#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iny s ASP 83 N 0.00 0.84 0.36 0.55 -1.08 -1.26 -4.93 116.67 111.15 1iny s ASP 83 Ca 0.00 -0.79 -0.28 0.00 -0.52 0.00 0.00 52.55 50.96 1iny s ASP 83 Cb 0.00 0.09 -0.11 0.00 -1.46 0.00 0.00 42.92 41.44 1iny s ASP 83 CO 0.00 -0.38 1.42 -0.36 0.52 0.00 0.00 175.17 176.38 1iny s PHE 84 N -2.65 2.73 0.22 -5.34 0.08 -1.26 -4.05 117.98 107.72 1iny s PHE 84 Ca 0.00 1.26 -0.19 0.00 0.12 0.00 0.00 56.93 58.12 1iny s PHE 84 Cb -0.01 -3.90 -0.08 0.00 -0.57 0.00 0.00 43.02 38.45 1iny s PHE 84 CO -0.03 -2.61 0.72 1.21 -0.10 0.00 0.00 175.22 174.40 1iny s ASN 85 N -0.28 7.04 -0.06 1.36 2.47 -0.37 -4.75 114.94 120.36 1iny s ASN 85 Ca 0.52 1.40 0.03 0.00 0.42 0.00 0.00 52.86 55.23 1iny s ASN 85 Cb -0.44 -2.41 0.00 0.00 -1.45 0.00 0.00 41.25 36.95 1iny s ASN 85 CO 0.59 0.03 -0.16 0.20 -3.72 0.00 0.00 177.10 174.05 1iny s ASN 86 N -1.66 2.10 -1.06 -4.21 0.01 -1.26 -0.04 114.94 108.81 1iny s ASN 86 Ca 0.43 -0.35 -0.23 0.00 -0.71 0.00 0.00 52.86 51.99 1iny s ASN 86 Cb -0.16 -0.79 -0.07 0.00 0.41 0.00 0.00 41.25 40.64 1iny s ASN 86 CO 0.21 0.10 1.94 -0.76 -1.51 0.00 0.00 177.10 177.08 1iny s LEU 87 N 0.33 3.11 0.02 0.60 1.43 -1.26 -4.71 118.68 118.19 1iny s LEU 87 Ca -0.10 -1.24 0.22 0.00 -1.03 0.00 0.00 54.13 51.98 1iny s LEU 87 Cb -0.14 -2.58 -0.25 0.00 0.03 0.00 0.00 46.19 43.25 1iny s LEU 87 CO 0.04 -2.92 0.61 0.41 0.23 0.00 0.00 176.35 174.72 1iny n THR 88 N 7.82 0.22 -3.31 5.49 -1.04 -1.26 -1.30 114.28 120.90 1iny n THR 88 Ca 0.43 -0.53 -0.20 0.00 -2.04 0.00 0.00 64.05 61.71 1iny n THR 88 Cb 0.47 -0.11 0.04 0.00 -1.82 0.00 0.00 70.33 68.91 1iny n THR 88 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1iny n LYS 89 N -2.39 0.67 -4.65 -2.82 5.02 -1.26 -4.70 118.16 108.03 1iny n LYS 89 Ca -0.04 -2.99 -0.32 0.00 -2.02 0.00 0.00 58.31 52.93 1iny n LYS 89 Cb 0.59 -0.04 -0.06 0.00 -0.02 0.00 0.00 35.03 35.50 1iny n LYS 89 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1iny s GLY 90 N -4.31 2.98 0.12 0.72 0.00 -1.26 -1.61 107.32 103.96 1iny s GLY 90 Ca 0.47 -0.35 -0.27 0.00 0.00 0.00 0.00 44.72 44.57 1iny s GLY 90 CO 0.30 -2.17 0.86 1.08 0.00 0.00 0.00 173.10 173.17 1iny s LEU 91 N -3.95 4.52 0.90 0.66 1.43 -1.26 0.10 118.68 121.08 1iny s LEU 91 Ca 0.07 1.67 -0.11 0.00 -1.03 0.00 0.00 54.13 54.73 1iny s LEU 91 Cb 0.00 -3.42 0.13 0.00 0.03 0.00 0.00 46.19 42.93 1iny s LEU 91 CO 0.04 0.04 1.09 0.00 0.23 0.00 0.00 176.35 177.75 1iny s THR 93 N -2.89 4.47 -0.31 0.00 -4.23 -1.26 -4.93 115.64 106.50 1iny s THR 93 Ca 0.64 1.91 -0.11 0.00 -1.18 0.00 0.00 61.69 62.95 1iny s THR 93 Cb -0.18 -4.25 -0.03 0.00 1.34 0.00 0.00 72.50 69.38 1iny s THR 93 CO 0.57 0.39 0.19 -0.63 -0.54 0.00 0.00 174.62 174.60 1iny s ILE 94 N -0.36 5.08 -0.39 2.99 1.01 -1.26 -4.32 121.20 123.94 1iny s ILE 94 Ca 0.42 -0.11 0.04 0.00 0.00 0.00 0.00 60.65 61.00 1iny s ILE 94 Cb -0.23 -3.52 0.00 0.00 0.01 0.00 0.00 42.46 38.73 1iny s ILE 94 CO 0.28 0.13 0.43 0.59 0.00 0.00 0.00 174.94 176.37 1iny n ASN 95 N 5.05 0.85 0.00 3.58 5.03 -0.59 -5.02 115.26 124.17 1iny n ASN 95 Ca -0.14 -0.93 0.00 0.00 0.87 0.00 0.00 54.58 54.39 1iny n ASN 95 Cb 0.51 0.43 0.00 0.00 -1.02 0.00 0.00 39.78 39.70 1iny n ASN 95 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1iny n SER 96 N -0.33 0.00 -4.14 6.41 3.41 -1.18 -4.57 113.62 113.22 1iny n SER 96 Ca 0.02 0.00 -0.22 0.00 -0.26 0.00 0.00 58.87 58.41 1iny n SER 96 Cb 0.09 0.00 -0.14 0.00 -0.26 0.00 0.00 64.21 63.89 1iny n SER 96 CO 0.00 0.00 0.00 0.26 -0.16 0.00 0.00 175.04 175.14 1iny s TRP 97 N -2.00 1.33 0.18 7.33 0.52 -1.26 -0.87 118.94 124.16 1iny s TRP 97 Ca 0.00 -0.29 0.11 0.00 0.02 0.00 0.00 56.10 55.94 1iny s TRP 97 Cb 0.00 -0.83 -0.04 0.00 -1.15 0.00 0.00 33.47 31.45 1iny s TRP 97 CO 0.00 0.00 -0.23 -3.38 0.02 0.00 0.00 176.95 173.37 1iny s HIS 98 N -0.53 2.35 0.37 -1.98 -3.43 0.15 -4.93 115.29 107.30 1iny s HIS 98 Ca 0.05 -0.34 -0.28 0.00 -0.80 0.00 0.00 55.06 53.69 1iny s HIS 98 Cb -0.07 -1.19 -0.10 0.00 -1.43 0.00 0.00 32.58 29.80 1iny s HIS 98 CO 0.00 0.47 1.36 0.96 -2.00 0.00 0.00 174.74 175.52 1iny s ILE 99 N -1.53 2.49 -0.02 -5.38 -5.25 -1.26 -1.61 121.20 108.63 1iny s ILE 99 Ca 0.20 0.47 -0.07 0.00 -0.99 0.00 0.00 60.65 60.26 1iny s ILE 99 Cb -0.09 -3.29 -0.02 0.00 2.95 0.00 0.00 42.46 42.01 1iny s ILE 99 CO 0.10 0.10 -0.14 0.00 -1.79 0.00 0.00 174.94 173.20 1iny n TYR 100 N 0.47 0.00 -3.85 1.37 9.36 0.29 -4.81 117.16 119.99 1iny n TYR 100 Ca 0.02 0.00 -0.10 0.00 3.32 0.00 0.00 57.90 61.14 1iny n TYR 100 Cb 0.42 -0.21 -0.08 0.00 -0.63 0.00 0.00 39.34 38.84 1iny n TYR 100 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 1iny s GLY 101 N -4.35 0.06 -0.17 2.98 0.00 -0.96 -4.98 107.32 99.90 1iny s GLY 101 Ca -0.12 -0.44 -0.11 0.00 0.00 0.00 0.00 44.72 44.04 1iny s GLY 101 CO 0.18 -0.63 0.42 1.25 0.00 0.00 0.00 173.10 174.32 1iny s LYS 102 N -3.19 0.43 -0.07 2.90 2.20 -1.26 -0.50 119.74 120.26 1iny s LYS 102 Ca -0.00 0.71 -0.05 0.00 -0.36 0.00 0.00 55.97 56.27 1iny s LYS 102 Cb 0.02 0.08 -0.03 0.00 -1.51 0.00 0.00 37.83 36.39 1iny s LYS 102 CO -0.07 -0.12 0.22 0.22 -0.36 0.00 0.00 175.35 175.24 1iny h ASP 103 N 6.47 -0.15 -2.98 1.43 3.58 -1.53 -3.42 116.42 119.83 1iny h ASP 103 Ca -0.33 0.01 -0.28 0.00 0.42 0.00 0.00 57.03 56.85 1iny h ASP 103 Cb 1.18 0.04 0.03 0.00 1.72 0.00 0.00 39.33 42.30 1iny h ASP 103 CO 0.27 0.27 -0.41 0.59 -2.88 0.00 0.00 179.24 177.09 1iny n ASN 104 N -4.61 -4.63 -0.12 2.28 3.02 -1.26 -4.48 115.26 105.45 1iny n ASN 104 Ca -0.02 -0.16 -0.09 0.00 -0.03 0.00 0.00 54.58 54.28 1iny n ASN 104 Cb 0.07 -3.55 -0.01 0.00 -0.61 0.00 0.00 39.78 35.68 1iny n ASN 104 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1iny h ALA 105 N 0.69 0.49 -0.12 5.41 0.00 -1.90 -2.65 119.26 121.18 1iny h ALA 105 Ca -0.36 -0.11 -0.12 0.00 0.00 0.00 0.00 54.91 54.32 1iny h ALA 105 Cb 1.25 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.88 1iny h ALA 105 CO 0.39 0.06 -0.45 0.28 0.00 0.00 0.00 179.25 179.53 1iny h VAL 106 N 0.47 1.33 -0.14 0.00 2.07 -1.92 0.32 116.25 118.38 1iny h VAL 106 Ca 0.13 -1.63 -0.02 0.00 0.82 0.00 0.00 66.70 66.00 1iny h VAL 106 Cb 0.14 1.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.64 1iny h VAL 106 CO -0.01 0.49 0.01 0.03 0.02 0.00 0.00 177.57 178.10 1iny h ARG 107 N 0.23 0.24 -0.05 1.57 3.08 -1.85 -3.18 114.38 114.42 1iny h ARG 107 Ca 0.02 -0.07 -0.20 0.00 0.07 0.00 0.00 59.98 59.79 1iny h ARG 107 Cb 0.89 -0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.92 1iny h ARG 107 CO 0.07 0.45 -0.81 0.82 -1.07 0.00 0.00 179.97 179.44 1iny h ILE 108 N -0.01 1.38 0.00 2.04 2.04 -1.44 -3.23 117.51 118.29 1iny h ILE 108 Ca 0.04 -2.25 0.00 0.00 1.00 0.00 0.00 64.86 63.65 1iny h ILE 108 Cb 0.34 2.22 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 1iny h ILE 108 CO 0.01 0.68 0.00 0.61 0.00 0.00 0.00 178.15 179.44 1iny n GLY 109 N 0.70 -0.91 0.24 5.37 0.00 0.11 -1.93 105.19 108.78 1iny n GLY 109 Ca -0.05 0.11 0.03 0.00 0.00 0.00 0.00 46.02 46.11 1iny n GLY 109 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1iny h GLU 110 N 0.00 0.20 -0.35 1.61 4.22 -1.57 -3.26 114.58 115.44 1iny h GLU 110 Ca 0.00 -0.04 -0.26 0.00 0.08 0.00 0.00 59.36 59.14 1iny h GLU 110 Cb 0.11 -0.03 -0.36 0.00 0.50 0.00 0.00 28.75 28.97 1iny h GLU 110 CO 0.00 0.31 -0.98 -3.47 -2.18 0.00 0.00 179.01 172.70 1iny n ASP 111 N -4.32 2.12 -3.94 1.04 2.03 -0.82 -4.97 116.55 107.70 1iny n ASP 111 Ca -0.01 -2.56 -0.09 0.00 0.52 0.00 0.00 54.79 52.66 1iny n ASP 111 Cb 0.24 -0.41 -0.04 0.00 -0.72 0.00 0.00 41.12 40.18 1iny n ASP 111 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1iny s SER 112 N -3.28 -0.14 -1.30 1.67 0.01 -1.11 -5.07 113.70 104.49 1iny s SER 112 Ca 0.35 -0.80 -0.10 0.00 1.31 0.00 0.00 55.95 56.71 1iny s SER 112 Cb 0.36 0.61 0.16 0.00 0.21 0.00 0.00 66.02 67.36 1iny s SER 112 CO -0.06 -1.16 1.92 0.47 0.41 0.00 0.00 173.24 174.82 1iny n ASP 113 N -0.39 5.09 -4.82 2.44 8.00 -1.26 -4.76 116.55 120.85 1iny n ASP 113 Ca -0.03 -3.09 -0.36 0.00 0.71 0.00 0.00 54.79 52.01 1iny n ASP 113 Cb 0.61 -1.49 -0.07 0.00 -0.02 0.00 0.00 41.12 40.16 1iny n ASP 113 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1iny s VAL 114 N 0.53 5.20 0.06 2.53 1.01 -1.26 -1.59 120.40 126.87 1iny s VAL 114 Ca 0.40 0.09 -0.26 0.00 0.00 0.00 0.00 61.98 62.22 1iny s VAL 114 Cb 0.10 -3.25 -0.06 0.00 0.00 0.00 0.00 36.38 33.18 1iny s VAL 114 CO -0.00 0.61 0.79 -0.76 0.00 0.00 0.00 175.10 175.74 1iny s LEU 115 N -0.94 4.46 0.01 3.92 1.43 0.75 -2.20 118.68 126.11 1iny s LEU 115 Ca 0.14 1.51 -0.30 0.00 -1.03 0.00 0.00 54.13 54.45 1iny s LEU 115 Cb -0.12 -3.29 -0.07 0.00 0.03 0.00 0.00 46.19 42.75 1iny s LEU 115 CO 0.03 0.01 1.61 -0.69 0.23 0.00 0.00 176.35 177.54 1iny s VAL 116 N -0.09 3.39 0.31 -1.59 1.01 -0.01 -4.82 120.40 118.59 1iny s VAL 116 Ca 0.40 0.69 0.04 0.00 0.00 0.00 0.00 61.98 63.10 1iny s VAL 116 Cb -0.21 -3.44 -0.02 0.00 0.00 0.00 0.00 36.38 32.71 1iny s VAL 116 CO 0.24 -0.03 0.15 0.35 0.00 0.00 0.00 175.10 175.82 1iny n THR 117 N 5.03 0.00 -3.90 3.92 -2.24 -1.26 -1.76 114.28 114.07 1iny n THR 117 Ca 0.16 -1.93 -0.01 0.00 -2.27 0.00 0.00 64.05 60.01 1iny n THR 117 Cb 0.42 0.78 0.01 0.00 -2.10 0.00 0.00 70.33 69.44 1iny n THR 117 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1iny s ARG 118 N -3.20 0.88 -1.22 -0.78 0.52 -0.90 -3.73 118.95 110.52 1iny s ARG 118 Ca 0.22 -0.56 -0.20 0.00 -0.52 0.00 0.00 55.73 54.66 1iny s ARG 118 Cb 0.01 0.25 0.01 0.00 0.52 0.00 0.00 34.95 35.74 1iny s ARG 118 CO 0.15 -0.41 0.67 0.39 0.02 0.00 0.00 175.30 176.12 1iny n GLU 119 N -0.75 -1.29 -2.30 3.54 4.71 -1.26 -1.65 120.64 121.64 1iny n GLU 119 Ca -0.01 0.33 -0.26 0.00 -0.01 0.00 0.00 57.16 57.20 1iny n GLU 119 Cb 0.59 -3.74 0.15 0.00 -1.01 0.00 0.00 31.44 27.44 1iny n GLU 119 CO 0.00 0.00 0.00 -1.25 0.09 0.00 0.00 177.13 175.97 1iny s PRO 120 N -6.53 1.15 0.04 3.49 0.04 -1.26 -4.07 135.00 127.86 1iny s PRO 120 Ca 0.38 -0.84 -0.27 