80 1xks n VAL 201 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1xks n ASP 206 N -3.23 0.00 -4.81 4.52 5.75 -1.26 -4.95 116.55 112.57 1xks n ASP 206 Ca -0.04 0.00 -0.36 0.00 -0.01 0.00 0.00 54.79 54.38 1xks n ASP 206 Cb 0.16 0.00 -0.07 0.00 -1.03 0.00 0.00 41.12 40.18 1xks n ASP 206 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1xks s LYS 207 N 0.00 3.82 -0.14 0.11 3.01 -1.26 -5.09 119.74 120.19 1xks s LYS 207 Ca 0.00 -0.14 0.00 0.00 -1.01 0.00 0.00 55.97 54.82 1xks s LYS 207 Cb 0.00 -3.30 -0.01 0.00 -1.01 0.00 0.00 37.83 33.51 1xks s LYS 207 CO 0.00 0.54 -0.14 0.99 0.51 0.00 0.00 175.35 177.25 1xks s THR 208 N -0.35 2.90 -0.20 2.17 2.01 -1.26 -4.62 115.64 116.29 1xks s THR 208 Ca 0.12 -0.71 -0.14 0.00 0.31 0.00 0.00 61.69 61.28 1xks s THR 208 Cb -0.12 -2.22 -0.04 0.00 0.01 0.00 0.00 72.50 70.13 1xks s THR 208 CO 0.02 0.52 0.31 -0.31 -0.69 0.00 0.00 174.62 174.47 1xks s TYR 209 N 0.50 3.38 -0.18 4.92 1.51 -0.64 -0.13 117.35 126.71 1xks s TYR 209 Ca -0.10 0.51 -0.11 0.00 -1.01 0.00 0.00 57.07 56.37 1xks s TYR 209 Cb -0.16 -2.41 -0.21 0.00 -0.11 0.00 0.00 41.96 39.07 1xks s TYR 209 CO 0.04 0.08 0.17 0.43 -1.11 0.00 0.00 175.55 175.16 1xks n SER 210 N 4.18 2.01 -4.12 2.29 7.64 0.05 -4.62 113.62 121.04 1xks n SER 210 Ca -0.11 0.25 -0.12 0.00 1.01 0.00 0.00 58.87 59.90 1xks n SER 210 Cb 0.51 -0.83 -0.11 0.00 -1.01 0.00 0.00 64.21 62.77 1xks n SER 210 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1xks s PHE 211 N -2.49 0.78 -0.04 1.43 0.40 -1.01 -4.50 117.98 112.55 1xks s PHE 211 Ca -0.28 -0.73 0.03 0.00 -0.60 0.00 0.00 56.93 55.35 1xks s PHE 211 Cb 0.08 -0.46 0.01 0.00 0.51 0.00 0.00 43.02 43.15 1xks s PHE 211 CO 0.66 -0.13 -0.11 -1.17 0.70 0.00 0.00 175.22 175.18 1xks s LEU 212 N -2.36 1.75 -0.05 -0.37 2.96 -0.61 -0.66 118.68 119.34 1xks s LEU 212 Ca 0.02 -0.24 -0.00 0.00 -0.22 0.00 0.00 54.13 53.69 1xks s LEU 212 Cb -0.02 -0.69 0.02 0.00 0.50 0.00 0.00 46.19 46.01 1xks s LEU 212 CO -0.03 0.07 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.16 1xks s THR 213 N 0.31 0.43 0.06 3.68 2.01 -0.64 -4.53 115.64 116.96 1xks s THR 213 Ca -0.06 0.00 -0.31 0.00 0.31 0.00 0.00 61.69 61.63 1xks s THR 213 Cb -0.11 -0.52 -0.08 0.00 0.01 0.00 0.00 72.50 71.80 1xks s THR 213 CO 0.01 0.23 1.64 0.00 -0.69 0.00 0.00 174.62 175.82 1xks s ALA 214 N 1.38 3.67 0.13 7.40 0.00 -1.26 -0.53 121.76 132.55 1xks s ALA 214 Ca -0.04 1.17 0.01 0.00 0.00 0.00 0.00 51.96 53.10 1xks s ALA 214 Cb -0.13 -3.70 -0.00 0.00 0.00 0.00 0.00 23.12 19.29 1xks s ALA 214 CO -0.02 -1.12 0.03 1.33 0.00 0.00 0.00 175.76 175.97 1xks n VAL 215 N 4.79 0.00 -1.80 0.00 0.24 -0.40 -4.92 118.33 116.23 1xks n VAL 215 Ca 0.16 -0.70 -0.32 0.00 -2.04 0.00 0.00 64.34 61.44 1xks n VAL 215 Cb 0.41 0.22 0.03 0.00 -1.47 0.00 0.00 33.84 33.04 1xks n VAL 215 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1xks s GLN 216 N -2.48 3.03 0.00 7.34 -2.07 -1.26 -3.27 119.66 120.95 1xks s GLN 216 Ca 0.05 1.17 0.00 0.00 -1.82 0.00 0.00 55.36 54.76 1xks s GLN 216 Cb 0.00 -1.99 0.00 0.00 -1.09 0.00 0.00 33.01 29.93 1xks s GLN 216 CO 0.03 -1.04 0.00 0.41 -1.32 0.00 0.00 175.29 173.37 1xks n GLY 217 N -1.17 0.48 2.34 2.60 0.00 -1.26 -3.75 105.19 104.42 1xks n GLY 217 Ca 0.09 -0.90 -0.17 0.00 0.00 0.00 0.00 46.02 45.04 1xks n GLY 217 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xks n GLY 218 N -1.89 -0.33 0.00 -0.02 0.00 -1.25 -4.98 105.19 96.72 1xks n GLY 218 Ca 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.85 1xks n GLY 218 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xks n SER 219 N -1.26 1.65 -3.74 1.61 3.41 -1.20 -4.59 113.62 109.49 1xks n SER 219 Ca -0.20 -0.96 -0.10 0.00 -0.26 0.00 0.00 58.87 57.35 1xks n SER 219 Cb 0.65 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.54 1xks n SER 219 CO 0.00 0.00 0.00 -0.36 -0.16 0.00 0.00 175.04 174.52 1xks s PHE 220 N -0.57 -0.05 -0.13 7.33 0.40 -0.89 -1.28 117.98 122.80 1xks s PHE 220 Ca 0.00 -0.28 0.03 0.00 -0.60 0.00 0.00 56.93 56.08 1xks s PHE 220 Cb 0.00 0.10 0.01 0.00 0.51 0.00 0.00 43.02 43.64 1xks s PHE 220 CO 0.00 -0.60 -0.22 0.42 0.70 0.00 0.00 175.22 175.52 1xks s ILE 221 N -3.58 2.00 -0.20 0.64 1.01 0.31 -0.91 121.20 120.48 1xks s ILE 221 Ca 0.02 -0.96 -0.13 0.00 0.00 0.00 0.00 60.65 59.58 1xks s ILE 221 Cb 0.03 -1.76 -0.04 0.00 0.01 0.00 0.00 42.46 40.69 1xks s ILE 221 CO -0.10 0.54 0.28 -0.22 0.00 0.00 0.00 174.94 175.45 1xks s LEU 222 N 0.70 4.18 -0.10 2.97 2.96 -0.19 -1.62 118.68 127.59 1xks s LEU 222 Ca -0.10 0.40 0.02 0.00 -0.22 0.00 0.00 54.13 54.22 1xks s LEU 222 Cb -0.16 -2.34 -0.01 0.00 0.50 0.00 0.00 46.19 44.18 1xks s LEU 222 CO 0.01 0.04 -0.17 -0.44 -1.32 0.00 0.00 176.35 174.47 1xks s SER 223 N 0.79 3.73 0.48 3.68 0.01 0.16 -1.41 113.70 121.15 1xks s SER 223 Ca 0.15 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.05 1xks s SER 223 Cb -0.14 -1.30 0.00 0.00 0.21 0.00 0.00 66.02 64.80 1xks s SER 223 CO 0.05 0.21 0.70 -0.94 0.41 0.00 0.00 173.24 173.67 1xks s SER 224 N 0.04 5.71 0.49 2.44 1.04 -0.17 -0.77 113.70 122.48 1xks s SER 224 Ca -0.06 0.24 0.16 0.00 0.48 0.00 0.00 55.95 56.76 1xks s SER 224 Cb -0.15 -1.40 1.16 0.00 0.10 0.00 0.00 66.02 65.73 1xks s SER 224 CO 0.05 -0.81 2.08 0.77 0.98 0.00 0.00 173.24 176.31 1xks h SER 225 N 0.31 0.00 -0.21 7.02 4.64 -0.86 0.31 113.55 124.76 1xks h SER 225 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1xks h SER 225 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1xks h SER 225 CO 0.56 0.09 0.00 0.61 -0.87 0.00 0.00 176.83 177.22 1xks n GLY 226 N -1.29 0.13 2.43 -0.77 0.00 -1.26 -1.16 105.19 103.28 1xks n GLY 226 Ca -0.03 -0.31 -0.18 0.00 0.00 0.00 0.00 46.02 45.50 1xks n GLY 226 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1xks n SER 227 N 0.19 -5.27 -4.69 1.61 3.41 0.11 -3.24 113.62 105.73 1xks n SER 227 Ca 0.11 0.20 -0.42 0.00 -0.26 0.00 0.00 58.87 58.50 1xks n SER 227 Cb 0.24 -4.36 -0.03 0.00 -0.26 0.00 0.00 64.21 59.80 1xks n SER 227 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1xks s GLN 228 N -4.29 4.25 -0.16 4.33 0.74 -1.26 -4.01 119.66 119.26 1xks s GLN 228 Ca 0.00 2.12 -0.06 0.00 0.05 0.00 0.00 55.36 57.47 1xks s GLN 228 Cb 0.00 -3.53 -0.03 0.00 1.10 0.00 0.00 33.01 30.55 1xks s GLN 228 CO 0.00 -0.62 0.02 -0.51 -0.55 0.00 0.00 175.29 173.63 1xks s LEU 229 N 2.29 3.58 -0.11 3.68 1.43 -0.73 -0.99 118.68 127.82 1xks s LEU 229 Ca 0.68 0.01 0.02 0.00 -1.03 0.00 0.00 54.13 53.80 1xks s LEU 229 Cb -0.35 -1.88 0.01 0.00 0.03 0.00 0.00 46.19 44.00 1xks s LEU 229 CO 0.29 0.19 -0.17 -0.63 0.23 0.00 0.00 176.35 176.26 1xks s ILE 230 N 0.26 1.61 0.08 -0.59 1.01 -0.50 -0.86 121.20 122.20 1xks s ILE 230 Ca 0.01 -0.72 -0.29 0.00 0.00 0.00 0.00 60.65 59.65 1xks s ILE 230 Cb -0.13 -1.46 -0.05 0.00 0.01 0.00 0.00 42.46 40.83 1xks s ILE 230 CO 0.01 0.46 0.92 -0.60 0.00 0.00 0.00 174.94 175.73 1xks s ARG 231 N 0.88 4.63 -0.14 2.79 6.06 0.04 -1.02 118.95 132.19 1xks s ARG 231 Ca -0.08 1.35 0.01 0.00 -2.50 0.00 0.00 55.73 54.51 1xks s ARG 231 Cb -0.15 -3.39 0.02 0.00 0.06 0.00 0.00 34.95 31.49 1xks s ARG 231 CO -0.00 0.19 -0.18 -0.51 -2.50 0.00 0.00 175.30 172.30 1xks s LEU 232 N 0.13 1.90 -0.21 -0.88 1.43 -0.09 -1.99 118.68 118.98 1xks s LEU 232 Ca 0.46 -0.53 -0.01 0.00 -1.03 0.00 0.00 54.13 53.01 1xks s LEU 232 Cb -0.22 -1.28 0.06 0.00 0.03 0.00 0.00 46.19 44.77 1xks s LEU 232 CO 0.28 0.01 -0.02 -0.63 0.23 0.00 0.00 176.35 176.22 1xks s ILE 233 N 1.11 1.07 0.19 -0.59 1.01 0.69 -2.08 121.20 122.61 1xks s ILE 233 Ca -0.02 -0.86 -0.31 0.00 0.00 0.00 0.00 60.65 59.46 1xks s ILE 233 Cb -0.14 -1.41 -0.10 0.00 0.01 0.00 0.00 42.46 40.82 1xks s ILE 233 CO -0.06 -0.09 1.55 -2.84 0.00 0.00 0.00 174.94 173.50 1xks s PRO 234 N 1.61 4.21 -0.02 2.79 0.02 -1.26 -0.66 135.00 141.70 1xks s PRO 234 Ca -0.03 2.38 -0.03 0.00 0.02 0.00 0.00 61.00 63.35 1xks s PRO 234 Cb -0.17 -3.13 -0.04 0.00 0.02 0.00 0.00 34.50 31.18 1xks s PRO 234 CO -0.07 -0.58 0.17 -1.21 -0.33 0.00 0.00 177.00 174.98 1xks s GLU 235 N 0.73 3.41 0.60 5.54 2.02 0.13 -4.91 118.70 126.22 1xks s GLU 235 Ca 0.68 -0.32 0.28 0.00 0.02 0.00 0.00 54.97 55.63 1xks s GLU 235 Cb -0.44 -3.09 1.38 0.00 0.10 0.00 0.00 34.13 32.09 1xks s GLU 235 CO 0.35 0.68 1.79 0.66 0.02 0.00 0.00 175.26 178.76 1xks h SER 236 N 3.93 0.00 -0.04 -0.19 4.64 -1.95 0.19 113.55 120.13 1xks h SER 236 Ca -0.49 0.00 0.01 0.00 -0.47 0.00 0.00 61.79 60.84 1xks h SER 236 Cb 1.19 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1xks h SER 236 CO 0.68 0.00 0.03 0.77 -0.87 0.00 0.00 176.83 177.43 1xks h SER 