0.00 0.04 0.00 0.00 61.00 60.31 1iny s PRO 120 Cb -0.16 -2.11 0.09 0.00 0.04 0.00 0.00 34.50 32.36 1iny s PRO 120 CO 0.90 -1.93 1.22 1.52 0.04 0.00 0.00 177.00 178.75 1iny s TYR 121 N -3.49 0.02 0.10 0.56 1.13 -0.52 -4.84 117.35 110.30 1iny s TYR 121 Ca 0.70 -0.21 0.07 0.00 -1.41 0.00 0.00 57.07 56.23 1iny s TYR 121 Cb -0.04 0.59 -0.03 0.00 -1.10 0.00 0.00 41.96 41.38 1iny s TYR 121 CO 0.48 -0.45 -0.19 0.08 -2.51 0.00 0.00 175.55 172.97 1iny s VAL 122 N -2.18 1.58 -0.19 -3.49 1.01 -1.26 0.02 120.40 115.89 1iny s VAL 122 Ca 0.24 -1.50 -0.12 0.00 0.00 0.00 0.00 61.98 60.60 1iny s VAL 122 Cb 0.00 -1.45 0.06 0.00 0.00 0.00 0.00 36.38 34.99 1iny s VAL 122 CO 0.00 -0.10 0.47 -0.55 0.00 0.00 0.00 175.10 174.92 1iny s SER 123 N -1.89 -0.57 0.14 3.32 0.15 -0.89 -4.65 113.70 109.31 1iny s SER 123 Ca 0.05 1.00 0.00 0.00 0.70 0.00 0.00 55.95 57.70 1iny s SER 123 Cb -0.10 0.92 -0.04 0.00 -1.71 0.00 0.00 66.02 65.09 1iny s SER 123 CO 0.04 -0.19 0.30 0.00 1.20 0.00 0.00 173.24 174.59 1iny n ASP 125 N -0.31 3.24 0.19 0.00 9.92 -0.22 -4.46 116.55 124.91 1iny n ASP 125 Ca -0.05 -3.12 0.05 0.00 -0.53 0.00 0.00 54.79 51.14 1iny n ASP 125 Cb 0.53 0.26 0.37 0.00 -0.64 0.00 0.00 41.12 41.65 1iny n ASP 125 CO 0.00 0.00 0.00 -0.65 0.13 0.00 0.00 177.20 176.68 1iny h PRO 126 N 0.00 0.00 0.00 -0.24 0.11 -1.98 -3.37 132.00 126.52 1iny h PRO 126 Ca -0.40 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.66 1iny h PRO 126 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 1iny h PRO 126 CO 0.66 0.36 -1.65 -0.40 -0.21 0.00 0.00 178.00 176.76 1iny n ASP 127 N -3.66 2.01 -3.66 -2.05 5.68 -1.26 -4.93 116.55 108.68 1iny n ASP 127 Ca -0.01 0.00 -0.14 0.00 -0.50 0.00 0.00 54.79 54.15 1iny n ASP 127 Cb 0.47 1.41 -0.07 0.00 -1.14 0.00 0.00 41.12 41.79 1iny n ASP 127 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 1iny s GLU 128 N -2.77 0.90 -0.13 0.11 -1.05 -1.26 -5.16 118.70 109.35 1iny s GLU 128 Ca -0.05 -0.24 -0.02 0.00 -0.15 0.00 0.00 54.97 54.51 1iny s GLU 128 Cb 0.07 0.41 -0.03 0.00 -0.44 0.00 0.00 34.13 34.14 1iny s GLU 128 CO 0.53 -0.30 -0.06 0.00 0.95 0.00 0.00 175.26 176.39 1iny s ARG 130 N 0.03 2.01 0.12 0.00 0.52 -0.57 -4.20 118.95 116.86 1iny s ARG 130 Ca -0.01 -1.96 -0.03 0.00 -0.52 0.00 0.00 55.73 53.21 1iny s ARG 130 Cb -0.14 -1.77 -0.05 0.00 0.52 0.00 0.00 34.95 33.51 1iny s ARG 130 CO 0.03 0.00 0.32 -0.06 0.02 0.00 0.00 175.30 175.61 1iny s PHE 131 N -2.64 3.49 0.08 -0.53 0.08 -0.87 -2.10 117.98 115.49 1iny s PHE 131 Ca 0.36 0.45 0.04 0.00 0.12 0.00 0.00 56.93 57.90 1iny s PHE 131 Cb 0.06 -1.92 -0.03 0.00 -0.57 0.00 0.00 43.02 40.55 1iny s PHE 131 CO 0.19 0.48 -0.10 0.71 -0.10 0.00 0.00 175.22 176.40 1iny s TYR 132 N -1.61 1.00 0.02 0.36 1.51 0.10 -2.27 117.35 116.45 1iny s TYR 132 Ca 0.39 -0.59 -0.29 0.00 -1.01 0.00 0.00 57.07 55.58 1iny s TYR 132 Cb -0.12 -0.56 0.10 0.00 -0.11 0.00 0.00 41.96 41.26 1iny s TYR 132 CO 0.26 -0.01 1.01 0.00 -1.11 0.00 0.00 175.55 175.69 1iny s ALA 133 N -2.01 -1.86 -0.42 3.71 0.00 -1.05 -1.43 121.76 118.70 1iny s ALA 133 Ca 0.01 0.76 -0.11 0.00 0.00 0.00 0.00 51.96 52.62 1iny s ALA 133 Cb -0.06 0.41 0.06 0.00 0.00 0.00 0.00 23.12 23.53 1iny s ALA 133 CO 0.00 -0.84 0.28 -0.51 0.00 0.00 0.00 175.76 174.70 1iny s LEU 134 N -2.65 5.18 0.79 0.00 1.02 -0.66 -2.09 118.68 120.27 1iny s LEU 134 Ca 0.09 -1.32 -0.11 0.00 0.02 0.00 0.00 54.13 52.82 1iny s LEU 134 Cb -0.00 -2.05 0.07 0.00 0.02 0.00 0.00 46.19 44.22 1iny s LEU 134 CO -0.04 -0.53 1.09 -0.55 0.02 0.00 0.00 176.35 176.34 1iny s SER 135 N 2.10 4.40 0.00 2.29 0.15 -0.57 -2.13 113.70 119.95 1iny s SER 135 Ca 0.03 1.73 0.08 0.00 0.70 0.00 0.00 55.95 58.50 1iny s SER 135 Cb -0.22 -2.45 0.05 0.00 -1.71 0.00 0.00 66.02 61.69 1iny s SER 135 CO 0.05 -2.09 0.70 0.00 1.20 0.00 0.00 173.24 173.11 1iny n GLN 136 N -3.55 0.65 -2.72 5.44 1.13 -0.72 -3.19 117.38 114.42 1iny n GLN 136 Ca 0.09 -0.87 -0.08 0.00 -1.94 0.00 0.00 57.00 54.20 1iny n GLN 136 Cb 0.53 -1.12 0.03 0.00 0.11 0.00 0.00 30.24 29.80 1iny n GLN 136 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1iny n GLY 137 N 0.54 0.21 3.58 1.08 0.00 -1.10 -4.66 105.19 104.84 1iny n GLY 137 Ca 0.04 -0.27 -0.06 0.00 0.00 0.00 0.00 46.02 45.73 1iny n GLY 137 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iny s THR 138 N -3.14 0.00 0.31 2.61 2.01 -1.26 -5.06 115.64 111.11 1iny s THR 138 Ca 0.09 0.00 -0.08 0.00 0.31 0.00 0.00 61.69 62.02 1iny s THR 138 Cb -0.04 -1.00 -0.06 0.00 0.01 0.00 0.00 72.50 71.41 1iny s THR 138 CO 0.30 0.00 0.61 0.42 -0.69 0.00 0.00 174.62 175.26 1iny s THR 139 N -2.11 4.94 0.15 -0.82 -4.23 -1.26 -0.83 115.64 111.48 1iny s THR 139 Ca 0.06 0.31 -0.17 0.00 -1.18 0.00 0.00 61.69 60.71 1iny s THR 139 Cb -0.01 -3.71 0.01 0.00 1.34 0.00 0.00 72.50 70.14 1iny s THR 139 CO -0.05 -0.32 1.76 0.40 -0.54 0.00 0.00 174.62 175.87 1iny h ILE 140 N 1.44 0.92 0.00 2.99 2.04 -1.75 -1.99 117.51 121.16 1iny h ILE 140 Ca -0.47 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.29 1iny h ILE 140 Cb 1.18 0.61 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1iny h ILE 140 CO 0.66 0.05 0.00 -1.14 0.00 0.00 0.00 178.15 177.72 1iny n ARG 141 N -5.00 0.00 -2.43 2.37 3.00 -1.26 -4.79 116.66 108.54 1iny n ARG 141 Ca 0.01 0.09 -0.34 0.00 -0.00 0.00 0.00 57.85 57.61 1iny n ARG 141 Cb 0.11 -1.50 -0.02 0.00 0.00 0.00 0.00 32.46 31.05 1iny n ARG 141 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.63 177.83 1iny s GLY 142 N -2.99 2.47 0.33 5.14 0.00 -0.75 -4.97 107.32 106.54 1iny s GLY 142 Ca 0.11 0.60 0.05 0.00 0.00 0.00 0.00 44.72 45.49 1iny s GLY 142 CO 0.43 0.92 1.89 0.50 0.00 0.00 0.00 173.10 176.85 1iny h LYS 143 N 1.35 0.82 0.00 2.90 6.56 -1.88 -2.78 116.57 123.54 1iny h LYS 143 Ca -0.49 -0.05 0.00 0.00 -1.06 0.00 0.00 60.65 59.05 1iny h LYS 143 Cb 1.23 -0.19 0.00 0.00 -0.57 0.00 0.00 32.23 32.70 1iny h LYS 143 CO 0.58 0.54 0.00 0.72 -2.06 0.00 0.00 179.45 179.24 1iny n HIS 144 N -4.53 0.00 0.88 -1.35 8.25 -1.26 -2.71 115.22 114.49 1iny n HIS 144 Ca 0.15 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.74 1iny n HIS 144 Cb 0.33 0.00 0.33 0.00 1.12 0.00 0.00 29.99 31.77 1iny n HIS 144 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 1iny n SER 145 N -0.57 0.45 -4.62 0.41 3.41 -1.05 -4.70 113.62 106.94 1iny n SER 145 Ca 0.02 0.05 -0.43 0.00 -0.26 0.00 0.00 58.87 58.25 1iny n SER 145 Cb 0.01 -0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 63.94 1iny n SER 145 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 1iny s ASN 146 N -3.36 6.68 0.00 4.04 3.84 -1.10 -3.06 114.94 121.97 1iny s ASN 146 Ca 0.11 0.96 0.00 0.00 0.21 0.00 0.00 52.86 54.14 1iny s ASN 146 Cb 0.17 -2.54 0.00 0.00 -0.55 0.00 0.00 41.25 38.32 1iny s ASN 146 CO 0.66 -1.12 0.00 0.61 -2.79 0.00 0.00 177.10 174.46 1iny n GLY 147 N 4.43 0.93 0.64 1.21 0.00 -0.89 -4.97 105.19 106.54 1iny n GLY 147 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1iny n GLY 147 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iny n THR 148 N -1.44 0.28 0.22 2.61 -2.24 -1.17 -3.10 114.28 109.43 1iny n THR 148 Ca 0.00 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.90 1iny n THR 148 Cb 0.00 -0.62 0.11 0.00 -2.10 0.00 0.00 70.33 67.71 1iny n THR 148 CO 0.00 0.00 0.00 -0.29 -0.57 0.00 0.00 175.07 174.21 1iny h ILE 149 N 0.01 0.00 -4.21 2.28 6.09 -1.88 -3.38 117.51 116.42 1iny h ILE 149 Ca 0.00 -0.94 -0.49 0.00 -1.37 0.00 0.00 64.86 62.06 1iny h ILE 149 Cb 0.62 1.69 0.05 0.00 0.47 0.00 0.00 36.82 39.65 1iny h ILE 149 CO 0.00 0.00 0.38 -1.00 -3.07 0.00 0.00 178.15 174.46 1iny s HIS 150 N -3.27 3.15 -0.26 2.19 3.76 -1.18 -5.03 115.29 114.65 1iny s HIS 150 Ca 0.04 1.48 0.00 0.00 -0.15 0.00 0.00 55.06 56.43 1iny s HIS 150 Cb 0.08 -2.93 -0.16 0.00 1.11 0.00 0.00 32.58 30.68 1iny s HIS 150 CO 0.72 -0.91 -0.24 -0.25 -0.85 0.00 0.00 174.74 173.21 1iny n ASP 151 N -2.04 2.01 -4.46 1.40 9.92 -1.26 -4.93 116.55 117.19 1iny n ASP 151 Ca 0.08 -0.08 -0.38 0.00 -0.53 0.00 0.00 54.79 53.88 1iny n ASP 151 Cb 0.53 -0.45 -0.12 0.00 -0.64 0.00 0.00 41.12 40.44 1iny n ASP 151 CO 0.00 0.00 0.00 -0.13 0.13 0.00 0.00 177.20 177.20 1iny s ARG 152 N -2.51 3.54 0.06 -1.24 0.52 -1.26 -4.91 118.95 113.15 1iny s ARG 152 Ca -0.35 -0.57 -0.20 0.00 -0.52 0.00 0.00 55.73 54.09 1iny s ARG 152 Cb 0.10 -3.48 0.04 0.00 0.52 0.00 0.00 34.95 32.13 1iny s ARG 152 CO 0.58 -0.30 0.47 -1.54 0.02 0.00 0.00 175.30 174.53 1iny s SER 153 N 1.63 -0.36 0.00 0.23 1.04 -1.26 -5.04 113.70 109.95 1iny s SER 153 Ca 0.06 0.04 0.05 0.00 0.48 0.00 0.00 55.95 56.57 1iny s SER 153 Cb -0.16 0.47 0.22 0.00 0.10 0.00 0.00 66.02 66.64 1iny s SER 153 CO 0.06 -0.73 1.12 0.00 0.98 0.00 0.00 173.24 174.67 1iny n GLN 154 N 0.32 0.02 -0.51 4.02 3.00 -1.26 -3.12 117.38 119.86 1iny n GLN 154 Ca -0.18 0.37 0.08 0.00 -0.01 0.00 0.00 57.00 57.27 1iny n GLN 154 Cb 0.61 -1.50 0.29 0.00 0.00 0.00 0.00 30.24 29.64 1iny n GLN 154 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.06 177.72 1iny n TYR 155 N -1.45 1.18 -3.81 1.08 4.01 -1.26 -4.99 117.16 111.91 1iny n TYR 155 Ca 0.01 -0.69 -0.23 0.00 -0.16 0.00 0.00 57.90 56.83 1iny n TYR 155 Cb 0.05 -0.26 -0.02 0.00 -0.31 0.00 0.00 39.34 38.80 1iny n TYR 155 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 1iny s ARG 156 N -2.13 3.46 0.11 -0.72 0.52 -1.18 -2.71 118.95 116.30 1iny s ARG 156 Ca 0.43 -0.62 -0.25 0.00 -0.52 0.00 0.00 55.73 54.78 1iny s ARG 156 Cb 0.30 -2.84 0.07 0.00 0.52 0.00 0.00 34.95 33.01 1iny s ARG 156 CO 0.16 0.37 0.65 0.00 0.02 0.00 0.00 175.30 176.51 1iny s ALA 157 N -2.02 -1.65 -0.33 2.13 0.00 -1.19 -3.57 121.76 115.13 1iny s ALA 157 Ca 0.36 0.66 -0.19 0.00 0.00 0.00 0.00 51.96 52.79 1iny s ALA 157 Cb -0.09 0.71 -0.01 0.00 0.00 0.00 0.00 23.12 23.73 1iny s ALA 157 CO 0.31 -0.71 0.56 -1.17 0.00 0.00 0.00 175.76 174.75 1iny s LEU 158 N -2.52 4.23 0.28 0.00 2.96 0.01 -1.50 118.68 122.13 1iny s LEU 158 Ca 0.00 0.20 0.12 0.00 -0.22 0.00 0.00 54.13 54.23 1iny s LEU 158 Cb -0.01 -2.69 -0.05 0.00 0.50 0.00 0.00 46.19 43.95 1iny s LEU 158 CO -0.10 -0.47 -0.18 0.27 -1.32 0.00 0.00 176.35 174.56 1iny s ILE 159 N 2.49 2.59 0.03 6.68 -4.36 -0.89 0.59 121.20 128.33 1iny s ILE 159 Ca 0.22 -2.35 0.01 0.00 -0.26 0.00 0.00 60.65 58.26 1iny s ILE 159 Cb -0.15 -2.36 -0.02 0.00 1.25 0.00 0.00 42.46 41.18 1iny s ILE 159 CO 0.13 -0.40 -0.05 -0.94 0.24 0.00 0.00 174.94 173.92 1iny s SER 160 N -3.53 0.52 0.22 4.36 1.04 0.81 -2.52 113.70 114.61 1iny s SER 160 Ca 0.30 -0.53 -0.10 0.00 0.48 0.00 0.00 55.95 56.11 1iny s SER 160 Cb -0.05 0.07 -0.01 0.00 0.10 0.00 0.00 66.02 66.13 1iny s SER 160 CO 0.16 -0.26 0.37 -1.66 0.98 0.00 0.00 173.24 172.82 1iny s TRP 161 N -1.45 0.52 0.36 5.02 -2.14 -0.96 -1.10 118.94 119.20 1iny s TRP 161 Ca -0.13 -0.86 -0.28 0.00 2.66 0.00 0.00 56.10 57.49 1iny s TRP 161 Cb -0.10 -0.01 -0.10 0.00 -3.10 0.00 0.00 33.47 30.16 1iny s TRP 161 CO -0.00 -0.86 1.40 -2.14 -2.66 0.00 0.00 176.95 172.68 1iny s PRO 162 N -4.03 4.18 -0.13 3.25 0.02 -1.26 -2.05 135.00 134.98 1iny s PRO 162 Ca 0.25 2.40 -0.36 0.00 0.02 0.00 0.00 61.00 63.31 1iny s PRO 162 Cb 0.02 -2.98 -0.13 0.00 0.02 0.00 0.00 34.50 31.42 1iny s PRO 162 CO 0.08 -0.41 1.81 -0.11 -0.33 0.00 0.00 177.00 178.04 1iny n LEU 163 N 0.54 3.06 -0.45 -5.54 7.94 -1.26 -2.33 117.00 118.97 1iny n LEU 163 Ca 0.01 1.01 -0.06 0.00 -1.11 0.00 0.00 56.01 55.86 1iny n LEU 163 Cb 0.41 -1.30 -0.03 0.00 0.53 0.00 0.00 43.42 43.03 1iny n LEU 163 CO 0.61 -0.21 -0.06 -1.20 -1.11 0.00 0.00 177.39 175.43 1iny n SER 164 N 5.97 -3.72 -4.60 1.96 7.64 -1.26 -5.00 113.62 114.61 1iny n SER 164 Ca 0.23 0.15 -0.24 0.00 1.01 0.00 0.00 58.87 60.02 1iny n SER 164 Cb 0.24 -1.73 -0.08 0.00 -1.01 0.00 0.00 64.21 61.63 1iny n SER 164 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 1iny s SER 165 N -2.93 4.33 0.53 6.43 0.01 -0.98 -4.61 113.70 116.48 1iny s SER 165 Ca 0.00 -0.70 -0.10 0.00 1.31 0.00 0.00 55.95 56.46 1iny s SER 165 Cb 0.00 -0.73 -0.05 0.00 0.21 0.00 0.00 66.02 65.45 1iny s SER 165 CO 0.00 0.03 0.91 -2.84 0.41 0.00 0.00 173.24 171.75 1iny s PRO 166 N -3.50 3.66 -1.13 12.44 0.02 -1.26 -4.86 135.00 140.38 1iny s PRO 166 Ca 0.30 0.57 -0.22 0.00 0.02 0.00 0.00 61.00 61.67 1iny s PRO 166 Cb -0.07 -2.23 -0.04 0.00 0.02 0.00 0.00 34.50 32.19 1iny s PRO 166 CO 0.18 -0.33 1.86 -2.14 -0.33 0.00 0.00 177.00 176.24 1iny s PRO 167 N -4.67 2.86 0.38 5.54 0.02 -1.26 -4.91 135.00 132.96 1iny s PRO 167 Ca 0.53 -1.11 -0.16 0.00 0.02 0.00 0.00 61.00 60.28 1iny s PRO 167 Cb -0.11 -5.26 -0.09 0.00 0.02 0.00 0.00 34.50 29.06 1iny s PRO 167 CO 0.44 -3.40 0.82 0.99 -0.33 0.00 0.00 177.00 175.52 1iny s THR 168 N 9.12 4.61 0.38 0.99 2.01 -1.26 -0.18 115.64 131.31 1iny s THR 168 Ca 0.64 1.04 0.12 0.00 0.31 0.00 0.00 61.69 63.80 1iny s THR 168 Cb -0.01 -3.64 0.11 0.00 0.01 0.00 0.00 72.50 68.97 1iny s THR 168 CO 0.07 -0.33 1.85 0.58 -0.69 0.00 0.00 174.62 176.10 1iny h VAL 169 N 1.68 1.24 0.00 3.82 2.07 -1.65 -2.97 116.25 120.44 1iny h VAL 169 Ca -0.48 -1.13 0.00 0.00 0.82 0.00 0.00 66.70 65.92 1iny h VAL 169 Cb 1.18 1.56 0.00 0.00 -1.52 0.00 0.00 31.29 32.51 1iny h VAL 169 CO 0.64 0.33 -0.90 -1.22 0.02 0.00 0.00 177.57 176.43 1iny n TYR 170 N -4.15 0.10 0.04 1.57 4.01 -1.26 -4.39 117.16 113.08 1iny n TYR 170 Ca -0.02 0.03 0.02 0.00 -0.16 0.00 0.00 57.90 57.77 1iny n TYR 170 Cb 0.37 -0.25 0.03 0.00 -0.31 0.00 0.00 39.34 39.18 1iny n TYR 170 CO 0.00 0.00 0.00 0.27 -0.46 0.00 0.00 176.86 176.67 1iny n ASN 171 N -1.70 1.83 -4.87 7.72 2.04 -1.22 -5.04 115.26 114.03 1iny n ASN 171 Ca 0.03 -1.60 -0.34 0.00 -0.44 0.00 0.00 54.58 52.23 1iny n ASN 171 Cb 0.38 -0.04 -0.05 0.00 -2.53 0.00 0.00 39.78 37.54 1iny n ASN 171 CO 0.00 0.00 0.00 -0.44 -0.44 0.00 0.00 177.26 176.38 1iny s SER 172 N -0.67 6.65 -0.11 0.53 0.01 -1.12 -4.65 113.70 114.33 1iny s SER 172 Ca 0.06 0.84 0.03 0.00 1.31 0.00 0.00 55.95 58.18 1iny s SER 172 Cb 0.03 -2.19 -0.00 0.00 0.21 0.00 0.00 66.02 64.07 1iny s SER 172 CO 0.05 0.10 -0.21 -0.60 0.41 0.00 0.00 173.24 172.98 1iny s ARG 173 N -2.18 3.12 -0.14 12.44 3.52 -0.25 -4.96 118.95 130.49 1iny s ARG 173 Ca 0.37 -0.83 -0.22 0.00 -0.13 0.00 0.00 55.73 54.92 1iny s ARG 173 Cb -0.13 -2.39 -0.03 0.00 -1.56 0.00 0.00 34.95 30.83 1iny s ARG 173 CO 0.20 0.15 0.66 0.08 -0.81 0.00 0.00 175.30 175.58 1iny s VAL 174 N 0.42 5.03 -0.17 7.11 1.01 -1.26 -0.13 120.40 132.41 1iny s VAL 174 Ca -0.15 1.30 -0.16 0.00 0.00 0.00 0.00 61.98 62.96 1iny s VAL 174 Cb -0.17 -3.99 -0.22 0.00 0.00 0.00 0.00 36.38 32.00 1iny s VAL 174 CO 0.07 0.17 0.29 -0.33 0.00 0.00 0.00 175.10 175.30 1iny h GLU 175 N 7.15 0.10 -2.18 2.72 4.39 -0.21 -3.49 114.58 123.06 1iny h GLU 175 Ca -0.35 -0.18 0.18 0.00 0.34 0.00 0.00 59.36 59.35 1iny h GLU 175 Cb 1.16 0.07 -0.11 0.00 -0.10 0.00 0.00 28.75 29.77 1iny h GLU 175 CO 0.77 1.09 0.54 0.00 -1.16 0.00 0.00 179.01 180.25 1iny s ILE 177 N -3.10 5.17 0.00 0.00 -1.09 -1.26 -0.81 121.20 120.11 1iny s ILE 177 Ca 0.10 0.61 0.00 0.00 -2.23 0.00 0.00 60.65 59.13 1iny s ILE 177 Cb -0.01 -3.71 0.00 0.00 -1.58 0.00 0.00 42.46 37.16 1iny s ILE 177 CO -0.02 0.16 0.00 0.61 -1.23 0.00 0.00 174.94 174.46 1iny n GLY 178 N 4.58 0.91 0.77 6.18 0.00 -1.23 -4.47 105.19 111.92 1iny n GLY 178 Ca -0.08 -0.97 0.07 0.00 0.00 0.00 0.00 46.02 45.04 1iny n GLY 178 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1iny n TRP 179 N -0.44 0.70 -3.62 1.61 4.27 0.04 -3.44 117.44 116.56 1iny n TRP 179 Ca 0.00 -0.67 -0.15 0.00 -3.89 0.00 0.00 57.50 52.79 1iny n TRP 179 Cb 0.00 -0.16 -0.07 0.00 -1.36 0.00 0.00 31.31 29.72 1iny n TRP 179 CO 0.00 0.00 0.00 0.45 -2.29 0.00 0.00 177.69 175.85 1iny s SER 180 N -1.41 -0.65 0.26 -0.67 0.15 -1.24 -4.92 113.70 105.21 1iny s SER 180 Ca 0.32 1.07 -0.20 0.00 0.70 0.00 0.00 55.95 57.84 1iny s SER 180 Cb 0.22 1.04 0.06 0.00 -1.71 0.00 0.00 66.02 65.64 1iny s SER 180 CO 0.13 -0.35 0.91 -0.94 1.20 0.00 0.00 173.24 174.18 1iny s SER 181 N -0.21 -0.05 0.06 5.45 1.04 -1.26 -2.06 113.70 116.67 1iny s SER 181 Ca -0.04 -0.78 -0.26 0.00 0.48 0.00 0.00 55.95 55.34 1iny s SER 181 Cb -0.03 0.64 0.09 0.00 0.10 0.00 0.00 66.02 66.82 1iny s SER 181 CO 0.04 -1.25 0.75 0.28 0.98 0.00 0.00 173.24 174.04 1iny s THR 182 N -2.58 0.00 -0.05 2.02 -1.32 -1.10 -1.04 115.64 111.57 1iny s THR 182 Ca 0.17 0.00 -0.29 0.00 -1.21 0.00 0.00 61.69 60.35 1iny s THR 182 Cb -0.04 -1.00 0.09 0.00 -1.51 0.00 0.00 72.50 70.05 1iny s THR 182 CO 0.07 0.00 0.80 -0.55 -2.21 0.00 0.00 174.62 172.73 1iny s SER 183 N -2.53 -0.52 -0.24 8.08 0.15 -1.26 -1.51 113.70 115.87 1iny s SER 183 Ca 0.03 0.44 -0.28 0.00 0.70 0.00 0.00 55.95 56.83 1iny s SER 183 Cb -0.01 0.45 0.16 0.00 -1.71 0.00 0.00 66.02 64.91 1iny s SER 183 CO -0.10 -0.57 1.19 0.00 1.20 0.00 0.00 173.24 174.95 1iny s HIS 185 N -0.65 3.52 -0.85 0.00 2.46 -1.26 -0.95 115.29 117.55 1iny s HIS 185 Ca 0.04 0.60 0.08 0.00 0.47 0.00 0.00 55.06 56.25 1iny s HIS 185 Cb -0.02 -2.03 0.14 0.00 -0.13 0.00 0.00 32.58 30.54 1iny s HIS 185 CO -0.06 0.49 0.97 -0.40 -2.47 0.00 0.00 174.74 173.27 1iny n ASP 186 N 0.47 2.16 0.00 9.88 5.68 -0.12 -4.74 116.55 129.88 1iny n ASP 186 Ca -0.05 -1.66 0.00 0.00 -0.50 0.00 0.00 54.79 52.58 1iny n ASP 186 Cb 0.52 -0.08 0.00 0.00 -1.14 0.00 0.00 41.12 40.42 1iny n ASP 186 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1iny n GLY 187 N 0.35 2.59 0.00 6.12 0.00 -1.26 -1.24 105.19 111.76 1iny n GLY 187 Ca 0.07 -0.86 0.00 0.00 0.00 0.00 0.00 46.02 45.22 1iny n GLY 187 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1iny n LYS 188 N 0.00 0.00 -4.02 1.61 5.02 -1.26 -3.12 118.16 116.39 1iny n LYS 188 Ca 0.00 0.06 -0.20 0.00 -2.02 0.00 0.00 58.31 56.16 1iny n LYS 188 Cb 0.00 -0.52 -0.06 0.00 -0.02 0.00 0.00 35.03 34.42 1iny n LYS 188 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1iny n THR 189 N -2.32 0.00 -4.47 -0.18 5.66 -1.26 -4.60 114.28 107.11 1iny n THR 189 Ca 0.00 -2.08 -0.33 0.00 -3.05 0.00 0.00 64.05 58.58 1iny n THR 189 Cb 0.00 0.87 -0.10 0.00 -1.55 0.00 0.00 70.33 69.55 1iny n THR 189 CO 0.00 0.00 0.00 -0.60 -3.05 0.00 0.00 175.07 171.42 1iny s ARG 190 N -3.28 2.74 -0.12 1.09 3.52 -1.26 -0.95 118.95 120.70 1iny s ARG 190 Ca 0.25 -0.58 -0.01 0.00 -0.13 0.00 0.00 55.73 55.26 1iny s ARG 190 Cb 0.01 -2.62 -0.02 0.00 -1.56 0.00 0.00 34.95 30.76 1iny s ARG 190 CO 0.18 0.65 -0.08 1.41 -0.81 0.00 0.00 175.30 176.64 1iny s MET 191 N -1.13 3.29 0.03 5.12 -2.45 -0.13 -2.80 119.30 121.22 1iny s MET 191 Ca 0.15 -0.60 0.05 0.00 -1.25 0.00 0.00 55.69 54.04 1iny s MET 191 Cb -0.11 -2.71 -0.02 0.00 1.25 0.00 0.00 34.83 33.24 1iny s MET 191 CO 0.05 0.35 -0.14 -1.12 1.05 0.00 0.00 175.02 175.22 1iny s SER 192 N 0.02 1.61 -0.06 1.11 0.01 -0.86 -1.56 113.70 113.97 1iny s SER 192 Ca -0.02 -0.40 0.01 0.00 1.31 0.00 0.00 55.95 56.85 1iny s SER 192 Cb -0.14 -0.12 0.02 0.00 0.21 0.00 0.00 66.02 65.99 1iny s SER 192 CO 0.03 0.07 -0.05 -0.63 0.41 0.00 0.00 173.24 173.07 1iny s ILE 193 N -0.71 0.62 0.03 1.44 1.01 -0.57 -1.37 121.20 121.65 1iny s ILE 193 Ca 0.02 -0.13 0.07 0.00 0.00 0.00 0.00 60.65 60.61 1iny s ILE 193 Cb -0.07 -0.65 -0.02 0.00 0.01 0.00 0.00 42.46 41.72 1iny s ILE 193 CO 0.01 0.26 -0.19 0.00 0.00 0.00 0.00 174.94 175.01 1iny s ILE 195 N -0.72 2.49 0.20 0.00 1.01 -0.88 -2.25 121.20 121.05 1iny s ILE 195 Ca 0.07 -0.89 -0.03 0.00 0.00 0.00 0.00 60.65 59.80 1iny s ILE 195 Cb -0.08 -1.97 -0.03 0.00 0.01 0.00 0.00 42.46 40.38 1iny s ILE 195 CO 0.01 0.56 0.18 -0.94 0.00 0.00 0.00 174.94 174.75 1iny s SER 196 N 0.06 0.13 0.00 3.58 1.04 -1.04 -0.78 113.70 116.69 1iny s SER 196 Ca -0.08 -1.27 0.00 0.00 0.48 0.00 0.00 55.95 55.08 1iny s SER 196 Cb -0.15 0.40 0.00 0.00 0.10 0.00 0.00 66.02 66.37 1iny s SER 196 CO 0.05 -0.87 0.00 0.61 0.98 0.00 0.00 173.24 174.01 1iny n GLY 197 N -0.26 0.99 3.92 7.32 0.00 -1.26 -1.59 105.19 114.30 1iny n GLY 197 Ca -0.00 -2.24 -0.29 0.00 0.00 0.00 0.00 46.02 43.49 1iny n GLY 197 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1iny s PRO 198 N -1.04 1.30 0.17 