237 N 0.00 0.00 0.00 4.97 4.64 -2.02 -3.46 113.55 117.68 1xks h SER 237 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 1xks h SER 237 Cb 1.43 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.52 1xks h SER 237 CO -0.00 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.57 1xks n GLY 238 N -1.53 2.33 3.73 -0.77 0.00 0.67 -5.12 105.19 104.50 1xks n GLY 238 Ca -0.02 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1xks n GLY 238 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xks s LYS 239 N -0.27 1.31 -0.23 1.61 1.02 -1.25 -4.77 119.74 117.17 1xks s LYS 239 Ca 0.00 0.77 0.01 0.00 0.02 0.00 0.00 55.97 56.76 1xks s LYS 239 Cb 0.00 -1.82 0.06 0.00 -0.52 0.00 0.00 37.83 35.55 1xks s LYS 239 CO 0.00 -2.19 -0.06 0.42 -0.92 0.00 0.00 175.35 172.60 1xks s ILE 240 N -2.97 1.57 0.44 2.17 1.01 -1.26 0.21 121.20 122.37 1xks s ILE 240 Ca 0.63 -1.20 -0.21 0.00 0.00 0.00 0.00 60.65 59.87 1xks s ILE 240 Cb -0.17 -1.80 -0.10 0.00 0.01 0.00 0.00 42.46 40.40 1xks s ILE 240 CO 0.56 -0.05 1.00 -2.28 0.00 0.00 0.00 174.94 174.17 1xks s HIS 241 N 1.38 3.19 -0.02 3.97 5.65 0.17 -4.83 115.29 124.80 1xks s HIS 241 Ca -0.05 1.61 -0.05 0.00 0.25 0.00 0.00 55.06 56.81 1xks s HIS 241 Cb -0.18 -2.97 0.01 0.00 -1.18 0.00 0.00 32.58 28.25 1xks s HIS 241 CO -0.06 -0.45 0.12 1.14 -0.65 0.00 0.00 174.74 174.84 1xks s GLN 242 N -3.07 0.31 0.10 2.88 -2.07 -1.26 -0.22 119.66 116.33 1xks s GLN 242 Ca 0.63 -0.13 -0.13 0.00 -1.82 0.00 0.00 55.36 53.91 1xks s GLN 242 Cb -0.14 0.13 0.02 0.00 -1.09 0.00 0.00 33.01 31.94 1xks s GLN 242 CO 0.18 -0.06 0.32 -3.38 -1.32 0.00 0.00 175.29 171.02 1xks s HIS 243 N -0.68 -0.08 0.35 9.60 -3.43 -0.84 -4.99 115.29 115.22 1xks s HIS 243 Ca -0.08 -0.24 -0.21 0.00 -0.80 0.00 0.00 55.06 53.73 1xks s HIS 243 Cb -0.05 0.13 -0.10 0.00 -1.43 0.00 0.00 32.58 31.13 1xks s HIS 243 CO 0.01 -0.62 0.88 0.42 -2.00 0.00 0.00 174.74 173.43 1xks s ILE 244 N -3.58 4.41 0.47 -5.38 -1.09 -1.26 -0.78 121.20 113.98 1xks s ILE 244 Ca 0.02 1.47 -0.21 0.00 -2.23 0.00 0.00 60.65 59.70 1xks s ILE 244 Cb 0.02 -3.76 -0.08 0.00 -1.58 0.00 0.00 42.46 37.06 1xks s ILE 244 CO -0.10 -0.08 1.09 -0.76 -1.23 0.00 0.00 174.94 173.85 1xks s LEU 245 N -2.64 3.93 -0.09 2.97 1.43 -0.04 -4.85 118.68 119.39 1xks s LEU 245 Ca 0.54 2.09 -0.38 0.00 -1.03 0.00 0.00 54.13 55.35 1xks s LEU 245 Cb -0.13 -4.41 -0.16 0.00 0.03 0.00 0.00 46.19 41.52 1xks s LEU 245 CO 0.18 -0.84 1.58 -0.81 0.23 0.00 0.00 176.35 176.69 1xks n PRO 246 N -0.73 1.29 -2.53 1.29 -0.04 -1.26 -0.51 135.00 132.50 1xks n PRO 246 Ca 0.08 0.47 -0.17 0.00 -0.04 0.00 0.00 63.50 63.85 1xks n PRO 246 Cb 0.51 -2.15 -0.00 0.00 -0.04 0.00 0.00 33.50 31.81 1xks n PRO 246 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1xks n GLN 247 N 4.19 -2.34 -0.88 0.54 6.02 -1.26 -4.70 117.38 118.96 1xks n GLN 247 Ca 0.22 0.76 0.05 0.00 -0.01 0.00 0.00 57.00 58.02 1xks n GLN 247 Cb 0.18 -5.41 0.15 0.00 1.02 0.00 0.00 30.24 26.18 1xks n GLN 247 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xks n GLY 248 N -0.96 3.81 0.31 1.08 0.00 0.33 -4.76 105.19 105.00 1xks n GLY 248 Ca -0.17 -1.15 0.19 0.00 0.00 0.00 0.00 46.02 44.89 1xks n GLY 248 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1xks h GLN 249 N 0.98 0.00 0.00 1.61 1.08 -1.86 -1.95 115.11 114.97 1xks h GLN 249 Ca -0.07 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.13 1xks h GLN 249 Cb 1.29 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.72 1xks h GLN 249 CO 0.03 0.02 0.00 0.41 -0.95 0.00 0.00 178.83 178.34 1xks n GLY 250 N -0.88 1.04 3.28 3.46 0.00 -1.26 -4.32 105.19 106.50 1xks n GLY 250 Ca -0.02 -0.95 -0.21 0.00 0.00 0.00 0.00 46.02 44.84 1xks n GLY 250 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1xks s MET 251 N 0.00 1.11 0.28 1.61 -1.94 -1.20 -4.76 119.30 114.40 1xks s MET 251 Ca 0.00 -1.25 0.00 0.00 -1.71 0.00 0.00 55.69 52.73 1xks s MET 251 Cb 0.00 -1.16 0.00 0.00 2.01 0.00 0.00 34.83 35.68 1xks s MET 251 CO 0.00 0.24 0.00 0.43 -0.01 0.00 0.00 175.02 175.68 1xks n SER 270 N 0.65 -5.05 -4.51 3.03 7.64 -1.26 -5.11 113.62 109.01 1xks n SER 270 Ca -0.16 0.88 -0.42 0.00 1.01 0.00 0.00 58.87 60.18 1xks n SER 270 Cb 0.56 -3.56 -0.09 0.00 -1.01 0.00 0.00 64.21 60.11 1xks n SER 270 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1xks s ASP 271 N -2.75 6.16 -0.31 6.43 3.68 -1.26 -4.98 116.67 123.64 1xks s ASP 271 Ca 0.00 -0.49 0.11 0.00 2.13 0.00 0.00 52.55 54.30 1xks s ASP 271 Cb 0.00 -2.19 0.73 0.00 -1.45 0.00 0.00 42.92 40.01 1xks s ASP 271 CO 0.00 -0.42 1.76 0.18 0.13 0.00 0.00 175.17 176.83 1xks n LEU 272 N 5.38 5.83 -4.70 -1.34 4.77 -1.26 -4.09 117.00 121.60 1xks n LEU 272 Ca -0.09 -3.22 -0.56 0.00 -0.03 0.00 0.00 56.01 52.11 1xks n LEU 272 Cb 0.48 -0.72 -0.07 0.00 -2.33 0.00 0.00 43.42 40.78 1xks n LEU 272 CO 0.42 0.81 1.34 0.41 -1.33 0.00 0.00 177.39 179.04 1xks n THR 273 N -0.18 0.34 -2.56 -5.08 -1.04 -1.26 -3.86 114.28 100.64 1xks n THR 273 Ca 0.38 -0.06 -0.42 0.00 -2.04 0.00 0.00 64.05 61.91 1xks n THR 273 Cb 1.33 -1.32 -0.03 0.00 -1.82 0.00 0.00 70.33 68.49 1xks n THR 273 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 1xks s LEU 274 N 3.49 4.33 -0.26 -4.42 2.96 -0.31 -0.87 118.68 123.60 1xks s LEU 274 Ca 0.97 1.79 -0.06 0.00 -0.22 0.00 0.00 54.13 56.60 1xks s LEU 274 Cb -1.00 -3.57 -0.15 0.00 0.50 0.00 0.00 46.19 41.97 1xks s LEU 274 CO 0.62 -0.42 -0.26 -1.20 -1.32 0.00 0.00 176.35 173.76 1xks n SER 275 N 4.34 1.97 -3.61 3.68 7.64 0.64 -4.94 113.62 123.35 1xks n SER 275 Ca 0.08 0.11 -0.08 0.00 1.01 0.00 0.00 58.87 60.00 1xks n SER 275 Cb 0.48 -0.63 -0.02 0.00 -1.01 0.00 0.00 64.21 63.03 1xks n SER 275 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1xks s SER 276 N -7.01 -0.35 0.19 6.43 1.04 -1.10 -4.85 113.70 108.04 1xks s SER 276 Ca -0.36 -0.21 0.06 0.00 0.48 0.00 0.00 55.95 55.91 1xks s SER 276 Cb 0.12 0.53 -0.05 0.00 0.10 0.00 0.00 66.02 66.72 1xks s SER 276 CO 0.55 -0.92 -0.11 0.68 0.98 0.00 0.00 173.24 174.42 1xks s VAL 277 N -3.48 1.46 -0.02 5.02 -7.23 -1.26 -0.88 120.40 114.01 1xks s VAL 277 Ca 0.07 -2.14 -0.01 0.00 -1.81 0.00 0.00 61.98 58.09 1xks s VAL 277 Cb -0.02 -2.00 0.02 0.00 0.56 0.00 0.00 36.38 34.94 1xks s VAL 277 CO -0.04 -0.63 0.05 -0.22 -0.31 0.00 0.00 175.10 173.95 1xks s LEU 278 N -3.26 1.40 -0.22 1.32 2.96 0.17 -4.92 118.68 116.13 1xks s LEU 278 Ca 0.21 0.09 -0.04 0.00 -0.22 0.00 0.00 54.13 54.17 1xks s LEU 278 Cb 0.01 0.09 -0.01 0.00 0.50 0.00 0.00 46.19 46.78 1xks s LEU 278 CO 0.05 -0.08 -0.04 0.86 -1.32 0.00 0.00 176.35 175.82 1xks s TRP 279 N 0.58 2.96 -0.46 5.38 -0.00 -1.26 0.01 118.94 126.16 1xks s TRP 279 Ca -0.05 -0.89 -0.11 0.00 -0.00 0.00 0.00 56.10 55.06 1xks s TRP 279 Cb -0.07 -2.10 0.10 0.00 -0.00 0.00 0.00 33.47 31.40 1xks s TRP 279 CO -0.02 -0.51 0.33 0.34 -0.00 0.00 0.00 176.95 177.09 1xks s ASP 280 N 1.42 5.77 0.01 5.86 2.15 0.13 -5.00 116.67 127.01 1xks s ASP 280 Ca 0.05 -1.67 -0.25 0.00 0.43 0.00 0.00 52.55 51.10 1xks s ASP 280 Cb -0.14 -2.04 -0.16 0.00 -0.30 0.00 0.00 42.92 40.28 1xks s ASP 280 CO -0.03 -0.64 1.22 -0.09 -0.17 0.00 0.00 175.17 175.46 1xks h ARG 281 N 8.51 -0.52 -1.09 4.34 2.43 -1.96 -0.69 114.38 125.39 1xks h ARG 281 Ca -0.23 0.04 0.30 0.00 -0.81 0.00 0.00 59.98 59.27 1xks h ARG 281 Cb 1.08 0.12 -0.08 0.00 -0.42 0.00 0.00 29.97 30.67 1xks h ARG 281 CO 0.84 -0.22 0.73 0.93 -1.51 0.00 0.00 179.97 180.74 1xks h GLU 282 N -0.86 0.25 -0.38 0.20 5.08 -1.97 0.10 114.58 117.00 1xks h GLU 282 Ca -0.06 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.29 1xks h GLU 282 Cb 0.55 -0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1xks h GLU 282 CO 0.09 0.17 0.00 0.54 -1.00 0.00 0.00 179.01 178.81 1xks n ARG 283 N -4.51 3.11 -4.40 2.33 1.74 -1.18 -4.97 116.66 108.77 1xks n ARG 283 Ca 0.26 -2.54 -0.36 0.00 -0.77 0.00 0.00 57.85 54.44 1xks n ARG 283 Cb 1.01 -1.63 -0.09 0.00 -1.02 0.00 0.00 32.46 30.74 1xks n ARG 283 CO 0.00 0.00 0.00 0.43 -1.52 0.00 0.00 177.63 176.54 1xks n SER 284 N 0.27 -0.31 -4.28 0.55 7.64 0.35 -4.87 113.62 112.97 1xks n SER 284 Ca 0.18 -1.26 -0.31 0.00 1.01 0.00 0.00 58.87 58.49 1xks n SER 284 Cb 0.71 -1.65 -0.16 0.00 -1.01 0.00 0.00 64.21 62.09 1xks n SER 284 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1xks s SER 285 N -3.90 3.10 -0.16 6.43 0.01 -0.38 -1.31 113.70 117.50 1xks s SER 285 Ca 0.36 -0.50 0.01 0.00 1.31 0.00 0.00 55.95 57.13 1xks s SER 285 Cb -0.21 -0.83 0.00 0.00 0.21 0.00 0.00 66.02 65.19 1xks s SER 285 CO 1.01 0.25 -0.17 0.12 0.41 0.00 0.00 173.24 174.86 1xks s PHE 286 N -0.19 2.76 0.15 2.43 5.36 -0.44 0.21 117.98 128.26 1xks s PHE 286 Ca -0.03 -1.15 0.09 0.00 -0.96 0.00 0.00 56.93 54.89 1xks s PHE 286 Cb -0.14 -1.88 -0.04 0.00 -0.34 0.00 0.00 43.02 40.62 1xks s PHE 286 CO 0.03 -0.53 -0.17 0.71 -1.46 0.00 0.00 175.22 173.80 1xks s TYR 287 N 0.88 2.51 0.05 10.12 1.51 0.10 -0.94 117.35 131.58 1xks s TYR 287 Ca -0.04 -0.27 0.07 0.00 -1.01 0.00 0.00 57.07 55.81 1xks s TYR 287 Cb -0.15 -1.29 -0.03 0.00 -0.11 0.00 0.00 41.96 40.38 1xks s TYR 287 CO -0.02 0.44 -0.19 -1.54 -1.11 0.00 0.00 175.55 173.13 1xks s SER 288 N -2.41 2.25 -0.19 2.29 1.04 0.08 -0.66 113.70 116.10 1xks s SER 288 Ca 0.20 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 56.12 1xks s SER 288 Cb -0.10 -0.17 0.03 0.00 0.10 0.00 0.00 66.02 65.89 1xks s SER 288 CO 0.11 0.11 -0.17 -0.22 0.98 0.00 0.00 173.24 174.05 1xks s LEU 289 N -1.27 2.36 0.00 2.42 2.96 -0.06 -1.00 118.68 124.10 1xks s LEU 289 Ca 0.06 -0.80 0.00 0.00 -0.22 0.00 0.00 54.13 53.17 1xks s LEU 289 Cb -0.09 -1.45 0.00 0.00 0.50 0.00 0.00 46.19 45.16 1xks s LEU 289 CO 0.02 -0.05 0.02 0.35 -1.32 0.00 0.00 176.35 175.37 1xks n THR 290 N 4.60 0.00 0.24 3.68 -2.24 0.47 -0.26 114.28 120.77 1xks n THR 290 Ca -0.19 -0.50 0.14 0.00 -2.27 0.00 0.00 64.05 61.23 1xks n THR 290 Cb 0.48 -0.04 0.48 0.00 -2.10 0.00 0.00 70.33 69.15 1xks n THR 290 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1xks h SER 291 N 0.23 0.00 0.00 3.42 4.64 -1.19 -3.31 113.55 117.33 1xks h SER 291 Ca -0.09 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.23 1xks h SER 291 Cb 0.27 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.36 1xks h SER 291 CO 0.14 0.07 -1.03 -1.54 -0.87 0.00 0.00 176.83 173.61 1xks n SER 292 N -3.17 4.87 -3.65 4.97 3.41 -1.26 -4.69 113.62 114.11 1xks n SER 292 Ca 0.01 -0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.47 1xks n SER 292 Cb 0.41 0.50 -0.08 0.00 -0.26 0.00 0.00 64.21 64.78 1xks n SER 292 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xks s ASN 293 N -3.08 0.87 -0.15 4.04 2.20 -1.25 -2.73 114.94 114.85 1xks s ASN 293 Ca -0.00 -1.51 -0.02 0.00 -0.94 0.00 0.00 52.86 50.39 1xks s ASN 293 Cb 0.00 0.53 -0.02 0.00 -2.00 0.00 0.00 41.25 39.76 1xks s ASN 293 CO 0.02 -1.05 -0.08 -0.63 -2.94 0.00 0.00 177.10 172.42 1xks s ILE 294 N -3.63 3.51 0.10 0.54 1.01 -0.81 -0.40 121.20 121.53 1xks s ILE 294 Ca 0.36 -0.49 0.10 0.00 0.00 0.00 0.00 60.65 60.62 1xks s ILE 294 Cb 0.03 -2.52 -0.04 0.00 0.01 0.00 0.00 42.46 39.94 1xks s ILE 294 CO 0.19 0.50 -0.26 -0.44 0.00 0.00 0.00 174.94 174.94 1xks s SER 295 N 0.41 3.35 -0.03 3.58 0.01 -0.17 -0.15 113.70 120.70 1xks s SER 295 Ca -0.07 -0.67 0.02 0.00 1.31 0.00 0.00 55.95 56.55 1xks s SER 295 Cb -0.15 -0.29 0.01 0.00 0.21 0.00 0.00 66.02 65.80 1xks s SER 295 CO 0.04 0.21 -0.10 -0.75 0.41 0.00 0.00 173.24 173.05 1xks s LYS 296 N -1.80 1.10 0.12 12.44 2.20 -0.61 -0.75 119.74 132.44 1xks s LYS 296 Ca 0.14 -0.33 0.09 0.00 -0.36 0.00 0.00 55.97 55.51 1xks s LYS 296 Cb -0.10 -1.00 -0.04 0.00 -1.51 0.00 0.00 37.83 35.17 1xks s LYS 296 CO 0.05 0.10 -0.19 -1.58 -0.36 0.00 0.00 175.35 173.37 1xks s TRP 297 N 0.29 2.51 -0.19 4.03 0.51 -0.11 0.15 118.94 126.12 1xks s TRP 297 Ca -0.05 -0.27 -0.05 0.00 -2.12 0.00 0.00 56.10 53.61 1xks s TRP 297 Cb -0.10 -1.34 -0.03 0.00 -0.81 0.00 0.00 33.47 31.20 1xks s TRP 297 CO 0.01 0.38 -0.00 -1.21 -0.51 0.00 0.00 176.95 175.62 1xks s GLU 298 N -2.12 3.64 0.27 4.98 2.02 0.47 -1.32 118.70 126.64 1xks s GLU 298 Ca 0.17 -0.51 0.08 0.00 0.02 0.00 0.00 54.97 54.73 1xks s GLU 298 Cb -0.11 -3.06 -0.04 0.00 0.10 0.00 0.00 34.13 31.02 1xks s GLU 298 CO 0.10 0.05 0.12 -0.51 0.02 0.00 0.00 175.26 175.04 1xks s LEU 299 N 0.89 3.52 0.00 1.80 1.43 -0.42 -0.22 118.68 125.67 1xks s LEU 299 Ca 0.01 -0.46 0.00 0.00 -1.03 0.00 0.00 54.13 52.65 1xks s LEU 299 Cb -0.14 -2.05 0.00 0.00 0.03 0.00 0.00 46.19 44.03 1xks s LEU 299 CO 0.02 -0.06 0.00 -0.90 0.23 0.00 0.00 176.35 175.64 1xks n ASP 300 N -1.08 1.09 0.03 2.29 5.68 -0.36 -4.88 116.55 119.32 1xks n ASP 300 Ca -0.07 -0.14 0.07 0.00 -0.50 0.00 0.00 54.79 54.15 1xks n ASP 300 Cb 0.59 0.00 0.31 0.00 -1.14 0.00 0.00 41.12 40.88 1xks n ASP 300 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 1xks n ASP 301 N -0.28 0.15 0.00 -1.12 8.00 -1.26 -3.74 116.55 118.30 1xks n ASP 301 Ca 0.00 0.54 0.00 0.00 0.71 0.00 0.00 54.79 56.04 1xks n ASP 301 Cb 0.00 -0.57 0.00 0.00 -0.02 0.00 0.00 41.12 40.53 1xks n ASP 301 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1xks n SER 302 N -1.67 0.00 -2.94 -2.24 3.41 -1.26 -4.68 113.62 104.24 1xks n SER 302 Ca 0.03 -0.87 -0.13 0.00 -0.26 0.00 0.00 58.87 57.64 1xks n SER 302 Cb 0.15 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.09 1xks n SER 302 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1xks n SER 303 N 0.00 -1.67 -3.81 4.04 3.41 -1.25 -5.11 113.62 109.24 1xks n SER 303 Ca 0.00 -2.81 -0.12 0.00 -0.26 0.00 0.00 58.87 55.67 1xks n SER 303 Cb 0.22 2.97 -0.10 0.00 -0.26 0.00 0.00 64.21 67.03 1xks n SER 303 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1xks s GLU 304 N -2.58 0.51 -0.11 4.33 8.01 -1.26 -1.22 118.70 126.38 1xks s GLU 304 Ca 0.25 -0.15 0.02 0.00 0.01 0.00 0.00 54.97 55.10 1xks s GLU 304 Cb -0.02 0.23 0.01 0.00 -4.31 0.00 0.00 34.13 30.04 1xks s GLU 304 CO 0.18 -0.12 -0.16 0.21 0.01 0.00 0.00 175.26 175.37 1xks s LYS 305 N -1.02 2.35 0.06 1.61 2.20 0.70 -4.74 119.74 120.90 1xks s LYS 305 Ca -0.11 -0.61 -0.32 0.00 -0.36 0.00 0.00 55.97 54.57 1xks s LYS 305 Cb -0.05 -1.98 -0.11 0.00 -1.51 0.00 0.00 37.83 34.18 1xks s LYS 305 CO 0.02 -0.05 1.87 1.58 -0.36 0.00 0.00 175.35 178.41 1xks n HIS 306 N 4.18 2.51 -0.12 4.03 -0.00 -1.26 -0.40 115.22 124.16 1xks n HIS 306 Ca -0.19 -0.17 -0.21 0.00 -0.00 0.00 0.00 57.72 57.15 1xks n HIS 306 Cb 0.51 -2.73 -0.07 0.00 -0.00 0.00 0.00 29.99 27.70 1xks n HIS 306 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1xks n ALA 307 N 6.27 1.02 -3.44 1.57 0.00 0.12 -4.90 120.51 121.15 1xks n ALA 307 Ca 0.19 -0.92 -0.09 0.00 0.00 0.00 0.00 53.44 52.62 1xks n ALA 307 Cb 0.36 0.03 -0.03 0.00 0.00 0.00 0.00 19.45 19.81 1xks n ALA 307 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1xks s TYR 308 N -2.61 -0.13 -0.14 0.00 -0.85 -1.14 -4.95 117.35 107.53 1xks s TYR 308 Ca -0.34 -0.23 -0.01 0.00 -0.52 0.00 0.00 57.07 55.97 1xks s TYR 308 Cb 0.10 0.47 0.04 0.00 0.38 0.00 0.00 41.96 42.95 1xks s TYR 308 CO 0.47 -1.00 -0.02 -1.12 -1.52 0.00 0.00 175.55 172.36 1xks s SER 309 N -2.89 2.45 -0.14 -0.18 0.01 -1.26 -1.57 113.70 110.13 1xks s SER 309 Ca 0.10 -0.51 -0.13 0.00 1.31 0.00 0.00 55.95 56.72 1xks s SER 309 Cb -0.02 -0.71 -0.05 0.00 0.21 0.00 0.00 66.02 65.45 1xks s SER 309 CO -0.00 -0.21 0.29 0.26 0.41 0.00 0.00 173.24 173.99 1xks s TRP 310 N 1.78 3.51 -1.06 2.43 0.51 0.79 -4.93 118.94 121.97 1xks s TRP 310 Ca 0.02 0.63 -0.22 0.00 -2.12 0.00 0.00 56.10 54.41 1xks s TRP 310 Cb -0.15 -2.28 0.05 0.00 -0.81 0.00 0.00 33.47 30.28 1xks s TRP 310 CO -0.07 0.35 1.49 0.34 -0.51 0.00 0.00 176.95 178.54 1xks s ASP 311 N 0.10 6.54 0.37 2.95 -1.08 -1.26 -1.92 116.67 122.37 1xks s ASP 311 Ca 0.17 -1.58 0.20 0.00 -0.52 0.00 0.00 52.55 50.81 1xks s ASP 311 Cb -0.13 -2.57 0.31 0.00 -1.46 0.00 0.00 42.92 39.06 1xks s ASP 311 CO 0.05 -1.46 1.57 0.16 0.52 0.00 0.00 175.17 176.00 1xks h ILE 312 N 6.64 0.48 0.17 4.11 3.07 -1.87 -1.96 117.51 128.14 1xks h ILE 312 Ca 0.23 -1.58 0.00 0.00 1.55 0.00 0.00 64.86 65.06 1xks h ILE 312 Cb 0.99 2.16 -0.01 0.00 -0.27 0.00 0.00 36.82 39.69 1xks h ILE 312 CO 1.43 0.26 -0.17 -1.13 -1.05 0.00 0.00 178.15 177.49 1xks h ASN 313 N 0.00 -0.45 -0.12 2.16 -0.00 -1.86 0.51 115.58 115.83 1xks h ASN 313 Ca -0.00 0.04 0.04 0.00 -0.00 0.00 0.00 56.30 56.38 1xks h ASN 313 Cb 1.14 0.16 -0.05 0.00 -0.00 0.00 0.00 38.32 39.57 1xks h ASN 313 CO 0.03 -0.26 -0.18 -0.09 -0.00 0.00 0.00 177.43 176.94 1xks h ARG 314 N -0.37 -0.23 -0.20 6.67 2.43 -1.82 -2.73 114.38 118.13 1xks h ARG 314 Ca 0.00 0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.18 1xks h ARG 314 Cb 0.35 0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.94 1xks h ARG 314 CO -0.04 -0.15 0.11 0.00 -1.51 0.00 0.00 179.97 178.37 1xks h ALA 315 N 0.78 0.26 0.00 2.80 0.00 -0.94 -3.37 119.26 118.79 1xks h ALA 315 Ca 0.09 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xks h ALA 315 Cb 0.37 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1xks h ALA 315 CO -0.26 -0.20 -1.50 1.28 0.00 0.00 0.00 179.25 178.57 1xks n LEU 316 N -4.88 0.44 -0.26 0.00 4.77 0.18 -4.57 117.00 112.68 1xks n LEU 316 Ca -0.04 -0.16 -0.10 0.00 -0.03 0.00 0.00 56.01 55.68 1xks n LEU 316 Cb 0.08 -0.02 -0.09 0.00 -2.33 0.00 0.00 43.42 41.07 1xks n LEU 316 CO 0.34 0.08 0.49 0.50 -1.33 0.00 0.00 177.39 177.48 1xks h LYS 317 N 0.00 -0.14 -0.58 3.23 3.64 -1.61 0.30 116.57 121.41 1xks h LYS 317 Ca 0.00 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.40 1xks h LYS 317 Cb 0.80 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 1xks h LYS 317 CO 0.00 -0.09 0.38 1.49 -2.27 0.00 0.00 179.45 178.96 1xks h GLU 318 N -0.14 0.76 -0.54 1.90 4.57 -1.85 0.00 114.58 119.28 1xks h GLU 318 Ca 0.11 -0.05 -0.11 0.00 -1.18 0.00 0.00 59.36 58.13 1xks h GLU 318 Cb 0.42 -0.17 -0.02 0.00 -0.16 0.00 0.00 28.75 28.82 1xks h GLU 318 CO -0.68 0.50 -0.10 -0.91 -1.18 0.00 0.00 179.01 176.64 1xks h ASN 319 N 0.78 1.02 0.41 1.04 2.35 -1.32 0.36 115.58 120.22 1xks h ASN 319 Ca 0.21 -0.33 -0.02 0.00 -0.55 0.00 0.00 56.30 55.61 1xks h ASN 319 Cb -0.08 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.02 1xks h ASN 319 CO -0.05 1.12 -0.20 0.40 -1.65 0.00 0.00 177.43 177.06 1xks h ILE 320 N 0.91 0.48 -0.10 2.81 2.04 0.35 -1.75 117.51 122.25 1xks h ILE 320 Ca 0.14 -0.54 -0.05 0.00 1.00 0.00 0.00 64.86 65.42 1xks h ILE 320 Cb 0.66 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1xks h ILE 320 CO 0.05 0.08 -0.16 0.71 0.00 0.00 0.00 178.15 178.82 1xks h THR 321 N -0.91 1.17 -0.14 -0.27 1.35 -1.01 -1.57 112.91 111.53 1xks h THR 321 Ca -0.06 -0.79 -0.11 0.00 -0.55 0.00 0.00 66.41 64.91 1xks h THR 321 Cb 0.56 1.28 -0.01 0.00 -1.73 0.00 0.00 68.15 68.25 1xks h THR 321 CO 0.09 0.24 -0.39 -0.78 -0.25 0.00 0.00 175.52 174.43 1xks h ASP 322 N 0.15 0.33 1.53 5.36 -0.00 -0.25 -0.93 116.42 122.61 1xks h ASP 322 Ca 0.03 -0.13 -0.02 0.00 -0.00 0.00 0.00 57.03 56.90 1xks h ASP 322 Cb 0.39 -0.09 -0.00 0.00 -0.00 0.00 0.00 39.33 39.62 1xks h ASP 322 CO 0.02 0.69 -0.11 0.00 -0.00 0.00 0.00 179.24 179.85 1xks h ALA 323 N 1.33 0.95 0.00 -0.78 0.00 -0.35 -1.98 119.26 118.43 1xks h ALA 323 Ca 0.03 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xks h ALA 323 Cb 0.80 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.58 1xks h ALA 323 CO 0.06 0.13 -0.52 -0.89 0.00 0.00 0.00 179.25 178.04 1xks n ILE 324 N -3.16 0.85 1.24 0.00 5.41 -0.99 -4.75 119.36 117.96 1xks n ILE 324 Ca 0.02 0.30 0.13 0.00 1.00 0.00 0.00 62.75 64.20 1xks n ILE 324 Cb 0.49 -2.00 0.30 0.00 -0.71 0.00 0.00 39.64 37.72 1xks n ILE 324 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 176.55 177.34 1xks n TRP 325 N -3.63 0.00 -0.21 1.39 8.01 -0.38 -4.70 117.44 117.93 1xks n TRP 325 Ca -0.07 0.00 0.31 0.00 -1.31 0.00 0.00 57.50 56.43 1xks n TRP 325 Cb 0.27 -0.02 0.72 0.00 -2.01 0.00 0.00 31.31 30.27 1xks n TRP 325 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 177.69 177.46 1xks h GLY 326 N 4.81 0.00 -2.22 6.99 0.00 -1.15 -0.65 103.07 110.85 1xks h GLY 326 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xks h GLY 326 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.98 1xks n SER 327 N -4.01 3.42 -4.74 0.19 7.64 -1.26 -4.86 113.62 110.00 1xks n SER 327 Ca 0.21 -1.97 -0.41 0.00 1.01 0.00 0.00 58.87 57.71 1xks n SER 327 Cb 1.11 -0.26 -0.04 0.00 -1.01 0.00 0.00 64.21 64.01 1xks n SER 327 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 1xks s GLU 328 N -1.38 4.67 0.25 1.43 0.41 -0.25 -4.92 118.70 118.91 1xks s GLU 328 Ca 0.37 1.61 -0.08 0.00 -0.41 0.00 0.00 54.97 56.46 1xks s GLU 328 Cb 0.22 -3.30 0.41 0.00 -1.78 0.00 0.00 34.13 29.67 1xks s GLU 328 CO 0.30 0.19 1.61 0.66 -0.49 0.00 0.00 175.26 177.53 1xks h SER 329 N 5.01 -0.55 -0.75 -0.19 4.64 -1.92 -0.65 113.55 119.14 1xks h SER 329 Ca -0.44 0.22 -0.46 0.00 -0.47 0.00 0.00 61.79 60.65 1xks h SER 329 Cb 1.21 0.43 -0.22 0.00 -0.31 0.00 0.00 62.40 63.50 1xks h SER 329 CO 0.71 -0.23 0.58 -0.46 -0.87 0.00 0.00 176.83 176.56 1xks n ASN 330 N -5.44 5.53 -0.27 4.97 6.94 -1.26 -4.69 115.26 121.03 1xks n ASN 330 Ca 0.13 -3.34 0.07 0.00 -0.02 0.00 0.00 54.58 51.42 1xks n ASN 330 Cb 0.46 -0.90 0.21 0.00 -2.36 0.00 0.00 39.78 37.19 1xks n ASN 330 CO 0.00 0.00 0.00 0.22 -1.03 0.00 0.00 177.26 176.45 1xks h TYR 331 N 1.30 0.55 -0.66 -2.53 3.20 -1.35 -1.25 116.97 116.21 1xks h TYR 331 Ca 0.47 0.04 -0.06 0.00 3.14 0.00 0.00 58.73 62.32 1xks h TYR 331 Cb 1.55 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 39.67 1xks h TYR 331 CO 1.16 0.04 0.18 0.93 -1.64 0.00 0.00 178.16 178.83 1xks h GLU 332 N 0.44 1.03 0.29 1.82 4.39 -1.86 0.14 114.58 120.83 1xks h GLU 332 Ca 0.45 -0.22 -0.01 0.00 0.34 0.00 0.00 59.36 59.91 1xks h GLU 332 Cb 0.73 -0.15 0.00 0.00 -0.10 0.00 0.00 28.75 29.23 1xks h GLU 332 CO -0.44 0.90 -0.14 0.00 -1.16 0.00 0.00 179.01 178.18 1xks h ALA 333 N 1.20 -0.38 -0.84 3.43 0.00 -1.84 -3.30 119.26 117.54 1xks h ALA 333 Ca 0.21 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 55.03 1xks h ALA 333 Cb 0.32 0.15 -0.12 0.00 0.00 0.00 0.00 17.79 18.14 1xks h ALA 333 CO -0.00 -0.48 -0.51 0.82 0.00 0.00 0.00 179.25 179.07 1xks h ILE 334 N -0.85 0.02 -0.68 0.00 2.04 -1.13 -3.19 117.51 113.72 1xks h ILE 334 Ca -0.04 0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.94 1xks h ILE 334 Cb 0.52 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 36.57 1xks h ILE 334 CO 0.06 0.00 0.46 0.07 0.00 0.00 0.00 178.15 178.74 1xks h LYS 335 N -0.10 0.43 0.00 2.37 2.10 -0.79 0.43 116.57 121.01 1xks h LYS 335 Ca 0.19 -0.03 0.00 0.00 -2.00 0.00 0.00 60.65 58.82 1xks h LYS 335 Cb 0.51 -0.10 0.00 0.00 -0.90 0.00 0.00 32.23 31.74 1xks h LYS 335 CO -0.85 0.29 0.00 0.39 -2.00 0.00 0.00 179.45 177.27 1xks n GLU 336 N -4.48 0.02 -0.21 0.07 -0.58 -1.20 -1.79 120.64 112.47 1xks n GLU 336 Ca 0.12 0.18 0.11 0.00 -0.42 0.00 0.00 57.16 57.15 1xks n GLU 336 Cb 0.43 -1.53 0.22 0.00 -0.57 0.00 0.00 31.44 29.99 1xks n GLU 336 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1xks n GLY 337 N 0.53 1.84 3.72 0.62 0.00 0.14 -4.98 105.19 107.06 1xks n GLY 337 Ca 0.05 -0.70 -0.42 0.00 0.00 0.00 0.00 46.02 44.95 1xks n GLY 337 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xks s VAL 338 N -1.33 4.04 -0.12 1.61 1.01 -0.74 -4.60 120.40 120.27 1xks s VAL 338 Ca 0.38 1.51 -0.17 0.00 0.00 0.00 0.00 61.98 63.69 1xks s VAL 338 Cb 0.22 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.58 1xks s VAL 338 CO 0.30 0.15 0.45 0.20 0.00 0.00 0.00 175.10 176.19 1xks s ASN 339 N 0.83 6.66 -0.06 3.32 0.01 0.38 -4.96 114.94 121.11 1xks s ASN 339 Ca 0.57 0.78 0.03 0.00 -0.71 0.00 0.00 52.86 53.53 1xks s ASN 339 Cb -0.29 -2.27 0.01 0.00 0.41 0.00 0.00 41.25 39.10 1xks s ASN 339 CO 0.30 0.03 -0.16 -0.63 -1.51 0.00 0.00 177.10 175.13 1xks s ILE 340 N 0.52 1.39 -0.08 0.60 1.01 -1.26 -1.10 121.20 122.29 1xks s ILE 340 Ca 0.25 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 60.28 1xks s ILE 340 Cb -0.15 -1.23 0.00 0.00 0.01 0.00 0.00 42.46 41.09 1xks s ILE 340 CO 0.10 0.41 -0.20 -0.13 0.00 0.00 0.00 174.94 175.12 1xks s ARG 341 N 0.40 2.44 -0.20 2.79 1.81 0.39 -4.97 118.95 121.61 1xks s ARG 341 Ca -0.12 -0.71 -0.16 0.00 -1.72 0.00 0.00 55.73 53.02 1xks s ARG 341 Cb -0.15 -1.92 -0.04 0.00 -0.45 0.00 0.00 34.95 32.39 1xks s ARG 341 CO 0.04 0.16 0.41 0.71 -0.68 0.00 0.00 175.30 175.94 1xks s TYR 342 N 0.35 3.38 -0.03 -0.53 1.51 -1.26 0.42 117.35 121.19 1xks s TYR 342 Ca -0.14 0.64 0.03 0.00 -1.01 0.00 0.00 57.07 56.58 1xks s TYR 342 Cb -0.16 -2.53 -0.04 0.00 -0.11 0.00 0.00 41.96 39.12 1xks s TYR 342 CO 0.06 0.00 0.01 1.28 -1.11 0.00 0.00 175.55 175.79 1xks n LEU 343 N 4.42 0.05 -3.60 -1.29 4.77 0.20 -4.82 117.00 116.72 1xks n LEU 343 Ca -0.08 -0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.77 1xks n LEU 343 Cb 0.51 0.07 -0.05 0.00 -2.33 0.00 0.00 43.42 41.62 1xks n LEU 343 CO 0.40 0.08 0.23 -0.62 -1.33 0.00 0.00 177.39 176.16 1xks s ASP 344 N -3.39 -0.38 -0.06 -1.43 -1.08 -1.17 -4.48 116.67 104.69 1xks s ASP 344 Ca -0.02 0.09 -0.02 0.00 -0.52 0.00 0.00 52.55 52.08 1xks s ASP 344 Cb 0.01 0.47 0.04 0.00 -1.46 0.00 0.00 42.92 41.98 1xks s ASP 344 CO 0.12 -0.71 0.11 -0.22 0.52 0.00 0.00 175.17 174.98 1xks s LEU 345 N -2.04 0.35 0.00 -1.34 2.96 -1.26 -1.46 118.68 115.89 1xks s LEU 345 Ca -0.05 0.21 0.05 0.00 -0.22 0.00 0.00 54.13 54.11 1xks s LEU 345 Cb -0.01 0.12 -0.02 0.00 0.50 0.00 0.00 46.19 46.79 1xks s LEU 345 CO -0.03 -0.21 0.17 0.29 -1.32 0.00 0.00 176.35 175.25 1xks n LYS 346 N 4.89 0.51 -3.95 1.98 4.76 -0.35 -4.73 118.16 121.27 1xks n LYS 346 Ca -0.13 -2.76 -0.09 0.00 -2.87 0.00 0.00 58.31 52.46 1xks n LYS 346 Cb 0.50 1.82 -0.10 0.00 -1.84 0.00 0.00 35.03 35.41 1xks n LYS 346 