1.61 0.02 -1.26 -4.81 135.00 130.98 1iny s PRO 198 Ca 0.00 -0.18 -0.07 0.00 0.02 0.00 0.00 61.00 60.77 1iny s PRO 198 Cb 0.00 -1.91 0.04 0.00 0.02 0.00 0.00 34.50 32.65 1iny s PRO 198 CO 0.00 -2.00 1.48 -0.91 -0.33 0.00 0.00 177.00 175.24 1iny h ASN 199 N -1.33 0.79 -0.26 2.53 4.21 -1.98 -2.91 115.58 116.64 1iny h ASN 199 Ca -0.45 -0.40 -0.03 0.00 1.21 0.00 0.00 56.30 56.63 1iny h ASN 199 Cb 1.28 -0.23 -0.02 0.00 -1.12 0.00 0.00 38.32 38.24 1iny h ASN 199 CO 0.51 1.15 0.08 -0.55 -1.29 0.00 0.00 177.43 177.34 1iny h ASN 200 N 0.57 0.44 -0.82 5.81 -1.07 -1.95 -3.21 115.58 115.34 1iny h ASN 200 Ca 0.02 -0.06 -0.03 0.00 0.07 0.00 0.00 56.30 56.31 1iny h ASN 200 Cb 1.07 -0.11 -0.18 0.00 -2.07 0.00 0.00 38.32 37.02 1iny h ASN 200 CO 0.10 0.45 -0.38 0.54 0.07 0.00 0.00 177.43 178.22 1iny s ASN 201 N -6.74 -1.25 0.88 6.14 6.03 -1.18 -4.63 114.94 114.19 1iny s ASN 201 Ca -0.07 -0.73 -0.12 0.00 -1.03 0.00 0.00 52.86 50.91 1iny s ASN 201 Cb 0.16 1.61 0.17 0.00 -3.03 0.00 0.00 41.25 40.16 1iny s ASN 201 CO 0.75 -0.13 1.22 0.00 -2.03 0.00 0.00 177.10 176.91 1iny s ALA 202 N 1.77 2.65 -0.20 3.54 0.00 -1.11 -4.27 121.76 124.14 1iny s ALA 202 Ca 0.17 -1.26 -0.27 0.00 0.00 0.00 0.00 51.96 50.59 1iny s ALA 202 Cb -0.02 -2.60 0.10 0.00 0.00 0.00 0.00 23.12 20.59 1iny s ALA 202 CO -0.09 -2.10 0.86 -1.54 0.00 0.00 0.00 175.76 172.90 1iny s SER 203 N -4.81 -0.57 -0.12 0.00 1.04 -0.62 -2.06 113.70 106.56 1iny s SER 203 Ca 0.71 0.91 -0.06 0.00 0.48 0.00 0.00 55.95 57.98 1iny s SER 203 Cb -0.05 0.86 -0.04 0.00 0.10 0.00 0.00 66.02 66.89 1iny s SER 203 CO 0.50 -0.32 0.11 0.00 0.98 0.00 0.00 173.24 174.51 1iny s ALA 204 N -0.31 3.75 -0.09 5.32 0.00 0.80 -2.51 121.76 128.71 1iny s ALA 204 Ca -0.02 -0.68 0.04 0.00 0.00 0.00 0.00 51.96 51.31 1iny s ALA 204 Cb -0.03 -1.88 0.00 0.00 0.00 0.00 0.00 23.12 21.21 1iny s ALA 204 CO 0.01 0.59 -0.23 0.54 0.00 0.00 0.00 175.76 176.67 1iny s VAL 205 N -0.93 1.98 -0.19 0.00 0.11 -0.95 -0.33 120.40 120.09 1iny s VAL 205 Ca 0.14 -0.98 -0.08 0.00 -2.93 0.00 0.00 61.98 58.13 1iny s VAL 205 Cb -0.12 -1.71 -0.04 0.00 -1.53 0.00 0.00 36.38 32.98 1iny s VAL 205 CO 0.03 0.54 0.09 -0.63 -3.33 0.00 0.00 175.10 171.81 1iny s ILE 206 N 0.32 5.07 0.12 7.04 1.09 0.20 -2.99 121.20 132.05 1iny s ILE 206 Ca -0.17 0.07 0.07 0.00 -1.10 0.00 0.00 60.65 59.52 1iny s ILE 206 Cb -0.17 -3.30 -0.04 0.00 -1.06 0.00 0.00 42.46 37.89 1iny s ILE 206 CO 0.08 0.46 -0.08 0.26 -0.10 0.00 0.00 174.94 175.55 1iny s TRP 207 N 0.32 2.74 -0.21 3.97 0.52 -0.47 -0.31 118.94 125.51 1iny s TRP 207 Ca 0.05 -0.16 -0.13 0.00 0.02 0.00 0.00 56.10 55.88 1iny s TRP 207 Cb -0.12 -1.41 0.06 0.00 -1.15 0.00 0.00 33.47 30.86 1iny s TRP 207 CO -0.01 0.45 0.52 -0.47 0.02 0.00 0.00 176.95 177.46 1iny s TYR 208 N -1.36 -0.74 -1.53 -1.98 5.04 0.08 -2.02 117.35 114.84 1iny s TYR 208 Ca 0.23 1.57 -0.04 0.00 -2.44 0.00 0.00 57.07 56.38 1iny s TYR 208 Cb -0.11 0.36 0.01 0.00 0.35 0.00 0.00 41.96 42.58 1iny s TYR 208 CO 0.15 -0.39 0.42 -1.71 -1.34 0.00 0.00 175.55 172.68 1iny n ASN 209 N 3.99 -5.59 -1.68 4.32 2.85 -1.12 -1.89 115.26 116.14 1iny n ASN 209 Ca -0.20 -0.21 -0.18 0.00 -0.11 0.00 0.00 54.58 53.88 1iny n ASN 209 Cb 0.57 -4.57 -0.05 0.00 1.24 0.00 0.00 39.78 36.97 1iny n ASN 209 CO 0.00 0.00 0.00 0.54 -2.11 0.00 0.00 177.26 175.69 1iny n ARG 210 N -3.69 -1.33 -4.52 1.20 1.74 -1.26 -5.02 116.66 103.78 1iny n ARG 210 Ca -0.13 1.01 -0.22 0.00 -0.77 0.00 0.00 57.85 57.75 1iny n ARG 210 Cb 0.62 -5.38 -0.14 0.00 -1.02 0.00 0.00 32.46 26.54 1iny n ARG 210 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 1iny s ARG 211 N -4.14 1.08 -0.44 5.56 0.52 -0.79 -5.10 118.95 115.63 1iny s ARG 211 Ca 0.00 -0.66 -0.29 0.00 -0.52 0.00 0.00 55.73 54.26 1iny s ARG 211 Cb 0.00 -1.08 0.01 0.00 0.52 0.00 0.00 34.95 34.41 1iny s ARG 211 CO 0.00 0.28 1.38 -1.25 0.02 0.00 0.00 175.30 175.73 1iny s PRO 212 N -0.78 3.55 -0.23 3.54 0.04 -1.26 -0.74 135.00 139.13 1iny s PRO 212 Ca 0.04 0.81 -0.16 0.00 0.04 0.00 0.00 61.00 61.73 1iny s PRO 212 Cb -0.07 -4.03 -0.12 0.00 0.04 0.00 0.00 34.50 30.33 1iny s PRO 212 CO 0.00 -1.60 -0.19 0.28 0.04 0.00 0.00 177.00 175.54 1iny n VAL 213 N 7.03 1.51 -4.38 -0.36 0.31 0.58 -4.96 118.33 118.06 1iny n VAL 213 Ca 0.15 -0.13 -0.27 0.00 -0.01 0.00 0.00 64.34 64.09 1iny n VAL 213 Cb 0.48 -2.06 -0.12 0.00 -0.91 0.00 0.00 33.84 31.23 1iny n VAL 213 CO 0.00 0.00 0.00 -0.89 -1.32 0.00 0.00 176.83 174.62 1iny s THR 214 N -2.51 2.17 0.03 2.52 2.01 -0.71 -4.95 115.64 114.20 1iny s THR 214 Ca -0.32 -1.87 0.04 0.00 0.31 0.00 0.00 61.69 59.85 1iny s THR 214 Cb 0.09 -1.98 -0.02 0.00 0.01 0.00 0.00 72.50 70.61 1iny s THR 214 CO 0.48 -0.07 -0.13 -1.61 -0.69 0.00 0.00 174.62 172.60 1iny s GLU 215 N -2.40 0.86 -0.08 4.92 8.01 -1.26 0.59 118.70 129.34 1iny s GLU 215 Ca 0.16 -0.69 -0.03 0.00 0.01 0.00 0.00 54.97 54.42 1iny s GLU 215 Cb -0.09 -0.84 0.05 0.00 -4.31 0.00 0.00 34.13 28.95 1iny s GLU 215 CO 0.07 0.21 0.16 0.42 0.01 0.00 0.00 175.26 176.13 1iny s ILE 216 N -0.80 -0.24 0.49 -1.63 1.01 0.56 -5.00 121.20 115.59 1iny s ILE 216 Ca 0.01 0.35 -0.06 0.00 0.00 0.00 0.00 60.65 60.94 1iny s ILE 216 Cb -0.07 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 42.07 1iny s ILE 216 CO 0.01 0.14 0.81 0.21 0.00 0.00 0.00 174.94 176.11 1iny s ASN 217 N 2.20 6.27 0.30 3.58 3.84 -1.26 -0.14 114.94 129.73 1iny s ASN 217 Ca 0.02 0.99 -0.29 0.00 0.21 0.00 0.00 52.86 53.79 1iny s ASN 217 Cb -0.12 -2.27 -0.13 0.00 -0.55 0.00 0.00 41.25 38.18 1iny s ASN 217 CO -0.06 -0.60 1.36 1.07 -2.79 0.00 0.00 177.10 176.08 1iny n THR 218 N -2.25 1.53 -0.12 -5.21 5.66 -0.87 -4.91 114.28 108.11 1iny n THR 218 Ca 0.01 -0.38 -0.19 0.00 -3.05 0.00 0.00 64.05 60.44 1iny n THR 218 Cb 0.55 -1.57 -0.12 0.00 -1.55 0.00 0.00 70.33 67.64 1iny n THR 218 CO 0.00 0.00 0.00 -2.67 -3.05 0.00 0.00 175.07 169.35 1iny n TRP 219 N 1.06 0.08 -0.48 1.09 2.14 -1.26 -4.60 117.44 115.48 1iny n TRP 219 Ca 0.08 0.02 0.08 0.00 2.07 0.00 0.00 57.50 59.74 1iny n TRP 219 Cb 0.34 -1.01 0.23 0.00 -0.81 0.00 0.00 31.31 30.07 1iny n TRP 219 CO 0.00 0.00 0.00 0.00 2.07 0.00 0.00 177.69 179.76 1iny n ALA 220 N -3.27 2.58 -4.26 -1.67 0.00 -1.26 -5.02 120.51 107.61 1iny n ALA 220 Ca -0.45 -1.53 -0.36 0.00 0.00 0.00 0.00 53.44 51.09 1iny n ALA 220 Cb 0.99 -0.66 -0.04 0.00 0.00 0.00 0.00 19.45 19.74 1iny n ALA 220 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1iny n ARG 221 N 0.47 -2.60 -3.28 0.00 1.74 -1.26 -4.67 116.66 107.06 1iny n ARG 221 Ca 0.18 0.32 -0.08 0.00 -0.77 0.00 0.00 57.85 57.50 1iny n ARG 221 Cb 0.65 -4.88 -0.04 0.00 -1.02 0.00 0.00 32.46 27.17 1iny n ARG 221 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 1iny s ASN 222 N -3.47 -0.11 -0.22 0.55 3.04 -1.25 -4.47 114.94 109.01 1iny s ASN 222 Ca 0.64 -0.93 -0.18 0.00 0.04 0.00 0.00 52.86 52.42 1iny s ASN 222 Cb -0.35 1.26 0.03 0.00 -1.54 0.00 0.00 41.25 40.64 1iny s ASN 222 CO 0.95 -0.25 0.31 -0.38 -3.04 0.00 0.00 177.10 174.69 1iny n ILE 223 N 4.62 -3.28 -2.25 -5.21 5.41 -1.21 -0.75 119.36 116.69 1iny n ILE 223 Ca 0.08 0.35 -0.42 0.00 1.00 0.00 0.00 62.75 63.77 1iny n ILE 223 Cb 0.51 -3.42 -0.03 0.00 -0.71 0.00 0.00 39.64 35.99 1iny n ILE 223 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 176.55 176.33 1iny s LEU 224 N -1.70 4.37 0.15 1.39 2.96 -1.26 -4.43 118.68 120.16 1iny s LEU 224 Ca 0.18 2.23 -0.02 0.00 -0.22 0.00 0.00 54.13 56.29 1iny s LEU 224 Cb -0.02 -3.58 -0.03 0.00 0.50 0.00 0.00 46.19 43.05 1iny s LEU 224 CO 0.43 -0.60 0.11 0.00 -1.32 0.00 0.00 176.35 174.97 1iny s ARG 225 N 1.13 1.04 0.00 1.98 1.70 -0.54 -4.96 118.95 119.30 1iny s ARG 225 Ca 0.63 -1.44 0.00 0.00 -0.47 0.00 0.00 55.73 54.44 1iny s ARG 225 Cb -0.34 0.27 0.00 0.00 -0.57 0.00 0.00 34.95 34.31 1iny s ARG 225 CO 0.30 -0.32 0.00 -2.37 -1.08 0.00 0.00 175.30 171.83 1iny n THR 226 N -0.16 0.00 -0.23 4.99 5.66 -1.26 -2.16 114.28 121.12 1iny n THR 226 Ca -0.04 0.00 0.02 0.00 -3.05 0.00 0.00 64.05 60.98 1iny n THR 226 Cb 0.64 0.00 0.14 0.00 -1.55 0.00 0.00 70.33 69.56 1iny n THR 226 CO 0.00 0.00 0.00 1.56 -3.05 0.00 0.00 175.07 173.58 1iny h GLN 227 N 0.00 0.49 -0.04 1.09 4.20 -1.72 -3.37 115.11 115.76 1iny h GLN 227 Ca 0.00 -0.03 -0.02 0.00 0.06 0.00 0.00 58.65 58.66 1iny h GLN 227 Cb 0.00 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.66 1iny h GLN 227 CO 0.00 0.32 -0.02 0.39 -0.67 0.00 0.00 178.83 178.86 1iny n GLU 228 N -4.94 -0.29 -3.93 1.46 4.71 -0.21 -3.97 120.64 113.48 1iny n GLU 228 Ca 0.11 0.23 -0.10 0.00 -0.01 0.00 0.00 57.16 57.39 1iny n GLU 228 Cb 0.31 -3.57 -0.02 0.00 -1.01 0.00 0.00 31.44 27.14 1iny n GLU 228 CO 0.00 0.00 0.00 -1.54 0.09 0.00 0.00 177.13 175.68 1iny s SER 229 N -2.27 0.11 0.54 1.62 1.04 -1.26 -4.70 113.70 108.78 1iny s SER 229 Ca 0.00 -1.04 -0.18 0.00 0.48 0.00 0.00 55.95 55.20 1iny s SER 229 Cb 0.00 0.71 -0.06 0.00 0.10 0.00 0.00 66.02 66.77 1iny s SER 229 CO 0.00 -1.39 1.07 -1.83 0.98 0.00 0.00 173.24 172.07 1iny s GLU 230 N -3.28 3.50 0.78 4.02 -1.05 -1.26 -4.20 118.70 117.21 1iny s GLU 230 Ca 0.20 1.38 -0.03 0.00 -0.15 0.00 0.00 54.97 56.36 1iny s GLU 230 Cb -0.03 -2.05 0.15 0.00 -0.44 0.00 0.00 34.13 31.76 1iny s GLU 230 CO 0.12 -0.69 1.07 0.00 0.95 0.00 0.00 175.26 176.71 1iny s VAL 232 N -3.30 0.83 0.17 0.00 1.01 -1.26 -4.78 120.40 113.06 1iny s VAL 232 Ca 0.69 -0.89 0.09 0.00 0.00 0.00 0.00 61.98 61.87 1iny s VAL 232 Cb -0.04 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 1iny s VAL 232 CO 0.46 -0.09 -0.19 0.00 0.00 0.00 0.00 175.10 175.29 1iny s HIS 234 N -2.04 0.17 -1.36 0.00 2.46 -0.06 -4.63 115.29 109.83 1iny s HIS 234 Ca 0.16 -0.27 -0.02 0.00 0.47 0.00 0.00 55.06 55.40 1iny s HIS 234 Cb -0.06 -0.67 0.01 0.00 -0.13 0.00 0.00 32.58 31.73 1iny s HIS 234 CO 0.07 -0.50 0.68 -1.71 -2.47 0.00 0.00 174.74 170.81 1iny n ASN 235 N 5.28 -1.48 0.00 9.88 5.15 0.94 -2.62 115.26 132.41 1iny n ASN 235 Ca -0.07 -0.85 0.00 0.00 -0.60 0.00 0.00 54.58 53.06 1iny n ASN 235 Cb 0.49 -3.82 0.00 0.00 -0.53 0.00 0.00 39.78 35.92 1iny n ASN 235 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1iny n GLY 236 N -1.67 3.17 3.72 8.20 0.00 -1.26 -4.99 105.19 112.37 1iny n GLY 236 Ca -0.25 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.40 1iny n GLY 236 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iny s VAL 237 N -2.16 5.27 -0.34 1.61 1.01 -1.08 -4.23 120.40 120.49 1iny s VAL 237 Ca 0.00 0.65 0.00 0.00 0.00 0.00 0.00 61.98 62.63 1iny s VAL 237 Cb 0.00 -3.68 0.11 0.00 0.00 0.00 0.00 36.38 32.81 1iny s VAL 237 CO 0.00 0.36 0.12 0.00 0.00 0.00 0.00 175.10 175.59 1iny s PRO 239 N 1.33 3.43 -0.01 0.00 0.02 -1.25 -3.43 135.00 135.09 1iny s PRO 239 Ca 0.12 1.69 -0.01 0.00 0.02 0.00 0.00 61.00 62.82 1iny s PRO 239 Cb -0.19 -2.12 0.00 0.00 0.02 0.00 0.00 34.50 32.22 1iny s PRO 239 CO -0.19 -0.80 0.02 0.08 -0.33 0.00 0.00 177.00 175.78 1iny s VAL 240 N -1.68 -0.01 -0.21 3.83 1.01 -0.03 -4.59 120.40 118.73 1iny s VAL 240 Ca 0.71 0.02 -0.08 0.00 0.00 0.00 0.00 61.98 62.63 1iny s VAL 240 Cb -0.26 -0.04 -0.04 0.00 0.00 0.00 0.00 36.38 36.04 1iny s VAL 240 CO 0.30 0.01 0.07 -0.69 0.00 0.00 0.00 175.10 174.79 1iny s VAL 241 N 0.10 4.63 0.27 2.92 1.01 -1.26 -1.23 120.40 126.85 1iny s VAL 241 Ca -0.01 -0.08 0.12 0.00 0.00 0.00 0.00 61.98 62.01 1iny s VAL 241 Cb -0.01 -3.12 -0.05 0.00 0.00 0.00 0.00 36.38 33.20 1iny s VAL 241 CO -0.00 0.40 -0.19 -0.36 0.00 0.00 0.00 175.10 174.95 1iny s PHE 242 N 0.92 2.32 0.01 5.22 0.40 -0.98 -3.85 117.98 122.02 1iny s PHE 242 Ca 0.04 -0.32 0.00 0.00 -0.60 0.00 0.00 56.93 56.05 1iny s PHE 242 Cb -0.14 -1.02 -0.01 0.00 0.51 0.00 0.00 43.02 42.37 1iny s PHE 242 CO 0.03 0.69 -0.01 0.99 0.70 0.00 0.00 175.22 177.62 1iny s THR 243 N -2.43 0.06 -0.22 0.64 2.01 -0.92 -1.92 115.64 112.87 1iny s THR 243 Ca 0.29 -0.32 -0.04 0.00 0.31 0.00 0.00 61.69 61.93 1iny s THR 243 Cb -0.05 -0.11 0.11 0.00 0.01 0.00 0.00 72.50 72.46 1iny s THR 243 CO 0.15 -0.17 0.37 -0.62 -0.69 0.00 0.00 174.62 173.66 1iny s ASP 244 N -0.51 0.18 0.00 3.53 -1.08 -1.03 -1.47 116.67 116.30 1iny s ASP 244 Ca -0.05 0.45 0.00 0.00 -0.52 0.00 0.00 52.55 52.42 1iny s ASP 244 Cb -0.04 1.10 0.00 0.00 -1.46 0.00 0.00 42.92 42.52 1iny s ASP 244 CO -0.00 -0.28 0.00 0.61 0.52 0.00 0.00 175.17 176.02 1iny n GLY 245 N 5.37 0.98 3.33 2.66 0.00 0.07 -2.06 105.19 115.53 1iny n GLY 245 Ca -0.05 -2.03 -0.39 0.00 0.00 0.00 0.00 46.02 43.54 1iny n GLY 245 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1iny n SER 246 N 2.32 -2.65 -0.00 1.61 2.88 -1.26 -4.84 113.62 111.68 1iny n SER 246 Ca 0.00 0.72 0.07 0.00 -1.33 0.00 0.00 58.87 58.33 1iny n SER 246 Cb 0.00 -0.96 -0.09 0.00 -0.75 0.00 0.00 64.21 62.41 1iny n SER 246 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1iny n ALA 247 N -1.43 3.65 -1.90 -1.46 0.00 -1.26 -4.34 120.51 113.77 1iny n ALA 247 Ca 0.10 -0.41 0.03 0.00 0.00 0.00 0.00 53.44 53.16 1iny n ALA 247 Cb 0.45 -0.54 0.14 0.00 0.00 0.00 0.00 19.45 19.51 1iny n ALA 247 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1iny n THR 248 N -1.51 1.65 -4.00 0.00 -2.24 -1.26 -3.86 114.28 103.06 1iny n THR 248 Ca 0.02 -2.74 0.03 0.00 -2.27 0.00 0.00 64.05 59.08 1iny n THR 248 Cb 0.27 0.05 0.01 0.00 -2.10 0.00 0.00 70.33 68.56 1iny n THR 248 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iny n GLY 249 N -0.66 0.23 3.60 3.38 0.00 -1.26 -4.98 105.19 105.50 1iny n GLY 249 Ca 0.17 -1.00 -0.49 0.00 0.00 0.00 0.00 46.02 44.70 1iny n GLY 249 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1iny n PRO 250 N -0.78 1.35 -1.16 1.61 -0.02 -1.26 -4.69 135.00 130.05 1iny n PRO 250 Ca 0.04 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1iny n PRO 250 Cb 0.48 -2.07 0.00 0.00 -0.02 0.00 0.00 33.50 31.89 1iny n PRO 250 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iny n ALA 251 N 2.07 0.00 -3.79 3.55 0.00 -1.26 -4.27 120.51 116.80 1iny n ALA 251 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 53.30 1iny n ALA 251 Cb 0.24 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.55 1iny n ALA 251 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1iny s GLU 252 N -0.74 1.23 0.22 0.00 2.02 -0.87 -4.98 118.70 115.57 1iny s GLU 252 Ca 0.00 -1.78 -0.10 0.00 0.02 0.00 0.00 54.97 53.11 1iny s GLU 252 Cb 0.00 -2.48 -0.07 0.00 0.10 0.00 0.00 34.13 31.68 1iny s GLU 252 CO 0.00 -1.07 0.54 0.99 0.02 0.00 0.00 175.26 175.74 1iny s THR 253 N 0.73 4.94 -0.14 3.63 2.01 -1.26 -2.45 115.64 123.10 1iny s THR 253 Ca 0.14 0.49 -0.15 0.00 0.31 0.00 0.00 61.69 62.48 1iny s THR 253 Cb -0.22 -3.63 0.04 0.00 0.01 0.00 0.00 72.50 68.70 1iny s THR 253 CO -0.08 -0.03 0.42 -0.13 -0.69 0.00 0.00 174.62 174.10 1iny s ARG 254 N -2.72 0.53 -0.25 4.92 0.52 -0.81 -2.77 118.95 118.39 1iny s ARG 254 Ca 0.46 0.49 -0.09 0.00 -0.52 0.00 0.00 55.73 56.07 1iny s ARG 254 Cb -0.12 0.26 -0.04 0.00 0.52 0.00 0.00 34.95 35.57 1iny s ARG 254 CO 0.21 -0.08 0.12 0.42 0.02 0.00 0.00 175.30 175.99 1iny s ILE 255 N -0.00 4.90 -0.01 1.52 1.09 0.32 -2.31 121.20 126.70 1iny s ILE 255 Ca -0.02 0.02 -0.01 0.00 -1.10 0.00 0.00 60.65 59.55 1iny s ILE 255 Cb -0.03 -3.29 -0.04 0.00 -1.06 0.00 0.00 42.46 38.04 1iny s ILE 255 CO 0.01 0.33 0.08 -0.31 -0.10 0.00 0.00 174.94 174.96 1iny s TYR 256 N 1.35 3.29 -0.24 3.97 1.51 -0.36 -1.33 117.35 125.54 1iny s TYR 256 Ca 0.06 0.22 0.01 0.00 -1.01 0.00 0.00 57.07 56.36 1iny s TYR 256 Cb -0.15 -1.75 0.04 0.00 -0.11 0.00 0.00 41.96 40.00 1iny s TYR 256 CO 0.06 0.55 -0.12 0.71 -1.11 0.00 0.00 175.55 175.64 1iny s TYR 257 N -1.17 3.11 0.12 2.71 2.02 -0.56 -0.85 117.35 122.74 1iny s TYR 257 Ca 0.22 -2.01 0.06 0.00 -0.37 0.00 0.00 57.07 54.97 1iny s TYR 257 Cb -0.12 -1.96 -0.04 0.00 -0.40 0.00 0.00 41.96 39.44 1iny s TYR 257 CO 0.13 -0.83 -0.02 -0.06 -1.57 0.00 0.00 175.55 173.19 1iny s PHE 258 N 1.19 2.88 -0.24 2.71 0.40 -1.22 -0.10 117.98 123.60 1iny s PHE 258 Ca -0.04 -0.09 -0.03 0.00 -0.60 0.00 0.00 56.93 56.17 1iny s PHE 258 Cb -0.18 -1.46 0.11 0.00 0.51 0.00 0.00 43.02 42.00 1iny s PHE 258 CO -0.07 0.48 0.23 0.21 0.70 0.00 0.00 175.22 176.78 1iny s LYS 259 N -2.50 0.23 -1.28 0.44 2.47 -0.80 -1.51 119.74 116.80 1iny s LYS 259 Ca 0.25 -0.01 -0.06 0.00 -1.56 0.00 0.00 55.97 54.59 1iny s LYS 259 Cb -0.11 -1.02 0.01 0.00 -1.46 0.00 0.00 37.83 35.25 1iny s LYS 259 CO 0.17 -0.83 0.82 0.39 0.16 0.00 0.00 175.35 176.07 1iny n GLU 260 N 5.31 -5.86 -0.30 4.03 1.02 -1.26 -2.43 120.64 121.15 1iny n GLU 260 Ca -0.04 0.76 0.00 0.00 -0.02 0.00 0.00 57.16 57.86 1iny n GLU 260 Cb 0.47 -5.47 0.00 0.00 -0.02 0.00 0.00 31.44 26.43 1iny n GLU 260 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iny n GLY 261 N -1.66 2.27 3.86 0.62 0.00 -1.26 -5.00 105.19 104.02 1iny n GLY 261 Ca -0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 1iny n GLY 261 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iny s LYS 262 N -0.05 3.62 -0.17 1.61 -0.14 -1.02 -4.25 119.74 119.35 1iny s LYS 262 Ca 0.00 0.08 -0.29 0.00 -1.36 0.00 0.00 55.97 54.40 1iny s LYS 262 Cb 0.00 -3.20 -0.02 0.00 -1.68 0.00 0.00 37.83 32.93 1iny s LYS 262 CO 0.00 0.74 1.37 0.42 -0.76 0.00 0.00 175.35 177.12 1iny s ILE 263 N -1.05 4.09 -0.05 2.17 1.01 -1.26 -1.90 121.20 124.20 1iny s ILE 263 Ca 0.19 1.29 -0.13 0.00 0.00 0.00 0.00 60.65 62.00 1iny s ILE 263 Cb -0.14 -3.90 -0.30 0.00 0.01 0.00 0.00 42.46 38.13 1iny s ILE 263 CO 0.08 -0.19 0.67 -0.07 0.00 0.00 0.00 174.94 175.43 1iny h LEU 264 N 10.17 0.59 -7.51 2.97 3.38 -0.86 -3.48 115.31 120.56 1iny h LEU 264 Ca -0.29 -0.92 0.29 0.00 0.09 0.00 0.00 57.88 57.05 1iny h LEU 264 Cb 1.12 -0.19 -0.09 0.00 0.09 0.00 0.00 40.66 41.58 1iny h LEU 264 CO 0.98 1.75 0.77 -0.75 0.09 0.00 0.00 178.44 181.28 1iny s LYS 265 N -2.56 0.60 -0.11 1.13 2.20 -1.19 -5.03 119.74 114.79 1iny s LYS 265 Ca -0.16 -0.35 -0.30 0.00 -0.36 0.00 0.00 55.97 54.80 1iny s LYS 265 Cb 0.05 0.19 0.07 0.00 -1.51 0.00 0.00 37.83 36.63 1iny s LYS 265 CO 0.84 -0.28 0.71 1.67 -0.36 0.00 0.00 175.35 177.93 1iny s TRP 266 N -2.43 -0.67 0.01 4.03 1.48 -1.26 -1.49 118.94 118.60 1iny s TRP 266 Ca 0.18 1.28 -0.12 0.00 -1.06 0.00 0.00 56.10 56.37 1iny s TRP 266 Cb 0.02 0.38 0.01 0.00 -1.16 0.00 0.00 33.47 32.73 1iny s TRP 266 CO -0.01 -0.54 0.25 -1.83 -4.06 0.00 0.00 176.95 170.75 1iny s GLU 267 N -0.83 0.65 0.84 3.25 -1.05 -0.45 -4.98 118.70 116.14 1iny s GLU 267 Ca -0.08 -0.35 -0.11 0.00 -0.15 0.00 0.00 54.97 54.27 1iny s GLU 267 Cb -0.01 0.28 0.10 0.00 -0.44 0.00 0.00 34.13 34.06 1iny s GLU 267 CO 0.07 -0.18 1.09 -1.25 0.95 0.00 0.00 175.26 175.95 1iny s PRO 268 N -1.71 1.69 0.58 -4.83 0.04 -1.26 -0.52 135.00 128.99 1iny s PRO 268 Ca -0.11 0.75 -0.20 0.00 0.04 0.00 0.00 61.00 61.47 1iny s PRO 268 Cb -0.05 -1.86 -0.04 0.00 0.04 0.00 0.00 34.50 32.59 1iny s PRO 268 CO 0.01 -1.92 1.32 -1.17 0.04 0.00 0.00 177.00 175.28 1iny s LEU 269 N -6.00 3.76 0.21 -3.56 0.20 -1.11 -4.75 118.68 107.43 1iny s LEU 269 Ca 0.62 2.68 0.00 0.00 0.69 0.00 0.00 54.13 58.12 1iny s LEU 269 Cb -0.16 -4.40 -0.04 0.00 -0.43 0.00 0.00 46.19 41.15 1iny s LEU 269 CO 0.56 -1.68 0.10 0.00 -0.29 0.00 0.00 176.35 175.03 1iny s ALA 270 N -1.36 1.34 0.00 5.97 0.00 -1.26 -5.08 121.76 121.37 1iny s ALA 270 Ca 0.75 -1.72 0.00 0.00 0.00 0.00 0.00 51.96 51.00 1iny s ALA 270 Cb -0.38 1.11 0.00 0.00 0.00 0.00 0.00 23.12 23.85 1iny s ALA 270 CO 0.44 -0.50 0.00 0.41 0.00 0.00 0.00 175.76 176.10 1iny n GLY 271 N -0.31 -1.78 1.22 0.00 0.00 -1.26 -3.18 105.19 99.87 1iny n GLY 271 Ca -0.01 -1.92 0.11 0.00 0.00 0.00 0.00 46.02 44.21 1iny n GLY 271 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1iny n THR 272 N 0.00 0.82 -2.61 2.61 -2.24 -1.18 -4.88 114.28 106.80 1iny n THR 272 Ca 0.00 -0.86 -0.42 0.00 -2.27 0.00 0.00 64.05 60.50 1iny n THR 272 Cb 0.00 0.54 -0.03 0.00 -2.10 0.00 0.00 70.33 68.74 1iny n THR 272 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1iny s ALA 273 N -1.18 3.27 -0.15 6.98 0.00 -1.26 -4.70 121.76 124.72 1iny s ALA 273 Ca 0.44 0.62 0.17 0.00 0.00 0.00 0.00 51.96 53.19 1iny s