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 1xks s GLN 347 N -3.19 0.51 0.08 1.97 -2.07 -1.26 -0.17 119.66 115.53 1xks s GLN 347 Ca 0.23 -0.71 0.01 0.00 -1.82 0.00 0.00 55.36 53.07 1xks s GLN 347 Cb 0.01 0.20 -0.00 0.00 -1.09 0.00 0.00 33.01 32.12 1xks s GLN 347 CO 0.17 -0.12 0.09 0.27 -1.32 0.00 0.00 175.29 174.38 1xks n ASN 348 N 1.00 -0.24 0.09 12.60 0.23 0.14 -4.85 115.26 124.23 1xks n ASN 348 Ca -0.20 -1.51 0.01 0.00 -0.53 0.00 0.00 54.58 52.34 1xks n ASN 348 Cb 0.57 0.50 0.34 0.00 -2.08 0.00 0.00 39.78 39.12 1xks n ASN 348 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xks n ASP 350 N -4.23 0.00 0.00 0.00 9.92 -1.26 -4.97 116.55 116.01 1xks n ASP 350 Ca -0.01 0.50 0.00 0.00 -0.53 0.00 0.00 54.79 54.76 1xks n ASP 350 Cb 0.30 -0.50 0.00 0.00 -0.64 0.00 0.00 41.12 40.28 1xks n ASP 350 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1xks n GLY 351 N -1.26 0.28 3.76 0.44 0.00 0.23 -4.38 105.19 104.25 1xks n GLY 351 Ca 0.01 -1.74 -0.40 0.00 0.00 0.00 0.00 46.02 43.89 1xks n GLY 351 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xks s LEU 352 N 0.00 4.49 -0.21 0.99 1.43 0.07 0.26 118.68 125.71 1xks s LEU 352 Ca 0.00 1.46 0.02 0.00 -1.03 0.00 0.00 54.13 54.58 1xks s LEU 352 Cb 0.00 -3.20 0.03 0.00 0.03 0.00 0.00 46.19 43.06 1xks s LEU 352 CO 0.00 0.09 -0.17 -0.69 0.23 0.00 0.00 176.35 175.82 1xks s VAL 353 N -0.44 2.07 -0.14 -1.59 1.01 0.76 -1.50 120.40 120.58 1xks s VAL 353 Ca 0.36 -1.17 -0.02 0.00 0.00 0.00 0.00 61.98 61.15 1xks s VAL 353 Cb -0.21 -1.99 -0.02 0.00 0.00 0.00 0.00 36.38 34.16 1xks s VAL 353 CO 0.23 0.34 -0.07 -0.63 0.00 0.00 0.00 175.10 174.96 1xks s ILE 354 N 1.23 3.56 -0.24 2.22 1.01 0.98 -1.21 121.20 128.75 1xks s ILE 354 Ca 0.00 -0.48 -0.17 0.00 0.00 0.00 0.00 60.65 60.01 1xks s ILE 354 Cb -0.15 -2.53 -0.03 0.00 0.01 0.00 0.00 42.46 39.75 1xks s ILE 354 CO -0.10 0.51 0.44 -0.22 0.00 0.00 0.00 174.94 175.57 1xks s LEU 355 N 0.32 4.08 -0.01 2.97 2.96 -0.53 0.48 118.68 128.95 1xks s LEU 355 Ca -0.06 0.46 0.03 0.00 -0.22 0.00 0.00 54.13 54.34 1xks s LEU 355 Cb -0.15 -2.56 -0.01 0.00 0.50 0.00 0.00 46.19 43.98 1xks s LEU 355 CO 0.04 -0.19 -0.12 0.00 -1.32 0.00 0.00 176.35 174.76 1xks s ALA 356 N 1.93 0.98 -0.14 5.97 0.00 -0.59 0.59 121.76 130.52 1xks s ALA 356 Ca 0.19 -0.48 -0.06 0.00 0.00 0.00 0.00 51.96 51.61 1xks s ALA 356 Cb -0.15 -0.28 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 1xks s ALA 356 CO 0.09 0.22 0.06 0.00 0.00 0.00 0.00 175.76 176.14 1xks s ALA 357 N -0.16 3.49 0.01 0.00 0.00 0.17 -1.01 121.76 124.26 1xks s ALA 357 Ca 0.03 -0.74 0.05 0.00 0.00 0.00 0.00 51.96 51.30 1xks s ALA 357 Cb -0.06 -1.79 -0.02 0.00 0.00 0.00 0.00 23.12 21.25 1xks s ALA 357 CO -0.00 0.42 -0.14 0.00 0.00 0.00 0.00 175.76 176.04 1xks s ALA 358 N -0.39 1.19 0.11 0.00 0.00 0.23 -0.46 121.76 122.44 1xks s ALA 358 Ca 0.09 -0.73 -0.15 0.00 0.00 0.00 0.00 51.96 51.17 1xks s ALA 358 Cb -0.12 -0.25 0.03 0.00 0.00 0.00 0.00 23.12 22.79 1xks s ALA 358 CO 0.02 0.26 0.37 1.67 0.00 0.00 0.00 175.76 178.08 1xks s TRP 359 N -0.59 -0.16 -0.32 0.00 -2.14 -0.26 -0.61 118.94 114.86 1xks s TRP 359 Ca 0.04 -0.13 0.01 0.00 2.66 0.00 0.00 56.10 58.68 1xks s TRP 359 Cb -0.07 0.21 0.10 0.00 -3.10 0.00 0.00 33.47 30.61 1xks s TRP 359 CO 0.00 -0.66 0.07 -1.58 -2.66 0.00 0.00 176.95 172.12 1xks s HIS 360 N -3.60 2.61 0.20 1.66 5.65 -1.26 -0.47 115.29 120.07 1xks s HIS 360 Ca 0.02 -2.27 0.06 0.00 0.25 0.00 0.00 55.06 53.12 1xks s HIS 360 Cb 0.02 -2.22 0.61 0.00 -1.18 0.00 0.00 32.58 29.81 1xks s HIS 360 CO -0.10 -0.90 0.95 0.43 -0.65 0.00 0.00 174.74 174.46 1xks n SER 361 N 4.59 0.05 -0.09 9.88 7.64 -1.26 -0.84 113.62 133.58 1xks n SER 361 Ca -0.00 1.02 0.13 0.00 1.01 0.00 0.00 58.87 61.03 1xks n SER 361 Cb 0.42 -0.42 0.50 0.00 -1.01 0.00 0.00 64.21 63.70 1xks n SER 361 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xks n ALA 362 N -3.02 2.91 -1.67 -0.43 0.00 -1.26 -4.82 120.51 112.22 1xks n ALA 362 Ca 0.18 -0.28 -0.38 0.00 0.00 0.00 0.00 53.44 52.96 1xks n ALA 362 Cb 0.60 -1.28 0.05 0.00 0.00 0.00 0.00 19.45 18.82 1xks n ALA 362 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1xks n ASP 363 N -1.12 1.65 -3.61 0.00 9.92 -0.02 -5.00 116.55 118.36 1xks n ASP 363 Ca 0.11 0.89 -0.27 0.00 -0.53 0.00 0.00 54.79 54.98 1xks n ASP 363 Cb 0.31 -1.47 -0.16 0.00 -0.64 0.00 0.00 41.12 39.15 1xks n ASP 363 CO 0.00 0.00 0.00 0.21 0.13 0.00 0.00 177.20 177.54 1xks s ASN 364 N -1.11 2.80 0.44 -2.24 2.47 -1.26 -3.05 114.94 112.99 1xks s ASN 364 Ca 0.74 -0.86 -0.24 0.00 0.42 0.00 0.00 52.86 52.92 1xks s ASN 364 Cb -0.42 -0.34 -0.08 0.00 -1.45 0.00 0.00 41.25 38.96 1xks s ASN 364 CO 0.48 -0.37 1.18 -2.16 -3.72 0.00 0.00 177.10 172.50 1xks s PRO 365 N 2.08 3.84 -0.43 0.43 0.04 -1.26 -5.12 135.00 134.58 1xks s PRO 365 Ca 0.04 1.83 -0.21 0.00 0.04 0.00 0.00 61.00 62.70 1xks s PRO 365 Cb -0.16 -2.50 0.02 0.00 0.04 0.00 0.00 34.50 31.90 1xks s PRO 365 CO -0.17 -0.49 0.65 0.00 0.04 0.00 0.00 177.00 177.03 1xks s LEU 367 N 2.85 3.55 -0.20 0.00 1.43 -1.26 -0.72 118.68 124.32 1xks s LEU 367 Ca 0.23 -0.51 -0.09 0.00 -1.03 0.00 0.00 54.13 52.74 1xks s LEU 367 Cb -0.14 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 1xks s LEU 367 CO 0.19 -0.24 0.10 -0.63 0.23 0.00 0.00 176.35 176.00 1xks s ILE 368 N -2.29 5.05 -0.22 -0.59 1.01 -0.21 -4.53 121.20 119.42 1xks s ILE 368 Ca 0.38 0.06 -0.09 0.00 0.00 0.00 0.00 60.65 61.00 1xks s ILE 368 Cb -0.06 -3.30 -0.05 0.00 0.01 0.00 0.00 42.46 39.06 1xks s ILE 368 CO 0.25 0.43 0.12 -0.31 0.00 0.00 0.00 174.94 175.43 1xks s TYR 369 N 0.55 3.29 -0.24 3.97 1.51 0.22 -3.62 117.35 123.03 1xks s TYR 369 Ca 0.05 0.14 -0.08 0.00 -1.01 0.00 0.00 57.07 56.17 1xks s TYR 369 Cb -0.12 -2.20 -0.04 0.00 -0.11 0.00 0.00 41.96 39.48 1xks s TYR 369 CO 0.00 0.08 0.10 0.71 -1.11 0.00 0.00 175.55 175.33 1xks s TYR 370 N 0.85 3.17 0.13 2.71 1.51 -1.23 0.77 117.35 125.26 1xks s TYR 370 Ca 0.06 -0.14 0.08 0.00 -1.01 0.00 0.00 57.07 56.06 1xks s TYR 370 Cb -0.13 -2.23 -0.04 0.00 -0.11 0.00 0.00 41.96 39.46 1xks s TYR 370 CO 0.03 -0.16 -0.19 -1.12 -1.11 0.00 0.00 175.55 173.00 1xks s SER 371 N 1.28 2.50 -0.24 2.29 0.01 -0.18 -0.99 113.70 118.36 1xks s SER 371 Ca 0.05 -0.77 -0.07 0.00 1.31 0.00 0.00 55.95 56.48 1xks s SER 371 Cb -0.15 -0.13 -0.02 0.00 0.21 0.00 0.00 66.02 65.93 1xks s SER 371 CO 0.04 -0.01 0.05 -0.76 0.41 0.00 0.00 173.24 172.97 1xks s LEU 372 N -2.29 3.34 -0.18 2.44 1.43 -0.53 -1.54 118.68 121.35 1xks s LEU 372 Ca 0.10 -0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 52.93 1xks s LEU 372 Cb -0.08 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.24 1xks s LEU 372 CO 0.05 -0.03 -0.04 -0.63 0.23 0.00 0.00 176.35 175.93 1xks s ILE 373 N 1.57 3.67 -0.14 -0.59 1.01 0.18 -1.95 121.20 124.94 1xks s ILE 373 Ca 0.06 -0.42 -0.00 0.00 0.00 0.00 0.00 60.65 60.29 1xks s ILE 373 Cb -0.15 -2.63 -0.01 0.00 0.01 0.00 0.00 42.46 39.68 1xks s ILE 373 CO 0.02 0.46 -0.12 0.42 0.00 0.00 0.00 174.94 175.72 1xks s THR 374 N 0.81 3.08 0.12 2.92 -4.23 -0.63 -0.01 115.64 117.69 1xks s THR 374 Ca -0.01 -0.65 0.03 0.00 -1.18 0.00 0.00 61.69 59.88 1xks s THR 374 Cb -0.15 -2.30 -0.04 0.00 1.34 0.00 0.00 72.50 71.35 1xks s THR 374 CO 0.02 0.52 -0.08 0.27 -0.54 0.00 0.00 174.62 174.80 1xks s ILE 375 N 0.45 0.93 0.18 2.99 -4.36 -0.56 -2.04 121.20 118.79 1xks s ILE 375 Ca -0.09 -1.97 -0.22 0.00 -0.26 0.00 0.00 60.65 58.11 1xks s ILE 375 Cb -0.16 -1.74 -0.08 0.00 1.25 0.00 0.00 42.46 41.74 1xks s ILE 375 CO 0.05 -0.79 0.72 -1.83 0.24 0.00 0.00 174.94 173.32 1xks s GLU 376 N -3.72 4.37 -0.63 0.37 -1.05 -1.26 -0.75 118.70 116.02 1xks s GLU 376 Ca 0.14 0.96 -0.07 0.00 -0.15 0.00 0.00 54.97 55.84 1xks s GLU 376 Cb 0.03 -3.08 0.16 0.00 -0.44 0.00 0.00 34.13 30.81 1xks s GLU 376 CO -0.02 0.50 0.49 0.34 0.95 0.00 0.00 175.26 177.52 1xks s ASP 377 N -1.38 5.76 -0.31 0.83 3.68 -1.26 -4.57 116.67 119.42 1xks s ASP 377 Ca 0.38 -2.54 -0.00 0.00 2.13 0.00 0.00 52.55 52.52 1xks s ASP 377 Cb -0.20 -1.99 0.10 0.00 -1.45 0.00 0.00 42.92 39.38 1xks s ASP 377 CO 0.23 -0.51 0.09 0.20 0.13 0.00 0.00 175.17 175.30 1xks s ASN 378 N 1.64 4.10 0.00 -0.34 0.02 -1.26 -5.02 114.94 114.08 1xks s ASN 378 Ca 0.14 -1.68 0.00 0.00 -1.02 0.00 0.00 52.86 50.30 1xks s ASN 378 Cb -0.19 -0.96 0.00 0.00 0.02 0.00 0.00 41.25 40.12 1xks s ASN 378 CO -0.04 -0.41 0.00 0.61 0.02 0.00 0.00 177.10 177.28 1xks n GLY 379 N 4.78 0.12 0.40 0.66 0.00 -1.26 -4.06 105.19 105.83 1xks n GLY 379 Ca -0.01 -1.35 0.04 0.00 0.00 0.00 0.00 46.02 44.70 1xks n GLY 379 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xks