ALA 273 Cb 0.23 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.92 1iny s ALA 273 CO 0.31 -0.36 1.08 0.87 0.00 0.00 0.00 175.76 177.66 1iny h LYS 274 N 6.87 0.00 -2.93 0.00 1.57 -1.94 -3.47 116.57 116.67 1iny h LYS 274 Ca -0.40 0.00 -0.17 0.00 -1.87 0.00 0.00 60.65 58.21 1iny h LYS 274 Cb 1.21 0.00 -0.28 0.00 0.08 0.00 0.00 32.23 33.23 1iny h LYS 274 CO 0.79 0.33 -0.42 -1.58 -0.57 0.00 0.00 179.45 177.99 1iny s HIS 275 N -2.99 -0.39 -0.02 -1.35 2.46 -1.26 -4.78 115.29 106.96 1iny s HIS 275 Ca -0.00 0.91 0.08 0.00 0.47 0.00 0.00 55.06 56.51 1iny s HIS 275 Cb 0.08 0.11 -0.02 0.00 -0.13 0.00 0.00 32.58 32.62 1iny s HIS 275 CO 0.78 -0.25 -0.24 0.42 -2.47 0.00 0.00 174.74 172.98 1iny s ILE 276 N 1.13 1.93 -0.21 0.89 -1.09 -1.26 -4.07 121.20 118.51 1iny s ILE 276 Ca -0.08 -1.04 -0.27 0.00 -2.23 0.00 0.00 60.65 57.03 1iny s ILE 276 Cb -0.09 -1.60 0.09 0.00 -1.58 0.00 0.00 42.46 39.29 1iny s ILE 276 CO -0.08 0.55 0.84 -1.61 -1.23 0.00 0.00 174.94 173.41 1iny s GLU 277 N -0.57 0.75 -0.97 2.79 2.02 -0.33 -4.89 118.70 117.50 1iny s GLU 277 Ca 0.09 0.59 -0.13 0.00 0.02 0.00 0.00 54.97 55.55 1iny s GLU 277 Cb -0.09 0.36 0.01 0.00 0.10 0.00 0.00 34.13 34.51 1iny s GLU 277 CO -0.01 -0.15 0.66 0.39 0.02 0.00 0.00 175.26 176.17 1iny n GLU 278 N 1.87 -1.11 -2.34 1.61 1.02 -1.26 -0.39 120.64 120.04 1iny n GLU 278 Ca -0.14 0.59 -0.40 0.00 -0.02 0.00 0.00 57.16 57.19 1iny n GLU 278 Cb 0.56 -2.86 -0.03 0.00 -0.02 0.00 0.00 31.44 29.09 1iny n GLU 278 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1iny s SER 280 N -0.85 3.64 0.16 0.00 0.01 -0.74 -4.64 113.70 111.27 1iny s SER 280 Ca 0.49 -0.53 0.10 0.00 1.31 0.00 0.00 55.95 57.31 1iny s SER 280 Cb -0.33 -1.59 -0.04 0.00 0.21 0.00 0.00 66.02 64.27 1iny s SER 280 CO 0.43 -0.00 -0.22 0.00 0.41 0.00 0.00 173.24 173.86 1iny s TYR 282 N -1.68 0.38 -0.02 0.00 -0.85 -0.84 -4.61 117.35 109.74 1iny s TYR 282 Ca 0.16 -0.74 -0.18 0.00 -0.52 0.00 0.00 57.07 55.79 1iny s TYR 282 Cb -0.08 0.17 0.03 0.00 0.38 0.00 0.00 41.96 42.46 1iny s TYR 282 CO 0.07 -0.98 0.38 0.20 -1.52 0.00 0.00 175.55 173.71 1iny s GLY 283 N -3.02 -0.24 -0.28 5.49 0.00 -1.26 -2.09 107.32 105.92 1iny s GLY 283 Ca 0.23 0.51 -0.23 0.00 0.00 0.00 0.00 44.72 45.23 1iny s GLY 283 CO 0.09 0.27 0.87 -1.83 0.00 0.00 0.00 173.10 172.50 1iny s GLU 284 N -1.37 0.64 -1.31 2.90 4.04 -1.11 -5.00 118.70 117.48 1iny s GLU 284 Ca -0.13 0.83 -0.02 0.00 0.04 0.00 0.00 54.97 55.69 1iny s GLU 284 Cb -0.04 0.27 0.01 0.00 0.02 0.00 0.00 34.13 34.39 1iny s GLU 284 CO 0.05 -0.09 0.85 0.54 -1.84 0.00 0.00 175.26 174.77 1iny n ARG 285 N 2.83 -5.67 -2.18 -4.83 1.74 -0.63 -3.08 116.66 104.84 1iny n ARG 285 Ca -0.15 0.69 -0.17 0.00 -0.77 0.00 0.00 57.85 57.45 1iny n ARG 285 Cb 0.56 -5.45 -0.02 0.00 -1.02 0.00 0.00 32.46 26.53 1iny n ARG 285 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1iny n ALA 286 N -4.35 -0.47 -2.89 7.54 0.00 -0.42 -5.02 120.51 114.91 1iny n ALA 286 Ca -0.23 0.17 -0.12 0.00 0.00 0.00 0.00 53.44 53.26 1iny n ALA 286 Cb 0.65 -1.89 -0.12 0.00 0.00 0.00 0.00 19.45 18.09 1iny n ALA 286 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1iny s GLU 287 N -4.61 0.37 -0.13 0.00 2.12 -1.18 -4.20 118.70 111.08 1iny s GLU 287 Ca 0.00 -0.52 0.03 0.00 0.36 0.00 0.00 54.97 54.83 1iny s GLU 287 Cb 0.00 -0.14 0.01 0.00 0.26 0.00 0.00 34.13 34.26 1iny s GLU 287 CO 0.00 0.02 -0.21 0.42 -0.54 0.00 0.00 175.26 174.95 1iny s ILE 288 N -1.04 1.91 -0.13 -3.70 1.01 -0.21 -2.77 121.20 116.28 1iny s ILE 288 Ca -0.09 -0.90 0.01 0.00 0.00 0.00 0.00 60.65 59.67 1iny s ILE 288 Cb -0.08 -1.70 -0.01 0.00 0.01 0.00 0.00 42.46 40.69 1iny s ILE 288 CO -0.00 0.52 -0.15 -0.89 0.00 0.00 0.00 174.94 174.42 1iny s THR 289 N 0.78 2.86 -0.10 2.92 2.01 -0.89 0.14 115.64 123.37 1iny s THR 289 Ca -0.09 -0.73 0.02 0.00 0.31 0.00 0.00 61.69 61.20 1iny s THR 289 Cb -0.16 -2.19 0.01 0.00 0.01 0.00 0.00 72.50 70.18 1iny s THR 289 CO -0.00 0.53 -0.15 0.00 -0.69 0.00 0.00 174.62 174.31 1iny s THR 291 N 0.95 5.06 0.00 0.00 2.01 -0.65 -0.70 115.64 122.31 1iny s THR 291 Ca -0.07 0.07 0.00 0.00 0.31 0.00 0.00 61.69 61.99 1iny s THR 291 Cb -0.15 -3.32 0.00 0.00 0.01 0.00 0.00 72.50 69.04 1iny s THR 291 CO -0.01 0.41 0.00 0.00 -0.69 0.00 0.00 174.62 174.33 1iny s ARG 293 N 1.38 1.61 -0.48 0.00 3.52 0.48 -4.14 118.95 121.33 1iny s ARG 293 Ca 0.00 -0.37 -0.13 0.00 -0.13 0.00 0.00 55.73 55.10 1iny s ARG 293 Cb 0.00 -1.38 0.10 0.00 -1.56 0.00 0.00 34.95 32.11 1iny s ARG 293 CO 0.00 -0.01 0.38 0.34 -0.81 0.00 0.00 175.30 175.20 1iny s ASP 294 N 0.80 5.96 0.20 -2.12 -1.08 -1.26 -1.19 116.67 117.97 1iny s ASP 294 Ca -0.12 -1.59 0.25 0.00 -0.52 0.00 0.00 52.55 50.57 1iny s ASP 294 Cb -0.15 -2.11 0.55 0.00 -1.46 0.00 0.00 42.92 39.74 1iny s ASP 294 CO 0.02 -0.68 1.55 -1.13 0.52 0.00 0.00 175.17 175.45 1iny h ASN 295 N 8.65 0.00 0.25 -0.34 -0.73 -1.84 -3.39 115.58 118.18 1iny h ASN 295 Ca -0.26 -0.08 -0.01 0.00 1.87 0.00 0.00 56.30 57.81 1iny h ASN 295 Cb 1.09 0.00 0.00 0.00 0.27 0.00 0.00 38.32 39.69 1iny h ASN 295 CO 0.89 0.04 -0.12 -0.25 -0.37 0.00 0.00 177.43 177.62 1iny h TRP 296 N 0.00 -0.31 -2.23 0.67 7.01 -1.88 -2.25 115.95 116.96 1iny h TRP 296 Ca 0.00 -0.01 -0.07 0.00 2.11 0.00 0.00 58.89 60.93 1iny h TRP 296 Cb 0.78 0.10 -0.21 0.00 -2.10 0.00 0.00 29.16 27.73 1iny h TRP 296 CO 0.00 -0.19 0.04 1.14 -2.79 0.00 0.00 178.44 176.63 1iny s GLN 297 N -2.78 0.79 0.00 2.65 -2.07 -1.26 -2.30 119.66 114.69 1iny s GLN 297 Ca -0.05 0.69 0.00 0.00 -1.82 0.00 0.00 55.36 54.19 1iny s GLN 297 Cb 0.00 0.38 0.00 0.00 -1.09 0.00 0.00 33.01 32.31 1iny s GLN 297 CO 0.15 -0.14 0.00 0.41 -1.32 0.00 0.00 175.29 174.39 1iny n GLY 298 N 2.31 2.54 0.04 2.60 0.00 -1.21 -4.80 105.19 106.67 1iny n GLY 298 Ca -0.15 -0.80 0.12 0.00 0.00 0.00 0.00 46.02 45.19 1iny n GLY 298 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1iny n SER 299 N 0.00 0.58 -4.92 1.61 7.64 -0.51 -4.73 113.62 113.29 1iny n SER 299 Ca 0.00 0.11 -0.26 0.00 1.01 0.00 0.00 58.87 59.72 1iny n SER 299 Cb 0.00 0.02 0.01 0.00 -1.01 0.00 0.00 64.21 63.23 1iny n SER 299 CO 0.00 0.00 0.00 0.54 -3.01 0.00 0.00 175.04 172.57 1iny s ASN 300 N -3.80 5.92 -0.05 6.43 4.22 -1.26 -2.30 114.94 124.10 1iny s ASN 300 Ca 0.09 0.74 -0.01 0.00 -2.14 0.00 0.00 52.86 51.54 1iny s ASN 300 Cb 0.15 -1.92 -0.04 0.00 1.28 0.00 0.00 41.25 40.73 1iny s ASN 300 CO 0.68 -0.80 0.02 -0.13 -2.04 0.00 0.00 177.10 174.84 1iny s ARG 301 N -4.82 2.97 0.58 3.55 0.52 -1.26 -4.81 118.95 115.69 1iny s ARG 301 Ca 0.50 -0.46 -0.17 0.00 -0.52 0.00 0.00 55.73 55.08 1iny s ARG 301 Cb -0.10 -2.80 -0.04 0.00 0.52 0.00 0.00 34.95 32.53 1iny s ARG 301 CO 0.44 0.68 1.09 -2.14 0.02 0.00 0.00 175.30 175.39 1iny s PRO 302 N -1.22 3.24 0.01 3.54 0.02 -1.26 -1.56 135.00 137.78 1iny s PRO 302 Ca 0.17 1.39 0.02 0.00 0.02 0.00 0.00 61.00 62.59 1iny s PRO 302 Cb -0.12 -2.01 -0.01 0.00 0.02 0.00 0.00 34.50 32.38 1iny s PRO 302 CO 0.06 -0.89 -0.06 0.08 -0.33 0.00 0.00 177.00 175.86 1iny s VAL 303 N -2.17 0.47 -0.11 3.83 1.01 0.56 -1.41 120.40 122.58 1iny s VAL 303 Ca 0.67 -0.47 -0.01 0.00 0.00 0.00 0.00 61.98 62.17 1iny s VAL 303 Cb -0.19 -0.44 0.03 0.00 0.00 0.00 0.00 36.38 35.78 1iny s VAL 303 CO 0.33 -0.02 -0.03 -0.63 0.00 0.00 0.00 175.10 174.75 1iny s ILE 304 N -0.48 0.71 -0.20 2.22 1.01 0.12 -1.85 121.20 122.74 1iny s ILE 304 Ca -0.01 -0.16 -0.08 0.00 0.00 0.00 0.00 60.65 60.40 1iny s ILE 304 Cb -0.04 -0.84 -0.04 0.00 0.01 0.00 0.00 42.46 41.54 1iny s ILE 304 CO -0.00 0.26 0.07 -0.13 0.00 0.00 0.00 174.94 175.14 1iny s ARG 305 N 1.83 3.90 0.05 2.79 1.81 -0.96 -0.96 118.95 127.42 1iny s ARG 305 Ca 0.04 -0.37 0.07 0.00 -1.72 0.00 0.00 55.73 53.75 1iny s ARG 305 Cb -0.13 -3.26 -0.03 0.00 -0.45 0.00 0.00 34.95 31.08 1iny s ARG 305 CO -0.07 0.15 -0.18 0.42 -0.68 0.00 0.00 175.30 174.94 1iny s ILE 306 N 0.72 2.80 -0.43 1.52 1.01 0.12 -2.80 121.20 124.15 1iny s ILE 306 Ca 0.04 -1.24 -0.06 0.00 0.00 0.00 0.00 60.65 59.39 1iny s ILE 306 Cb -0.13 -2.20 0.11 0.00 0.01 0.00 0.00 42.46 40.25 1iny s ILE 306 CO 0.02 0.30 0.25 -0.62 0.00 0.00 0.00 174.94 174.89 1iny s ASP 307 N -1.56 5.45 0.59 3.58 2.15 -0.61 -1.04 116.67 125.23 1iny s ASP 307 Ca 0.15 -1.88 0.32 0.00 0.43 0.00 0.00 52.55 51.57 1iny s ASP 307 Cb -0.10 -1.91 1.85 0.00 -0.30 0.00 0.00 42.92 42.46 1iny s ASP 307 CO 0.06 -0.58 2.24 1.55 -0.17 0.00 0.00 175.17 178.27 1iny h PRO 308 N 8.24 0.00 0.07 4.34 0.13 -1.87 0.11 132.00 143.02 1iny h PRO 308 Ca -0.18 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.79 1iny h PRO 308 Cb 1.06 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.19 1iny h PRO 308 CO 0.76 0.02 -0.80 0.28 -0.23 0.00 0.00 178.00 178.03 1iny h VAL 309 N 0.00 1.38 0.00 1.56 2.07 -1.93 -3.35 116.25 115.99 1iny h VAL 309 Ca -0.00 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 65.13 1iny h VAL 309 Cb 0.06 2.99 0.00 0.00 -1.52 0.00 0.00 31.29 32.82 1iny h VAL 309 CO 0.00 0.62 -0.22 0.00 0.02 0.00 0.00 177.57 177.99 1iny n ALA 310 N -2.84 2.53 -2.94 1.67 0.00 -1.18 -4.97 120.51 112.77 1iny n ALA 310 Ca -0.18 -0.11 -0.12 0.00 0.00 0.00 0.00 53.44 53.03 1iny n ALA 310 Cb 0.72 -1.36 0.06 0.00 0.00 0.00 0.00 19.45 18.87 1iny n ALA 310 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1iny n MET 311 N -2.16 -3.00 -4.20 0.00 0.00 0.36 -5.05 117.12 103.07 1iny n MET 311 Ca 0.05 0.66 -0.13 0.00 0.00 0.00 0.00 57.70 58.28 1iny n MET 311 Cb 0.43 -4.94 -0.09 0.00 0.00 0.00 0.00 33.22 28.62 1iny n MET 311 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 175.97 176.92 1iny s THR 312 N -3.29 0.00 0.27 2.03 -4.23 -1.19 -5.01 115.64 104.22 1iny s THR 312 Ca 0.22 -1.95 -0.20 0.00 -1.18 0.00 0.00 61.69 58.59 1iny s THR 312 Cb -0.03 -2.49 0.06 0.00 1.34 0.00 0.00 72.50 71.39 1iny s THR 312 CO 0.57 0.00 0.90 -1.38 -0.54 0.00 0.00 174.62 174.17 1iny s HIS 313 N -3.96 0.04 0.18 3.99 -0.00 -1.26 -1.58 115.29 112.70 1iny s HIS 313 Ca 0.38 -0.55 -0.16 0.00 -0.00 0.00 0.00 55.06 54.73 1iny s HIS 313 