s GLN 381 N -0.92 1.07 0.37 0.00 -0.21 -1.26 -4.88 119.66 113.82 1xks s GLN 381 Ca 0.14 -1.26 -0.25 0.00 0.02 0.00 0.00 55.36 54.01 1xks s GLN 381 Cb 0.08 -0.99 -0.09 0.00 1.00 0.00 0.00 33.01 33.00 1xks s GLN 381 CO 0.10 0.19 1.00 -1.64 -2.12 0.00 0.00 175.29 172.83 1xks s MET 382 N -2.66 4.34 0.85 2.91 -1.94 -1.26 -4.38 119.30 117.16 1xks s MET 382 Ca 0.10 1.42 -0.11 0.00 -1.71 0.00 0.00 55.69 55.39 1xks s MET 382 Cb -0.05 -2.63 0.14 0.00 2.01 0.00 0.00 34.83 34.30 1xks s MET 382 CO 0.04 0.04 1.19 0.45 -0.01 0.00 0.00 175.02 176.73 1xks s SER 383 N -1.61 3.87 0.24 3.03 0.15 -1.26 -4.99 113.70 113.13 1xks s SER 383 Ca 0.55 0.31 0.20 0.00 0.70 0.00 0.00 55.95 57.71 1xks s SER 383 Cb -0.20 -0.59 0.05 0.00 -1.71 0.00 0.00 66.02 63.57 1xks s SER 383 CO 0.25 -2.24 1.18 0.44 1.20 0.00 0.00 173.24 174.07 1xks h ASP 384 N -1.17 0.00 -3.36 5.45 5.19 -2.00 -3.43 116.42 117.09 1xks h ASP 384 Ca -0.43 0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.35 1xks h ASP 384 Cb 1.27 0.00 -0.13 0.00 0.18 0.00 0.00 39.33 40.66 1xks h ASP 384 CO 0.48 0.19 0.46 0.00 -3.12 0.00 0.00 179.24 177.25 1xks s ALA 385 N -3.18 3.22 -0.12 3.45 0.00 -1.26 -5.01 121.76 118.87 1xks s ALA 385 Ca 0.01 -1.18 0.02 0.00 0.00 0.00 0.00 51.96 50.81 1xks s ALA 385 Cb 0.08 -3.62 0.02 0.00 0.00 0.00 0.00 23.12 19.59 1xks s ALA 385 CO 0.76 -2.20 -0.16 0.08 0.00 0.00 0.00 175.76 174.25 1xks s VAL 386 N 3.63 1.59 -0.17 0.00 1.01 -1.26 -4.47 120.40 120.73 1xks s VAL 386 Ca 0.29 -0.69 -0.06 0.00 0.00 0.00 0.00 61.98 61.53 1xks s VAL 386 Cb -0.13 -1.45 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 1xks s VAL 386 CO 0.20 0.46 0.02 0.42 0.00 0.00 0.00 175.10 176.20 1xks s THR 387 N 1.05 4.39 -0.19 3.92 -4.23 -0.87 -4.99 115.64 114.73 1xks s THR 387 Ca -0.05 -0.18 -0.04 0.00 -1.18 0.00 0.00 61.69 60.24 1xks s THR 387 Cb -0.15 -2.96 -0.02 0.00 1.34 0.00 0.00 72.50 70.71 1xks s THR 387 CO -0.03 0.48 -0.02 -0.69 -0.54 0.00 0.00 174.62 173.81 1xks s VAL 388 N 0.37 3.82 -0.25 2.29 1.01 -1.26 -1.60 120.40 124.77 1xks s VAL 388 Ca -0.00 -0.36 0.02 0.00 0.00 0.00 0.00 61.98 61.63 1xks s VAL 388 Cb -0.13 -2.71 0.06 0.00 0.00 0.00 0.00 36.38 33.60 1xks s VAL 388 CO 0.01 0.45 -0.07 -0.70 0.00 0.00 0.00 175.10 174.79 1xks s GLU 389 N 0.86 1.87 -0.10 2.72 2.56 -0.82 -4.99 118.70 120.80 1xks s GLU 389 Ca -0.00 -1.18 -0.30 0.00 0.00 0.00 0.00 54.97 53.50 1xks s GLU 389 Cb -0.14 -2.73 -0.02 0.00 2.00 0.00 0.00 34.13 33.24 1xks s GLU 389 CO 0.02 -0.60 1.09 0.08 -0.56 0.00 0.00 175.26 175.28 1xks s VAL 390 N 1.25 4.57 0.76 3.70 1.01 -1.26 -1.45 120.40 128.98 1xks s VAL 390 Ca -0.06 1.86 -0.07 0.00 0.00 0.00 0.00 61.98 63.71 1xks s VAL 390 Cb -0.19 -4.20 0.11 0.00 0.00 0.00 0.00 36.38 32.10 1xks s VAL 390 CO -0.06 -0.02 1.07 0.42 0.00 0.00 0.00 175.10 176.51 1xks s THR 391 N 2.25 2.19 -0.83 3.92 -4.23 -0.16 -4.97 115.64 113.81 1xks s THR 391 Ca 0.51 -0.30 0.21 0.00 -1.18 0.00 0.00 61.69 60.92 1xks s THR 391 Cb -0.20 -2.89 0.19 0.00 1.34 0.00 0.00 72.50 70.94 1xks s THR 391 CO 0.18 0.00 1.64 0.00 -0.54 0.00 0.00 174.62 175.90 1xks n GLN 392 N -3.07 0.08 -2.75 3.99 6.02 -1.26 -4.67 117.38 115.71 1xks n GLN 392 Ca 0.11 0.25 -0.43 0.00 -0.01 0.00 0.00 57.00 56.92 1xks n GLN 392 Cb 0.60 -1.63 -0.03 0.00 1.02 0.00 0.00 30.24 30.19 1xks n GLN 392 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1xks s TYR 393 N -3.10 2.85 -0.38 1.08 5.04 -1.26 -4.88 117.35 116.70 1xks s TYR 393 Ca 0.08 0.41 0.11 0.00 -2.44 0.00 0.00 57.07 55.23 1xks s TYR 393 Cb 0.11 -4.14 0.36 0.00 0.35 0.00 0.00 41.96 38.65 1xks s TYR 393 CO 0.38 -1.21 0.87 -1.71 -1.34 0.00 0.00 175.55 172.54 1xks n ASN 394 N 7.46 0.09 -4.83 4.32 4.05 -1.26 -3.55 115.26 121.54 1xks n ASN 394 Ca 0.07 -3.10 -0.30 0.00 0.45 0.00 0.00 54.58 51.70 1xks n ASN 394 Cb 0.49 0.03 0.06 0.00 1.23 0.00 0.00 39.78 41.58 1xks n ASN 394 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1xks s PRO 395 N -1.81 2.61 0.56 1.20 0.04 -1.24 -4.59 135.00 131.77 1xks s PRO 395 Ca 0.34 0.72 -0.20 0.00 0.04 0.00 0.00 61.00 61.90 1xks s PRO 395 Cb 0.35 -1.97 -0.05 0.00 0.04 0.00 0.00 34.50 32.88 1xks s PRO 395 CO -0.06 -1.27 1.20 -2.14 0.04 0.00 0.00 177.00 174.77 1xks s PRO 396 N -5.16 3.17 0.13 0.56 0.02 -1.26 -1.04 135.00 131.43 1xks s PRO 396 Ca 0.59 1.81 -0.30 0.00 0.02 0.00 0.00 61.00 63.12 1xks s PRO 396 Cb -0.13 -2.04 -0.07 0.00 0.02 0.00 0.00 34.50 32.28 1xks s PRO 396 CO 0.54 -1.04 1.23 0.12 -0.33 0.00 0.00 177.00 177.52 1xks s PHE 397 N -1.60 3.39 0.01 6.54 5.36 0.10 -4.69 117.98 127.10 1xks s PHE 397 Ca 0.74 1.29 -0.00 0.00 -0.96 0.00 0.00 56.93 58.00 1xks s PHE 397 Cb -0.30 -3.48 -0.00 0.00 -0.34 0.00 0.00 43.02 38.91 1xks s PHE 397 CO 0.33 -1.45 -0.00 1.04 -1.46 0.00 0.00 175.22 173.67 1xks n GLN 398 N 3.26 0.01 -3.82 10.12 6.02 -1.26 -4.98 117.38 126.73 1xks n GLN 398 Ca 0.07 0.00 -0.11 0.00 -0.01 0.00 0.00 57.00 56.95 1xks n GLN 398 Cb 0.45 -0.13 -0.09 0.00 1.02 0.00 0.00 30.24 31.49 1xks n GLN 398 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 1xks s SER 399 N -5.12 -0.05 0.36 1.08 0.15 -1.26 -5.05 113.70 103.81 1xks s SER 399 Ca -0.00 -0.19 0.04 0.00 0.70 0.00 0.00 55.95 56.50 1xks s SER 399 Cb 0.00 0.28 0.68 0.00 -1.71 0.00 0.00 66.02 65.27 1xks s SER 399 CO 0.01 -0.49 1.96 -0.08 1.20 0.00 0.00 173.24 175.84 1xks h GLU 400 N 3.74 0.62 0.00 5.44 4.81 -1.99 -1.14 114.58 126.06 1xks h GLU 400 Ca -0.31 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 58.84 1xks h GLU 400 Cb 1.19 -0.12 -0.00 0.00 0.63 0.00 0.00 28.75 30.45 1xks h GLU 400 CO 0.44 0.50 -0.01 -0.44 -0.73 0.00 0.00 179.01 178.77 1xks h ASP 401 N 0.62 0.00 0.22 1.04 3.32 -2.07 -2.51 116.42 117.04 1xks h ASP 401 Ca 0.15 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.20 1xks h ASP 401 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1xks h ASP 401 CO -0.02 0.01 -0.26 0.18 -1.72 0.00 0.00 179.24 177.43 1xks n LEU 402 N -3.59 1.08 -4.57 1.55 4.77 -0.44 -4.68 117.00 111.13 1xks n LEU 402 Ca -0.03 -0.29 -0.33 0.00 -0.03 0.00 0.00 56.01 55.34 1xks n LEU 402 Cb 0.10 -0.11 -0.04 0.00 -2.33 0.00 0.00 43.42 41.03 1xks n LEU 402 CO 0.26 0.20 1.50 -0.63 -1.33 0.00 0.00 177.39 177.39 1xks s ILE 403 N -2.49 3.67 -0.05 -0.08 1.01 -0.95 -4.91 121.20 117.40 1xks s ILE 403 Ca 0.24 -0.82 0.05 0.00 0.00 0.00 0.00 60.65 60.12 1xks s ILE 403 Cb 0.19 -4.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.09 1xks s ILE 403 CO 0.52 -1.34 -0.19 -0.76 0.00 0.00 0.00 174.94 173.17 1xks s LEU 404 N 8.33 2.44 -0.30 2.97 1.43 -1.26 -5.09 118.68 127.20 1xks s LEU 404 Ca 0.62 -0.33 -0.21 0.00 -1.03 0.00 0.00 54.13 53.18 1xks s LEU 404 Cb -0.02 -1.47 0.21 0.00 0.03 0.00 0.00 46.19 44.93 1xks s LEU 404 CO 0.02 0.31 1.39 0.00 0.23 0.00 0.00 176.35 178.29 1xks s GLN 406 N 0.49 1.62 -0.06 0.00 -0.21 -0.57 -4.82 119.66 116.10 1xks s GLN 406 Ca 0.00 -1.79 0.05 0.00 0.02 0.00 0.00 55.36 53.65 1xks s GLN 406 Cb -0.04 -1.47 -0.01 0.00 1.00 0.00 0.00 33.01 32.49 1xks s GLN 406 CO -0.13 0.17 -0.22 -1.17 -2.12 0.00 0.00 175.29 171.82 1xks s LEU 407 N -3.48 2.25 -0.03 2.90 2.96 -1.26 -1.22 118.68 120.80 1xks s LEU 407 Ca 0.29 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.82 1xks s LEU 407 Cb 0.00 -1.42 -0.01 0.00 0.50 0.00 0.00 46.19 45.26 1xks s LEU 407 CO 0.13 0.26 -0.17 0.28 -1.32 0.00 0.00 176.35 175.53 1xks s THR 408 N -0.25 1.40 -0.50 3.68 -1.32 -0.08 -4.98 115.64 113.59 1xks s THR 408 Ca -0.00 -0.73 0.03 0.00 -1.21 0.00 0.00 61.69 59.77 1xks s THR 408 Cb -0.13 -1.18 0.14 0.00 -1.51 0.00 0.00 72.50 69.82 1xks s THR 408 CO 0.03 0.40 0.30 -0.69 -2.21 0.00 0.00 174.62 172.45 1xks s VAL 409 N -0.23 1.80 0.21 5.08 1.01 -1.26 -1.65 120.40 125.36 1xks s VAL 409 Ca 0.03 -3.05 -0.06 0.00 0.00 0.00 0.00 61.98 58.91 1xks s VAL 409 Cb -0.09 -2.24 0.04 0.00 0.00 0.00 0.00 36.38 34.10 1xks s VAL 409 CO 0.00 -0.93 1.63 -0.65 0.00 0.00 0.00 175.10 175.15 1xks h PRO 410 N 6.31 0.85 -4.64 2.72 0.11 -1.89 -3.40 132.00 132.06 1xks h PRO 410 Ca 0.04 -0.33 -0.69 0.00 0.11 0.00 0.00 66.00 65.13 1xks h PRO 410 Cb 0.88 -0.05 -0.32 0.00 0.11 0.00 0.00 31.00 31.62 1xks h PRO 410 CO 0.56 0.96 -0.62 1.21 -0.21 0.00 0.00 178.00 179.89 1xks s ASN 411 N -6.72 5.13 0.57 -2.05 3.84 -1.26 -4.40 114.94 110.06 1xks s ASN 411 Ca -0.10 -1.51 0.32 0.00 0.21 0.00 0.00 52.86 51.78 1xks s ASN 411 Cb 0.13 -1.80 1.42 0.00 -0.55 0.00 0.00 41.25 40.46 1xks s ASN 411 CO 0.84 -0.38 1.75 0.15 -2.79 0.00 0.00 177.10 176.67 1xks h PHE 412 N 8.08 0.00 0.00 0.43 3.57 -1.89 -3.26 116.94 123.87 1xks h PHE 412 Ca -0.19 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.31 1xks h PHE 412 Cb 1.06 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.80 1xks h PHE 412 CO 0.59 0.00 -0.55 -1.13 -2.23 0.00 0.00 178.31 174.99 1xks n SER 413 N -3.83 1.59 -4.89 0.41 3.41 -1.26 -0.59 113.62 108.45 1xks n SER 413 Ca 0.19 -0.38 -0.29 0.00 -0.26 0.00 0.00 58.87 58.13 1xks n SER 413 Cb 1.08 1.07 -0.02 0.00 -0.26 0.00 0.00 64.21 66.08 1xks n SER 413 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xks s ASN 414 N -1.77 6.41 -1.13 4.04 4.22 -1.23 -4.95 114.94 120.52 1xks s ASN 414 Ca 0.00 0.97 -0.04 0.00 -2.14 0.00 0.00 52.86 51.65 1xks s ASN 414 Cb 0.03 -2.26 0.26 0.00 1.28 0.00 0.00 41.25 40.57 1xks s ASN 414 CO 0.17 -0.42 1.78 0.00 -2.04 0.00 0.00 177.10 176.58 1xks n GLN 415 N -1.59 4.67 -4.87 3.55 6.02 -1.26 -4.88 117.38 119.02 1xks n GLN 415 Ca 0.01 -4.28 -0.28 0.00 -0.01 0.00 0.00 57.00 52.44 1xks n GLN 415 Cb 0.54 -2.58 -0.17 0.00 1.02 0.00 0.00 30.24 29.06 1xks n GLN 415 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 1xks s THR 416 N -2.55 1.54 0.11 5.09 2.01 -1.26 -0.96 115.64 119.63 1xks s THR 416 Ca 0.38 -0.73 0.08 0.00 0.31 0.00 0.00 61.69 61.73 1xks s THR 416 Cb 0.12 -1.36 -0.04 0.00 0.01 0.00 0.00 72.50 71.23 1xks s THR 416 CO -0.01 0.44 -0.19 0.00 -0.69 0.00 0.00 174.62 174.18 1xks s ALA 417 N 0.45 1.73 -0.22 7.40 0.00 -0.82 -4.57 121.76 125.73 1xks s ALA 417 Ca -0.15 -1.27 0.00 0.00 0.00 0.00 0.00 51.96 50.54 1xks s ALA 417 Cb -0.16 -0.19 0.03 0.00 0.00 0.00 0.00 23.12 22.80 1xks s ALA 417 CO 0.06 0.28 -0.12 0.71 0.00 0.00 0.00 175.76 176.68 1xks s TYR 418 N -1.48 2.99 -0.02 0.00 1.51 -0.66 -0.14 117.35 119.55 1xks s TYR 418 Ca 0.08 -1.71 -0.14 0.00 -1.01 0.00 0.00 57.07 54.28 1xks s TYR 418 Cb -0.08 -1.98 -0.05 0.00 -0.11 0.00 0.00 41.96 39.73 1xks s TYR 418 CO 0.04 -0.78 0.38 -0.51 -1.11 0.00 0.00 175.55 173.57 1xks s LEU 419 N 1.28 4.45 0.00 -1.29 1.43 -0.57 -0.90 118.68 123.08 1xks s LEU 419 Ca 0.00 0.90 -0.03 0.00 -1.03 0.00 0.00 54.13 53.98 1xks s LEU 419 Cb -0.16 -2.53 -0.01 0.00 0.03 0.00 0.00 46.19 43.52 1xks s LEU 419 CO -0.08 0.31 0.04 -0.72 0.23 0.00 0.00 176.35 176.14 1xks s TYR 420 N -0.95 0.09 0.00 0.29 -0.85 -0.36 0.12 117.35 115.69 1xks s TYR 420 Ca 0.23 -0.19 0.00 0.00 -0.52 0.00 0.00 57.07 56.59 1xks s TYR 420 Cb -0.16 -0.08 0.00 0.00 0.38 0.00 0.00 41.96 42.10 1xks s TYR 420 CO 0.12 -0.16 0.00 0.27 -1.52 0.00 0.00 175.55 174.26 1xks n ASN 421 N 2.07 1.16 -0.06 -0.18 0.23 -0.65 -1.52 115.26 116.31 1xks n ASN 421 Ca -0.20 0.00 0.15 0.00 -0.53 0.00 0.00 54.58 54.00 1xks n ASN 421 Cb 0.57 0.00 0.70 0.00 -2.08 0.00 0.00 39.78 38.97 1xks n ASN 421 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 1xks n GLU 422 N 0.00 0.62 0.00 -3.83 1.02 -1.26 -3.89 120.64 113.30 1xks n GLU 422 Ca 0.00 -0.12 0.00 0.00 -0.02 0.00 0.00 57.16 57.02 1xks n GLU 422 Cb 0.00 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 29.92 1xks n GLU 422 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 1xks n SER 423 N -1.08 1.02 -3.73 1.62 3.41 -1.26 -1.14 113.62 112.46 1xks n SER 423 Ca 0.15 -0.28 -0.09 0.00 -0.26 0.00 0.00 58.87 58.39 1xks n SER 423 Cb 0.25 0.77 -0.02 0.00 -0.26 0.00 0.00 64.21 64.95 1xks n SER 423 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xks s ALA 424 N -0.98 -1.32 -0.05 7.33 0.00 -1.25 -0.84 121.76 124.65 1xks s ALA 424 Ca 0.00 -0.07 0.02 0.00 0.00 0.00 0.00 51.96 51.91 1xks s ALA 424 Cb 0.00 0.86 0.01 0.00 0.00 0.00 0.00 23.12 24.00 1xks s ALA 424 CO 0.00 -0.95 -0.09 0.08 0.00 0.00 0.00 175.76 174.80 1xks s VAL 425 N -3.87 0.87 -0.27 0.00 1.01 -0.18 -1.64 120.40 116.32 1xks s VAL 425 Ca 0.08 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.67 1xks s VAL 425 Cb -0.04 -0.81 0.01 0.00 0.00 0.00 0.00 36.38 35.53 1xks s VAL 425 CO 0.01 0.29 0.02 -0.31 0.00 0.00 0.00 175.10 175.11 1xks s TYR 426 N 0.62 3.09 -0.23 5.22 1.51 0.32 -0.13 117.35 127.74 1xks s TYR 426 Ca -0.11 -1.12 -0.29 0.00 -1.01 0.00 0.00 57.07 54.54 1xks s TYR 426 Cb -0.14 -2.17 -0.01 0.00 -0.11 0.00 0.00 41.96 39.54 1xks s TYR 426 CO 0.02 -0.61 1.27 0.08 -1.11 0.00 0.00 175.55 175.20 1xks s VAL 427 N 1.45 4.24 0.37 0.71 1.01 0.13 -1.51 120.40 126.80 1xks s VAL 427 Ca 0.02 1.46 0.04 0.00 0.00 0.00 0.00 61.98 63.51 1xks s VAL 427 Cb -0.16 -4.09 -0.05 0.00 0.00 0.00 0.00 36.38 32.07 1xks s VAL 427 CO -0.00 -0.29 0.06 0.00 0.00 0.00 0.00 175.10 174.86 1xks s SER 429 N -3.58 2.22 0.23 0.00 1.04 -1.26 -1.94 113.70 110.41 1xks s SER 429 Ca 0.30 -0.80 0.01 0.00 0.48 0.00 0.00 55.95 55.94 1xks s SER 429 Cb 0.07 -0.10 0.01 0.00 0.10 0.00 0.00 66.02 66.10 1xks s SER 429 CO 0.14 -0.09 0.08 0.35 0.98 0.00 0.00 173.24 174.70 1xks n THR 430 N 0.55 0.00 -4.92 2.02 -2.24 -0.13 -4.85 114.28 104.71 1xks n THR 430 Ca -0.15 -1.00 0.00 0.00 -2.27 0.00 0.00 64.05 60.63 1xks n THR 430 Cb 0.57 -0.03 0.00 0.00 -2.10 0.00 0.00 70.33 68.77 1xks n THR 430 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xks n GLY 431 N 2.25 1.45 0.20 3.38 0.00 -1.26 -1.87 105.19 109.34 1xks n GLY 431 Ca -0.05 -0.58 0.05 0.00 0.00 0.00 0.00 46.02 45.44 1xks n GLY 431 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1xks h THR 432 N 0.00 1.04 0.00 2.61 2.02 -1.97 -3.47 112.91 113.14 1xks h THR 432 Ca 0.00 -1.29 0.00 0.00 0.77 0.00 0.00 66.41 65.89 1xks h THR 432 Cb 0.00 1.74 0.00 0.00 -1.74 0.00 0.00 68.15 68.15 1xks h THR 432 CO 0.00 0.34 0.00 0.61 0.37 0.00 0.00 175.52 176.84 1xks n GLY 433 N -0.23 1.17 0.38 2.16 0.00 -0.78 -4.96 105.19 102.92 1xks n GLY 433 Ca -0.01 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.93 1xks n GLY 433 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xks h LYS 434 N 3.31 -0.18 -0.30 1.61 6.56 -1.90 -1.03 116.57 124.64 1xks h LYS 434 Ca 0.00 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 1xks h LYS 434 Cb 0.00 0.04 0.00 0.00 -0.57 0.00 0.00 32.23 31.70 1xks h LYS 434 CO 0.00 -0.12 0.00 1.97 -2.06 0.00 0.00 179.45 179.24 1xks n PHE 435 N -5.41 0.39 -2.45 -1.35 1.16 -1.26 -4.99 117.46 103.55 1xks n PHE 435 Ca 0.03 -0.20 -0.39 0.00 -1.87 0.00 0.00 57.45 55.02 1xks n PHE 435 Cb 0.35 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.18 1xks n PHE 435 CO 0.00 0.00 0.00 -1.12 -1.87 0.00 0.00 176.76 173.77 1xks s SER 436 N -1.34 6.98 0.91 5.98 0.01 -0.39 -4.16 113.70 121.69 1xks s SER 436 Ca 0.32 2.23 -0.12 0.00 1.31 0.00 0.00 55.95 59.70 1xks s SER 436 Cb 0.17 -2.61 0.14 0.00 0.21 0.00 0.00 66.02 63.93 1xks s SER 436 CO 0.24 -0.34 1.09 -0.76 0.41 0.00 0.00 173.24 173.88 1xks s LEU 437 N -1.97 2.15 0.38 2.44 1.43 -1.26 -4.95 118.68 116.90 1xks s LEU 437 Ca 0.50 1.44 -0.28 0.00 -1.03 0.00 0.00 54.13 54.77 1xks s LEU 437 Cb -0.29 -3.83 -0.10 0.00 0.03 0.00 0.00 46.19 42.00 1xks s LEU 437 CO 0.37 -2.72 1.43 -2.84 0.23 0.00 0.00 176.35 172.82 1xks s PRO 438 N -4.94 4.09 -0.15 1.29 0.02 -1.26 -4.83 135.00 129.22 1xks s PRO 438 Ca 0.64 2.45 -0.29 0.00 0.02 0.00 0.00 61.00 63.81 1xks s PRO 438 Cb -0.18 -2.93 -0.01 0.00 0.02 0.00 0.00 34.50 31.40 1xks s PRO 438 CO 0.57 -0.50 1.20 -0.65 -0.33 0.00 0.00 177.00 177.29 1xks s GLN 439 N -2.10 4.27 0.02 5.54 -0.21 -1.26 -4.80 119.66 121.13 1xks s GLN 439 Ca 0.53 1.60 -0.09 0.00 0.02 0.00 0.00 55.36 57.42 1xks s GLN 439 Cb -0.44 -3.69 0.00 0.00 1.00 0.00 0.00 33.01 29.88 1xks s GLN 439 CO 0.59 -0.63 0.19 -2.00 -2.12 0.00 0.00 175.29 171.32 1xks s GLU 440 N 3.13 0.62 -0.24 2.91 2.12 -0.90 -4.98 118.70 121.37 1xks s GLU 440 Ca 0.53 -0.50 -0.10 0.00 0.36 0.00 0.00 54.97 55.26 1xks s GLU 440 Cb -0.21 0.26 -0.05 0.00 0.26 0.00 0.00 34.13 34.39 1xks s GLU 440 CO 0.15 -0.17 0.15 0.21 -0.54 0.00 0.00 175.26 175.06 1xks s LYS 441 N -2.00 4.03 -0.22 4.30 2.20 -1.26 0.19 119.74 126.98 1xks s LYS 441 Ca -0.10 -0.29 -0.04 0.00 -0.36 0.00 0.00 55.97 55.18 1xks s LYS 441 Cb -0.04 -3.50 -0.01 0.00 -1.51 0.00 0.00 37.83 32.77 1xks s LYS 441 CO -0.01 0.06 -0.04 0.42 -0.36 0.00 0.00 175.35 175.42 1xks s ILE 442 N 1.05 3.42 -0.14 5.43 1.01 0.81 -4.97 121.20 127.81 1xks s ILE 442 Ca 0.07 -0.49 -0.18 0.00 0.00 0.00 0.00 60.65 60.05 1xks s ILE 442 Cb -0.14 -2.56 -0.04 0.00 0.01 0.00 0.00 42.46 39.73 1xks s ILE 442 CO 0.04 0.41 0.49 -0.69 0.00 0.00 0.00 174.94 175.19 1xks s VAL 443 N 1.48 5.17 -0.18 2.92 1.01 -1.26 -1.01 120.40 128.53 1xks s VAL 443 Ca 0.06 0.95 0.17 0.00 0.00 0.00 0.00 61.98 63.16 1xks s VAL 443 Cb -0.14 -3.82 0.45 0.00 0.00 0.00 0.00 36.38 32.87 1xks s VAL 443 CO -0.03 0.29 1.17 0.49 0.00 0.00 0.00 175.10 177.02 1xks n PHE 444 N 3.96 0.90 0.60 5.22 3.01 -0.02 -4.80 117.46 126.33 1xks n PHE 444 Ca -0.06 -1.52 0.11 0.00 1.01 0.00 0.00 57.45 56.98 1xks n PHE 444 Cb 0.51 -0.24 -0.11 0.00 -0.01 0.00 0.00 39.48 39.64 1xks n PHE 444 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 1xks n ASN 445 N -0.44 0.60 -4.71 4.37 0.23 -0.89 -2.35 115.26 112.07 1xks n ASN 445 Ca 0.18 -0.54 -0.42 0.00 -0.53 0.00 0.00 54.58 53.28 1xks n ASN 445 Cb 0.91 1.29 -0.03 0.00 -2.08 0.00 0.00 39.78 39.86 1xks n ASN 445 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1xks s ALA 446 N -3.20 3.25 -1.00 -2.53 0.00 -1.26 -4.35 121.76 112.66 1xks s ALA 446 Ca 0.02 0.42 -0.01 0.00 0.00 0.00 0.00 51.96 52.39 1xks s ALA 446 Cb 0.15 -3.28 -0.01 0.00 0.00 0.00 0.00 23.12 19.98 1xks s ALA 446 CO 0.87 -0.28 0.84 1.04 0.00 0.00 0.00 175.76 178.23 1xks n GLN 447 N 4.10 -4.88 0.00 0.00 6.02 -1.26 -2.65 117.38 118.71 1xks n GLN 447 Ca 0.05 0.73 0.00 0.00 -0.01 0.00 0.00 57.00 57.77 1xks n GLN 447 Cb 0.51 -5.35 0.00 0.00 1.02 0.00 0.00 30.24 26.41 1xks n GLN 447 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xks n GLY 448 N -1.14 2.81 3.69 1.08 0.00 -1.26 -5.01 105.19 105.36 1xks n GLY 448 Ca -0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 1xks n GLY 448 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1xks s ASP 449 N -3.81 3.46 -0.10 1.61 2.15 -1.09 -4.85 116.67 114.04 1xks s ASP 449 Ca 0.00 2.28 -0.30 0.00 0.43 0.00 0.00 52.55 54.96 1xks s ASP 449 Cb 0.00 -2.58 0.11 0.00 -0.30 0.00 0.00 42.92 40.16 1xks s ASP 449 CO 0.00 -2.75 0.93 -0.55 -0.17 0.00 0.00 175.17 172.63 1xks s SER 450 N -2.38 -0.40 -0.48 -0.34 0.15 -0.99 -4.43 113.70 104.83 1xks s SER 450 Ca 0.70 0.32 -0.23 0.00 0.70 0.00 0.00 55.95 57.45 1xks s SER 450 Cb -0.26 0.35 0.03 0.00 -1.71 0.00 0.00 66.02 64.43 1xks s SER 450 CO 0.53 -0.45 0.80 -0.69 1.20 0.00 0.00 173.24 174.63 1xks s VAL 451 N -1.70 4.62 -0.50 4.45 1.01 -0.29 -0.12 120.40 127.87 1xks s VAL 451 Ca -0.01 0.25 0.23 0.00 0.00 0.00 0.00 61.98 62.46 1xks s VAL 451 Cb -0.01 -4.37 0.03 0.00 0.00 0.00 0.00 36.38 32.04 1xks s VAL 451 CO -0.01 -0.83 1.22 -0.07 0.00 0.00 0.00 175.10 175.42 1xks h LEU 452 N 10.27 0.00 0.00 3.92 3.38 -1.04 -3.41 115.31 128.43 1xks h LEU 452 Ca -0.25 -0.15 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1xks h LEU 452 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 1xks h LEU 452 CO 0.99 0.07 0.00 0.61 0.09 0.00 0.00 178.44 180.20 1xks n GLY 453 N 1.28 -0.13 3.40 0.83 0.00 -1.18 -3.95 105.19 105.44 1xks n GLY 453 Ca 0.02 -0.90 -0.12 0.00 0.00 0.00 0.00 46.02 45.02 1xks n GLY 453 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xks s ALA 454 N -2.00 -1.41 0.00 4.61 0.00 -1.26 -1.07 121.76 120.63 1xks s ALA 454 Ca 0.00 0.40 0.00 0.00 0.00 0.00 0.00 51.96 52.36 1xks s ALA 454 Cb 0.00 0.75 0.00 0.00 0.00 0.00 0.00 23.12 23.87 1xks s ALA 454 CO 0.00 -0.69 0.00 0.41 0.00 0.00 0.00 175.76 175.48 1xks n GLY 455 N -0.20 1.61 3.18 0.00 0.00 0.23 -4.63 105.19 105.38 1xks n GLY 455 Ca -0.17 -0.22 -0.13 0.00 0.00 0.00 0.00 46.02 45.50 1xks n GLY 455 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xks s ALA 456 N -1.00 -0.70 -0.13 4.61 0.00 -1.26 -0.36 121.76 122.92 1xks s ALA 456 Ca 0.00 0.71 -0.01 0.00 0.00 0.00 0.00 51.96 52.66 1xks s ALA 456 Cb 0.00 -0.38 0.04 0.00 0.00 0.00 0.00 23.12 22.77 1xks s ALA 456 CO 0.00 -0.15 -0.03 0.00 0.00 0.00 0.00 175.76 175.58 1xks n GLY 458 N 5.00 -0.52 2.18 0.00 0.00 -1.26 -1.09 105.19 109.50 1xks n GLY 458 Ca -0.10 0.20 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 1xks n GLY 458 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xks n GLY 459 N -1.73 0.65 3.62 -0.02 0.00 -1.26 -5.03 105.19 101.42 1xks n GLY 459 Ca -0.01 -0.57 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 1xks n GLY 459 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xks s VAL 460 N -2.05 4.70 0.03 1.61 1.01 -0.25 -4.34 120.40 121.12 1xks s VAL 460 Ca 0.00 -0.07 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 1xks s VAL 460 Cb 0.00 -3.11 -0.08 0.00 0.00 0.00 0.00 36.38 33.19 1xks s VAL 460 CO 0.00 0.47 1.66 -2.84 0.00 0.00 0.00 175.10 174.39 1xks s PRO 461 N 0.35 4.19 -0.09 2.72 0.02 -1.26 -1.67 135.00 139.25 1xks s PRO 461 Ca 0.02 2.30 0.02 0.00 0.02 0.00 0.00 61.00 63.36 1xks s PRO 461 Cb -0.12 -3.73 -0.02 0.00 0.02 0.00 0.00 34.50 30.65 1xks s PRO 461 CO 0.00 -0.77 -0.16 0.42 -0.33 0.00 0.00 177.00 176.17 1xks s ILE 462 N 3.09 2.86 -0.02 2.83 -1.09 0.51 -2.32 121.20 127.05 1xks s ILE 462 Ca 0.74 -0.76 0.08 0.00 -2.23 0.00 0.00 60.65 58.48 1xks s ILE 462 Cb -0.38 -2.15 -0.02 0.00 -1.58 0.00 0.00 42.46 38.33 1xks s ILE 462 CO 0.32 0.55 -0.25 -0.63 -1.23 0.00 0.00 174.94 173.70 1xks s ILE 463 N -0.04 2.13 -0.37 2.92 -1.09 0.14 -0.60 121.20 124.30 1xks s ILE 463 Ca -0.04 -1.08 -0.09 0.00 -2.23 0.00 0.00 60.65 57.21 1xks s ILE 463 Cb -0.14 -1.74 0.04 0.00 -1.58 0.00 0.00 42.46 39.04 1xks s ILE 463 CO 0.04 0.58 0.18 0.12 -1.23 0.00 0.00 174.94 174.62 1xks s PHE 464 N -0.62 3.27 -0.05 3.97 5.36 -0.23 -0.78 117.98 128.90 1xks s PHE 464 Ca 0.10 -1.25 -0.02 0.00 -0.96 0.00 0.00 56.93 54.80 1xks s PHE 464 Cb -0.10 -2.47 -0.04 0.00 -0.34 0.00 0.00 43.02 40.07 1xks s PHE 464 CO -0.01 -0.72 0.09 -1.54 -1.46 0.00 0.00 175.22 171.58 1xks s SER 465 N 1.59 5.80 0.32 6.13 1.04 0.16 -0.39 113.70 128.36 1xks s SER 465 Ca 0.01 0.24 0.03 0.00 0.48 0.00 0.00 55.95 56.71 1xks s SER 465 Cb -0.20 -1.73 0.63 0.00 0.10 0.00 0.00 66.02 64.82 1xks s SER 465 CO 0.04 0.33 1.88 -0.09 0.98 0.00 0.00 173.24 176.38 1xks h ARG 466 N 4.50 0.88 0.00 4.02 2.43 -0.82 -0.77 114.38 124.62 1xks h ARG 466 Ca -0.51 -0.05 -0.14 0.00 -0.81 0.00 0.00 59.98 58.47 1xks h ARG 466 Cb 1.20 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 30.52 1xks h ARG 466 CO 0.60 0.58 -1.60 0.09 -1.51 0.00 0.00 179.97 178.14 1xks n ASN 467 N -4.54 0.58 0.00 -3.80 3.02 -1.26 -4.59 115.26 104.68 1xks n ASN 467 Ca 0.16 0.25 0.00 0.00 -0.03 0.00 0.00 54.58 54.96 1xks n ASN 467 Cb 0.32 0.65 0.00 0.00 -0.61 0.00 0.00 39.78 40.13 1xks n ASN 467 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1xks n SER 468 N -2.73 1.15 0.00 6.41 7.64 -1.07 -5.11 113.62 119.92 1xks n SER 468 Ca -0.11 -1.40 0.00 0.00 1.01 0.00 0.00 58.87 58.37 1xks n SER 468 Cb 0.79 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.99 1xks n SER 468 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1xks n GLY 469 N -0.20 0.54 3.74 0.23 0.00 -0.32 -4.65 105.19 104.52 1xks n GLY 469 Ca 0.00 -0.89 -0.41 0.00 0.00 0.00 0.00 46.02 44.72 1xks n GLY 469 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xks s LEU 470 N 0.00 4.51 -0.03 0.99 1.43 -1.26 0.40 118.68 124.72 1xks s LEU 470 Ca 0.00 1.96 -0.04 0.00 -1.03 0.00 0.00 54.13 55.02 1xks s LEU 470 Cb 0.00 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.63 1xks s LEU 470 CO 0.00 -0.13 0.10 -0.69 0.23 0.00 0.00 176.35 175.87 1xks s VAL 471 N -0.21 0.02 0.24 -1.59 1.01 0.04 -1.29 120.40 118.62 1xks s VAL 471 Ca 0.48 -0.18 0.07 0.00 0.00 0.00 0.00 61.98 62.35 1xks s VAL 471 Cb -0.27 -0.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.86 1xks s VAL 471 CO 0.33 -0.10 0.15 -0.94 0.00 0.00 0.00 175.10 174.53 1xks s SER 472 N -0.29 5.32 -0.26 3.32 1.04 -0.22 0.25 113.70 122.86 1xks s SER 472 Ca -0.04 -0.31 0.03 0.00 0.48 0.00 0.00 55.95 56.11 1xks s SER 472 Cb -0.03 -1.29 0.06 0.00 0.10 0.00 0.00 66.02 64.86 1xks s SER 472 CO 0.00 -0.01 -0.11 -0.63 0.98 0.00 0.00 173.24 173.47 1xks s ILE 473 N -2.10 2.19 -0.02 -1.02 1.01 -0.98 -2.49 121.20 117.80 1xks s ILE 473 Ca 0.32 -1.63 0.06 0.00 0.00 0.00 0.00 60.65 59.40 1xks s ILE 473 Cb -0.08 -2.29 -0.01 0.00 0.01 0.00 0.00 42.46 40.09 1xks s ILE 473 CO 0.24 -0.03 -0.18 0.42 0.00 0.00 0.00 174.94 175.38 1xks s THR 474 N 1.10 1.44 0.42 2.92 -4.23 -0.75 -4.37 115.64 112.18 1xks s THR 474 Ca -0.09 -0.78 -0.26 0.00 -1.18 0.00 0.00 61.69 59.39 1xks s THR 474 Cb -0.20 -1.20 -0.10 0.00 1.34 0.00 0.00 72.50 72.34 1xks s THR 474 CO -0.05 0.41 1.31 -0.24 -0.54 0.00 0.00 174.62 175.51 1xks n SER 475 N 2.65 2.78 0.22 3.99 2.88 -1.26 -0.55 113.62 124.33 1xks n SER 475 Ca -0.15 1.12 0.10 0.00 -1.33 0.00 0.00 58.87 58.61 1xks n SER 475 Cb 0.54 -1.52 0.45 0.00 -0.75 0.00 0.00 64.21 62.92 1xks n SER 475 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1xks h ARG 476 N 2.20 0.00 -0.02 -1.46 3.08 -1.60 -3.44 114.38 113.14 1xks h ARG 476 Ca -0.48 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.57 1xks h ARG 476 Cb 1.29 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.34 1xks h ARG 476 CO 0.60 0.22 0.00 0.39 -1.07 0.00 0.00 179.97 180.12