Cb 0.05 0.75 0.03 0.00 -0.00 0.00 0.00 32.58 33.41 1iny s HIS 313 CO 0.15 -1.20 0.48 0.95 -0.00 0.00 0.00 174.74 175.12 1iny s THR 314 N -2.53 0.04 0.15 -5.38 -4.23 -1.12 -4.87 115.64 97.69 1iny s THR 314 Ca 0.17 -0.80 -0.02 0.00 -1.18 0.00 0.00 61.69 59.86 1iny s THR 314 Cb -0.04 -1.53 -0.04 0.00 1.34 0.00 0.00 72.50 72.23 1iny s THR 314 CO 0.08 -0.16 0.09 -0.94 -0.54 0.00 0.00 174.62 173.14 1iny s SER 315 N -2.87 0.26 0.00 3.99 1.04 -1.19 -2.26 113.70 112.66 1iny s SER 315 Ca 0.09 -1.22 0.00 0.00 0.48 0.00 0.00 55.95 55.30 1iny s SER 315 Cb -0.00 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.44 1iny s SER 315 CO -0.04 -0.76 0.00 0.00 0.98 0.00 0.00 173.24 173.42 1iny n GLN 316 N -0.14 0.00 -4.42 4.02 10.64 -0.77 -3.13 117.38 123.58 1iny n GLN 316 Ca -0.04 0.00 -0.24 0.00 -1.83 0.00 0.00 57.00 54.89 1iny n GLN 316 Cb 0.64 0.00 -0.09 0.00 -0.86 0.00 0.00 30.24 29.93 1iny n GLN 316 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1iny s TYR 317 N -2.17 2.44 -0.27 2.61 2.02 0.07 -0.32 117.35 121.73 1iny s TYR 317 Ca 0.00 -0.36 -0.29 0.00 -0.37 0.00 0.00 57.07 56.05 1iny s TYR 317 Cb 0.00 -1.20 0.01 0.00 -0.40 0.00 0.00 41.96 40.37 1iny s TYR 317 CO 0.00 0.63 1.07 0.42 -1.57 0.00 0.00 175.55 176.09 1iny s ILE 318 N -2.49 4.58 0.14 2.71 1.01 -0.60 -4.74 121.20 121.81 1iny s ILE 318 Ca 0.32 1.87 -0.18 0.00 0.00 0.00 0.00 60.65 62.66 1iny s ILE 318 Cb -0.03 -4.35 0.00 0.00 0.01 0.00 0.00 42.46 38.09 1iny s ILE 318 CO 0.17 -0.33 1.72 0.00 0.00 0.00 0.00 174.94 176.51 1iny n SER 320 N -5.11 -1.93 -0.06 0.00 2.88 -0.04 -2.80 113.62 106.56 1iny n SER 320 Ca -0.00 0.63 0.14 0.00 -1.33 0.00 0.00 58.87 58.31 1iny n SER 320 Cb 0.14 -0.65 0.64 0.00 -0.75 0.00 0.00 64.21 63.58 1iny n SER 320 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1iny n PRO 321 N 0.94 0.51 -2.60 -1.46 -0.04 -1.26 -4.61 135.00 126.48 1iny n PRO 321 Ca 0.09 -0.13 -0.41 0.00 -0.04 0.00 0.00 63.50 63.01 1iny n PRO 321 Cb 0.28 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.21 1iny n PRO 321 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1iny s VAL 322 N -2.58 3.94 0.41 0.52 1.01 -1.26 -3.87 120.40 118.57 1iny s VAL 322 Ca 0.26 -0.46 -0.25 0.00 0.00 0.00 0.00 61.98 61.53 1iny s VAL 322 Cb 0.20 -4.98 -0.08 0.00 0.00 0.00 0.00 36.38 31.51 1iny s VAL 322 CO 0.49 -1.86 1.19 -0.76 0.00 0.00 0.00 175.10 174.16 1iny s LEU 323 N 4.99 4.18 0.00 3.92 1.43 -1.26 -5.01 118.68 126.92 1iny s LEU 323 Ca 0.41 2.39 0.00 0.00 -1.03 0.00 0.00 54.13 55.90 1iny s LEU 323 Cb -0.03 -4.03 0.00 0.00 0.03 0.00 0.00 46.19 42.16 1iny s LEU 323 CO -0.02 -0.74 0.66 0.35 0.23 0.00 0.00 176.35 176.84 1iny n THR 324 N 0.02 0.41 -2.45 5.49 -2.24 -1.14 -5.03 114.28 109.33 1iny n THR 324 Ca 0.05 -0.46 -0.24 0.00 -2.27 0.00 0.00 64.05 61.13 1iny n THR 324 Cb 0.46 0.88 0.10 0.00 -2.10 0.00 0.00 70.33 69.68 1iny n THR 324 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1iny s ASP 325 N -0.41 4.39 -0.16 3.42 -1.08 -0.97 -4.74 116.67 117.12 1iny s ASP 325 Ca 0.00 -0.12 -0.08 0.00 -0.52 0.00 0.00 52.55 51.83 1iny s ASP 325 Cb 0.00 -0.33 0.06 0.00 -1.46 0.00 0.00 42.92 41.19 1iny s ASP 325 CO 0.00 -1.83 0.37 0.21 0.52 0.00 0.00 175.17 174.44 1iny s ASN 326 N -4.68 -0.37 0.90 -0.34 3.84 -1.26 -4.22 114.94 108.80 1iny s ASN 326 Ca 0.65 0.82 -0.12 0.00 0.21 0.00 0.00 52.86 54.42 1iny s ASN 326 Cb -0.07 0.79 0.13 0.00 -0.55 0.00 0.00 41.25 41.55 1iny s ASN 326 CO 0.45 -0.20 1.13 -2.16 -2.79 0.00 0.00 177.10 173.53 1iny s PRO 327 N 1.63 1.24 0.16 0.43 0.04 -1.26 -3.12 135.00 134.12 1iny s PRO 327 Ca -0.08 0.36 -0.23 0.00 0.04 0.00 0.00 61.00 61.09 1iny s PRO 327 Cb -0.10 -1.85 0.06 0.00 0.04 0.00 0.00 34.50 32.66 1iny s PRO 327 CO -0.12 -2.14 0.69 -0.98 0.04 0.00 0.00 177.00 174.49 1iny s ARG 328 N -5.24 1.33 0.00 4.56 1.70 0.19 -4.85 118.95 116.63 1iny s ARG 328 Ca 0.63 -0.58 0.00 0.00 -0.47 0.00 0.00 55.73 55.32 1iny s ARG 328 Cb -0.15 0.55 0.00 0.00 -0.57 0.00 0.00 34.95 34.78 1iny s ARG 328 CO 0.54 -0.59 0.00 -0.35 -1.08 0.00 0.00 175.30 173.82 1iny n PRO 329 N -0.39 0.58 -2.71 3.89 -0.04 -1.26 -4.60 135.00 130.48 1iny n PRO 329 Ca -0.12 0.00 -0.27 0.00 -0.04 0.00 0.00 63.50 63.07 1iny n PRO 329 Cb 0.63 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 34.09 1iny n PRO 329 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 1iny s ASN 330 N -1.00 6.28 0.19 3.54 0.01 -1.26 -5.00 114.94 117.70 1iny s ASN 330 Ca 0.00 0.90 -0.31 0.00 -0.71 0.00 0.00 52.86 52.74 1iny s ASN 330 Cb 0.00 -2.23 -0.09 0.00 0.41 0.00 0.00 41.25 39.33 1iny s ASN 330 CO 0.00 -0.54 1.43 -1.81 -1.51 0.00 0.00 177.10 174.67 1iny s ASP 331 N -4.05 6.73 0.13 -1.22 1.01 -1.26 -4.99 116.67 113.02 1iny s ASP 331 Ca 0.47 2.53 0.01 0.00 0.71 0.00 0.00 52.55 56.26 1iny s ASP 331 Cb -0.10 -2.61 0.01 0.00 1.01 0.00 0.00 42.92 41.23 1iny s ASP 331 CO 0.43 -0.68 0.07 -0.81 0.21 0.00 0.00 175.17 174.39 1iny n PRO 332 N 3.10 0.87 0.03 8.23 -0.04 -1.25 -5.06 135.00 140.88 1iny n PRO 332 Ca 0.09 -0.25 -0.15 0.00 -0.04 0.00 0.00 63.50 63.16 1iny n PRO 332 Cb 0.41 -0.03 -0.14 0.00 -0.04 0.00 0.00 33.50 33.70 1iny n PRO 332 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 1iny h THR 333 N -0.09 0.99 -3.58 0.52 2.02 -1.96 -3.46 112.91 107.36 1iny h THR 333 Ca -0.02 -2.71 -0.44 0.00 0.77 0.00 0.00 66.41 64.00 1iny h THR 333 Cb 0.10 2.61 -0.19 0.00 -1.74 0.00 0.00 68.15 68.94 1iny h THR 333 CO 0.03 0.74 -0.77 0.68 0.37 0.00 0.00 175.52 176.58 1iny s VAL 334 N -2.61 1.43 0.20 3.16 -7.23 -1.26 -4.66 120.40 109.43 1iny s VAL 334 Ca -0.10 -1.71 0.00 0.00 -1.81 0.00 0.00 61.98 58.36 1iny s VAL 334 Cb 0.07 -1.56 0.00 0.00 0.56 0.00 0.00 36.38 35.46 1iny s VAL 334 CO 0.83 -0.36 0.01 0.61 -0.31 0.00 0.00 175.10 175.88 1iny n GLY 335 N 0.58 3.87 3.30 2.32 0.00 0.30 -4.77 105.19 110.79 1iny n GLY 335 Ca -0.16 -2.27 -0.32 0.00 0.00 0.00 0.00 46.02 43.27 1iny n GLY 335 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iny s LYS 336 N -2.73 3.23 -0.06 1.61 1.02 -1.12 -4.89 119.74 116.81 1iny s LYS 336 Ca 0.01 -0.78 -0.12 0.00 0.02 0.00 0.00 55.97 55.11 1iny s LYS 336 Cb -0.00 -2.48 -0.30 0.00 -0.52 0.00 0.00 37.83 34.53 1iny s LYS 336 CO 0.01 0.20 0.65 0.00 -0.92 0.00 0.00 175.35 175.29 1iny n ASN 338 N -3.65 1.46 -3.66 0.00 4.13 -1.26 -0.75 115.26 111.53 1iny n ASN 338 Ca -0.25 -3.18 -0.15 0.00 1.68 0.00 0.00 54.58 52.69 1iny n ASN 338 Cb 1.05 -0.44 -0.08 0.00 -1.54 0.00 0.00 39.78 38.77 1iny n ASN 338 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 1iny s ASP 339 N -2.74 -0.54 0.09 6.41 2.15 -1.26 -4.86 116.67 115.92 1iny s ASP 339 Ca 0.35 0.87 -0.31 0.00 0.43 0.00 0.00 52.55 53.89 1iny s ASP 339 Cb 0.36 0.88 -0.08 0.00 -0.30 0.00 0.00 42.92 43.77 1iny s ASP 339 CO -0.09 -0.33 1.56 -2.16 -0.17 0.00 0.00 175.17 173.98 1iny s PRO 340 N -0.30 4.23 -0.12 4.34 0.04 -1.26 -4.76 135.00 137.17 1iny s PRO 340 Ca -0.05 2.25 -0.29 0.00 0.04 0.00 0.00 61.00 62.95 1iny s PRO 340 Cb -0.03 -3.45 -0.03 0.00 0.04 0.00 0.00 34.50 31.03 1iny s PRO 340 CO 0.03 -0.65 1.40 -0.47 0.04 0.00 0.00 177.00 177.36 1iny s TYR 341 N 2.07 2.56 0.47 0.56 5.04 -1.26 -4.76 117.35 122.03 1iny s TYR 341 Ca 0.70 0.72 -0.20 0.00 -2.44 0.00 0.00 57.07 55.85 1iny s TYR 341 Cb -0.39 -3.65 -0.09 0.00 0.35 0.00 0.00 41.96 38.18 1iny s TYR 341 CO 0.31 -2.47 1.01 -1.25 -1.34 0.00 0.00 175.55 171.81 1iny s PRO 342 N 3.60 3.92 0.00 4.97 0.04 -1.26 -1.43 135.00 144.84 1iny s PRO 342 Ca 0.62 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.92 1iny s PRO 342 Cb -0.26 -2.12 0.00 0.00 0.04 0.00 0.00 34.50 32.16 1iny s PRO 342 CO 0.20 -0.32 0.00 0.41 0.04 0.00 0.00 177.00 177.34 1iny n GLY 343 N -0.45 1.25 3.03 0.56 0.00 -1.26 -4.92 105.19 103.40 1iny n GLY 343 Ca 0.08 -0.06 -0.15 0.00 0.00 0.00 0.00 46.02 45.89 1iny n GLY 343 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1iny s ASN 344 N 0.00 0.85 0.35 1.61 3.84 -1.26 -4.81 114.94 115.52 1iny s ASN 344 Ca 0.00 -0.34 0.09 0.00 0.21 0.00 0.00 52.86 52.82 1iny s ASN 344 Cb 0.00 -0.03 -0.06 0.00 -0.55 0.00 0.00 41.25 40.61 1iny s ASN 344 CO 0.00 -0.05 -0.02 0.20 -2.79 0.00 0.00 177.10 174.43 1iny s ASN 345 N -0.88 3.98 -1.67 -4.21 -0.87 -1.26 -3.94 114.94 106.09 1iny s ASN 345 Ca -0.03 -1.12 -0.09 0.00 -1.57 0.00 0.00 52.86 50.05 1iny s ASN 345 Cb -0.06 -0.44 0.09 0.00 -0.02 0.00 0.00 41.25 40.82 1iny s ASN 345 CO 0.00 -0.26 0.27 0.59 -2.57 0.00 0.00 177.10 175.14 1iny n ASN 346 N -0.90 -0.30 -3.56 -1.22 5.03 -0.97 -4.91 115.26 108.42 1iny n ASN 346 Ca -0.04 -1.24 -0.10 0.00 0.87 0.00 0.00 54.58 54.06 1iny n ASN 346 Cb 0.63 -1.72 -0.05 0.00 -1.02 0.00 0.00 39.78 37.63 1iny n ASN 346 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1iny s ASN 347 N -3.93 -0.38 0.00 6.41 3.84 -0.87 -5.01 114.94 115.00 1iny s ASN 347 Ca 0.34 0.36 0.00 0.00 0.21 0.00 0.00 52.86 53.76 1iny s ASN 347 Cb -0.19 0.32 0.00 0.00 -0.55 0.00 0.00 41.25 40.83 1iny s ASN 347 CO 1.00 -0.39 0.00 0.61 -2.79 0.00 0.00 177.10 175.53 1iny n GLY 348 N 0.59 1.43 3.55 1.21 0.00 -1.18 -4.63 105.19 106.15 1iny n GLY 348 Ca -0.10 -0.71 -0.16 0.00 0.00 0.00 0.00 46.02 45.05 1iny n GLY 348 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iny s VAL 349 N -2.38 0.00 0.18 1.61 0.11 -1.20 -4.62 120.40 114.10 1iny s VAL 349 Ca 0.00 0.00 -0.30 0.00 -2.93 0.00 0.00 61.98 58.75 1iny s VAL 349 Cb 0.00 -1.00 -0.08 0.00 -1.53 0.00 0.00 36.38 33.77 1iny s VAL 349 CO 0.00 0.00 1.27 -0.75 -3.33 0.00 0.00 175.10 172.29 1iny s LYS 350 N -0.86 4.42 0.03 1.54 2.20 -1.26 -4.82 119.74 120.99 1iny s LYS 350 Ca -0.07 1.98 -0.00 0.00 -0.36 0.00 0.00 55.97 57.52 1iny s LYS 350 Cb -0.01 -3.22 0.00 0.00 -1.51 0.00 0.00 37.83 33.09 1iny s LYS 350 CO 0.06 -0.21 0.04 0.41 -0.36 0.00 0.00 175.35 175.30 1iny n GLY 351 N 2.39 3.02 2.71 5.54 0.00 -1.23 -2.99 105.19 114.62 1iny n GLY 351 Ca 0.06 -1.39 -0.06 0.00 0.00 0.00 0.00 46.02 44.63 1iny n GLY 351 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 1iny n PHE 352 N -0.05 -1.93 -3.58 1.61 -1.74 -1.26 -4.50 117.46 106.02 1iny n PHE 352 Ca 0.00 -1.31 -0.06 0.00 -0.56 0.00 0.00 57.45 55.52 1iny n PHE 352 Cb 0.05 0.65 -0.02 0.00 1.52 0.00 0.00 39.48 41.68 1iny n PHE 352 CO 0.00 0.00 0.00 -1.54 -0.56 0.00 0.00 176.76 174.66 1iny s SER 353 N -2.51 -0.21 -0.33 5.98 1.04 -1.26 -3.93 113.70 112.49 1iny s SER 353 Ca 0.12 0.04 -0.03 0.00 0.48 0.00 0.00 55.95 56.56 1iny s SER 353 Cb -0.03 0.21 0.06 0.00 0.10 0.00 0.00 66.02 66.35 1iny s SER 353 CO 0.08 -0.32 0.05 -0.31 0.98 0.00 0.00 173.24 173.73 1iny s TYR 354 N -2.36 3.33 -0.46 5.02 2.02 -0.79 -4.87 117.35 119.24 1iny s TYR 354 Ca 0.07 -1.92 -0.17 0.00 -0.37 0.00 0.00 57.07 54.68 1iny s TYR 354 Cb -0.01 -2.36 0.05 0.00 -0.40 0.00 0.00 41.96 39.24 1iny s TYR 354 CO -0.05 -0.83 0.45 -0.51 -1.57 0.00 0.00 175.55 173.05 1iny s LEU 355 N 1.25 5.21 -0.39 -1.29 1.43 -1.26 -1.71 118.68 121.92 1iny s LEU 355 Ca -0.02 -1.01 0.11 0.00 -1.03 0.00 0.00 54.13 52.18 1iny s LEU 355 Cb -0.20 -2.30 0.38 0.00 0.03 0.00 0.00 46.19 44.10 1iny s LEU 355 CO -0.01 -0.67 1.05 -0.67 0.23 0.00 0.00 176.35 176.28 1iny n ASP 356 N 5.55 -0.61 0.00 2.29 2.03 -1.26 -5.00 116.55 119.55 1iny n ASP 356 Ca -0.09 -2.98 0.00 0.00 0.52 0.00 0.00 54.79 52.23 1iny n ASP 356 Cb 0.45 0.53 0.00 0.00 -0.72 0.00 0.00 41.12 41.38 1iny n ASP 356 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1iny n GLY 357 N -0.01 3.60 0.15 0.27 0.00 -1.26 -1.29 105.19 106.65 1iny n GLY 357 Ca 0.09 0.18 0.01 0.00 0.00 0.00 0.00 46.02 46.29 1iny n GLY 357 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1iny h VAL 358 N 0.00 1.27 -0.49 1.61 2.07 -1.94 0.50 116.25 119.27 1iny h VAL 358 Ca 0.00 -1.93 -0.30 0.00 0.82 0.00 0.00 66.70 65.28 1iny h VAL 358 Cb 0.00 2.08 -0.11 0.00 -1.52 0.00 0.00 31.29 31.73 1iny h VAL 358 CO 0.00 0.53 0.18 -3.20 0.02 0.00 0.00 177.57 175.10 1iny n ASN 359 N -3.72 6.05 -4.65 0.57 5.15 -0.41 -4.48 115.26 113.78 1iny n ASN 359 Ca -0.01 -2.89 -0.35 0.00 -0.60 0.00 0.00 54.58 50.74 1iny n ASN 359 Cb 0.58 -1.20 -0.10 0.00 -0.53 0.00 0.00 39.78 38.54 1iny n ASN 359 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1iny s THR 360 N -1.26 4.67 -0.05 -0.44 2.01 -1.23 -4.04 115.64 115.30 1iny s THR 360 Ca 0.42 -0.08 0.00 0.00 0.31 0.00 0.00 61.69 62.34 1iny s THR 360 Cb 0.26 -3.07 0.02 0.00 0.01 0.00 0.00 72.50 69.73 1iny s THR 360 CO -0.07 0.51 -0.02 0.26 -0.69 0.00 0.00 174.62 174.60 1iny s TRP 361 N 0.01 0.61 -0.04 4.92 0.52 -0.69 -2.15 118.94 122.12 1iny s TRP 361 Ca 0.05 -0.14 0.00 0.00 0.02 0.00 0.00 56.10 56.03 1iny s TRP 361 Cb -0.12 -0.63 -0.03 0.00 -1.15 0.00 0.00 33.47 31.54 1iny s TRP 361 CO 0.01 -0.20 -0.01 -0.51 0.02 0.00 0.00 176.95 176.25 1iny s LEU 362 N 1.17 3.46 0.14 2.99 1.43 -0.13 -1.89 118.68 125.86 1iny s LEU 362 Ca -0.07 0.03 0.07 0.00 -1.03 0.00 0.00 54.13 53.13 1iny s LEU 362 Cb -0.14 -1.89 -0.04 0.00 0.03 0.00 0.00 46.19 44.16 1iny s LEU 362 CO -0.02 0.33 -0.05 -0.83 0.23 0.00 0.00 176.35 176.01 1iny s GLY 363 N -1.20 1.77 -0.07 -3.19 0.00 -1.25 -0.32 107.32 103.06 1iny s GLY 363 Ca 0.16 -1.32 -0.31 0.00 0.00 0.00 0.00 44.72 43.26 1iny s GLY 363 CO 0.06 -1.32 0.99 1.09 0.00 0.00 0.00 173.10 173.92 1iny s ARG 364 N -2.60 0.65 0.76 2.90 1.70 -0.63 -4.78 118.95 116.96 1iny s ARG 364 Ca 0.25 -0.23 -0.11 0.00 -0.47 0.00 0.00 55.73 55.17 1iny s ARG 364 Cb -0.10 0.30 0.05 0.00 -0.57 0.00 0.00 34.95 34.63 1iny s ARG 364 CO 0.16 -0.28 1.08 0.95 -1.08 0.00 0.00 175.30 176.13 1iny s THR 365 N -2.83 3.46 -0.12 4.99 -4.23 -1.26 -0.96 115.64 114.69 1iny s THR 365 Ca 0.06 0.48 -0.21 0.00 -1.18 0.00 0.00 61.69 60.84 1iny s THR 365 Cb -0.01 -3.14 -0.26 0.00 1.34 0.00 0.00 72.50 70.43 1iny s THR 365 CO -0.07 -0.62 0.58 0.40 -0.54 0.00 0.00 174.62 174.37 1iny h ILE 366 N -1.00 1.25 -3.43 2.99 2.04 -1.57 -3.45 117.51 114.33 1iny h ILE 366 Ca -0.45 -2.36 -0.52 0.00 1.00 0.00 0.00 64.86 62.52 1iny h ILE 366 Cb 1.24 2.84 0.03 0.00 -0.74 0.00 0.00 36.82 40.18 1iny h ILE 366 CO 0.56 0.60 0.61 -0.55 0.00 0.00 0.00 178.15 179.38 1iny s SER 367 N -6.81 6.97 0.18 1.72 0.15 -1.16 -4.92 113.70 109.83 1iny s SER 367 Ca -0.21 2.34 0.25 0.00 0.70 0.00 0.00 55.95 59.04 1iny s SER 367 Cb 0.03 -2.61 0.64 0.00 -1.71 0.00 0.00 66.02 62.36 1iny s SER 367 CO 0.72 -0.47 1.61 2.30 1.20 0.00 0.00 173.24 178.61 1iny n ILE 368 N 2.54 0.52 -0.12 6.45 -5.35 -1.26 -4.20 119.36 117.94 1iny n ILE 368 Ca 0.05 -0.29 -0.18 0.00 -0.27 0.00 0.00 62.75 62.06 1iny n ILE 368 Cb 0.43 -0.42 -0.11 0.00 -1.74 0.00 0.00 39.64 37.80 1iny n ILE 368 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1iny n ALA 369 N -1.81 1.45 -2.27 -1.28 0.00 -1.26 -0.64 120.51 114.70 1iny n ALA 369 Ca 0.05 -1.05 -0.15 0.00 0.00 0.00 0.00 53.44 52.29 1iny n ALA 369 Cb 0.44 -0.05 -0.10 0.00 0.00 0.00 0.00 19.45 19.74 1iny n ALA 369 CO 0.00 0.00 0.00 -0.48 0.00 0.00 0.00 177.50 177.02 1iny s LEU 370 N -6.54 1.78 -1.04 0.00 0.05 -1.26 -4.60 118.68 107.07 1iny s LEU 370 Ca -0.34 -1.30 -0.22 0.00 0.05 0.00 0.00 54.13 52.32 1iny s LEU 370 Cb 0.09 0.03 -0.11 0.00 -2.05 0.00 0.00 46.19 44.15 1iny s LEU 370 CO 0.56 -0.68 1.92 0.54 -0.55 0.00 0.00 176.35 178.14 1iny n ARG 371 N -0.36 1.58 -3.86 1.48 1.74 -1.26 -4.36 116.66 111.62 1iny n ARG 371 Ca -0.02 -2.26 -0.12 0.00 -0.77 0.00 0.00 57.85 54.68 1iny n ARG 371 Cb 0.65 -3.44 -0.13 0.00 -1.02 0.00 0.00 32.46 28.52 1iny n ARG 371 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1iny s SER 372 N 5.93 -0.03 0.11 0.55 1.04 -1.26 -2.92 113.70 117.12 1iny s SER 372 Ca 0.64 0.04 0.00 0.00 0.48 0.00 0.00 55.95 57.11 1iny s SER 372 Cb 0.05 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.29 1iny s SER 372 CO 0.13 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 174.90 1iny n GLY 373 N 2.83 -2.48 3.57 7.32 0.00 0.15 -2.38 105.19 114.20 1iny n GLY 373 Ca -0.14 -1.39 -0.13 0.00 0.00 0.00 0.00 46.02 44.36 1iny n GLY 373 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1iny s TYR 374 N -2.83 -0.76 0.02 1.61 5.04 -0.50 -3.81 117.35 116.12 1iny s TYR 374 Ca 0.00 1.80 -0.11 0.00 -2.44 0.00 0.00 57.07 56.31 1iny s TYR 374 Cb 0.00 0.29 0.01 0.00 0.35 0.00 0.00 41.96 42.61 1iny s TYR 374 CO 0.00 -0.37 0.24 -1.83 -1.34 0.00 0.00 175.55 172.25 1iny s GLU 375 N 0.51 0.66 -0.06 4.97 -1.05 -0.14 -1.40 118.70 122.20 1iny s GLU 375 Ca -0.01 -0.42 0.02 0.00 -0.15 0.00 0.00 54.97 54.40 1iny s GLU 375 Cb -0.05 0.28 -0.03 0.00 -0.44 0.00 0.00 34.13 33.90 1iny s GLU 375 CO -0.02 -0.19 -0.10 -1.64 0.95 0.00 0.00 175.26 174.27 1iny s MET 376 N -1.94 2.66 -0.04 -4.83 -1.94 -0.03 -1.60 119.30 111.58 1iny s MET 376 Ca -0.10 -0.61 0.01 0.00 -1.71 0.00 0.00 55.69 53.28 1iny s MET 376 Cb -0.04 -2.51 0.02 0.00 2.01 0.00 0.00 34.83 34.32 1iny s MET 376 CO -0.00 0.64 -0.02 -0.51 -0.01 0.00 0.00 175.02 175.12 1iny s LEU 377 N -0.76 1.19 -0.42 -0.03 1.43 0.56 -1.63 118.68 119.02 1iny s LEU 377 Ca 0.12 -0.08 -0.24 0.00 -1.03 0.00 0.00 54.13 52.89 1iny s LEU 377 Cb -0.11 -0.35 0.02 0.00 0.03 0.00 0.00 46.19 45.78 1iny s LEU 377 CO 0.01 -0.09 0.85 -0.75 0.23 0.00 0.00 176.35 176.61 1iny s LYS 378 N 1.06 3.59 -0.46 1.70 2.20 -0.27 -0.95 119.74 126.60 1iny s LYS 378 Ca -0.09 0.18 0.03 0.00 -0.36 0.00 0.00 55.97 55.72 1iny s LYS 378 Cb -0.14 -3.89 0.13 0.00 -1.51 0.00 0.00 37.83 32.43 1iny s LYS 378 CO -0.01 -1.07 0.23 0.08 -0.36 0.00 0.00 175.35 174.22 1iny s VAL 379 N 3.44 1.92 0.10 4.02 1.01 -0.91 -0.92 120.40 129.05 1iny s VAL 379 Ca 0.34 -2.83 -0.34 0.00 0.00 0.00 0.00 61.98 59.14 1iny s VAL 379 Cb -0.12 -2.35 -0.14 0.00 0.00 0.00 0.00 36.38 33.78 1iny s VAL 379 CO 0.22 -0.84 1.62 -2.65 0.00 0.00 0.00 175.10 173.46 1iny n PRO 380 N 3.43 2.06 -2.75 2.72 -0.02 -1.26 -2.62 135.00 136.56 1iny n PRO 380 Ca 0.06 0.75 -0.20 0.00 -2.02 0.00 0.00 63.50 62.09 1iny n PRO 380 Cb 0.34 -2.52 0.02 0.00 -0.02 0.00 0.00 33.50 31.32 1iny n PRO 380 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1iny n ASN 381 N 4.02 -5.71 -0.19 2.55 3.02 0.17 -4.82 115.26 114.29 1iny n ASN 381 Ca 0.18 -0.18 -0.03 0.00 -0.03 0.00 0.00 54.58 54.53 1iny n ASN 381 Cb 0.28 -4.61 0.04 0.00 -0.61 0.00 0.00 39.78 34.87 1iny n ASN 381 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1iny h ALA 382 N 0.92 0.20 -0.06 5.41 0.00 -1.75 0.11 119.26 124.09 1iny h ALA 382 Ca -0.48 0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 1iny h ALA 382 Cb 1.34 0.59 -0.00 0.00 0.00 0.00 0.00 17.79 19.72 1iny h ALA 382 CO 0.53 -0.54 0.00 1.25 0.00 0.00 0.00 179.25 180.50 1iny h LEU 383 N -0.09 0.07 0.00 0.00 5.85 -1.92 -0.04 115.31 119.19 1iny h LEU 383 Ca 0.26 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.98 1iny h LEU 383 Cb 0.50 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.51 1iny h LEU 383 CO -0.64 0.09 -0.67 0.35 -0.34 0.00 0.00 178.44 177.23 1iny n THR 384 N -4.49 0.00 -3.78 1.05 -2.24 -0.79 -3.35 114.28 100.67 1iny n THR 384 Ca -0.02 -0.27 -0.37 0.00 -2.27 0.00 0.00 64.05 61.12 1iny n THR 384 Cb 0.12 0.82 -0.13 0.00 -2.10 0.00 0.00 70.33 69.04 1iny n THR 384 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1iny s ASP 385 N -2.15 5.22 -0.05 3.42 -1.08 -0.04 -4.98 116.67 117.02 1iny s ASP 385 Ca 0.02 -1.16 0.01 0.00 -0.52 0.00 0.00 52.55 50.89 1iny s ASP 385 Cb 0.06 -1.84 0.09 0.00 -1.46 0.00 0.00 42.92 39.78 1iny s ASP 385 CO 0.37 -0.31 0.98 -0.90 0.52 0.00 0.00 175.17 175.83 1iny n ASP 386 N 4.77 2.66 0.00 -0.34 5.75 -1.26 -2.77 116.55 125.36 1iny n ASP 386 Ca -0.13 -2.18 0.00 0.00 -0.01 0.00 0.00 54.79 52.47 1iny n ASP 386 Cb 0.44 -0.54 0.00 0.00 -1.03 0.00 0.00 41.12 40.00 1iny n ASP 386 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1iny n LYS 387 N 0.23 0.00 -1.61 0.11 4.76 -1.26 -0.54 118.16 119.85 1iny n LYS 387 Ca 0.06 0.00 -0.43 0.00 -2.87 0.00 0.00 58.31 55.07 1iny n LYS 387 Cb 0.57 -0.17 -0.01 0.00 -1.84 0.00 0.00 35.03 33.58 1iny n LYS 387 CO 0.00 0.00 0.00 -1.13 -1.37 0.00 0.00 177.40 174.90 1iny n SER 388 N 0.00 1.53 -4.15 4.39 3.41 -1.12 -4.83 113.62 112.86 1iny n SER 388 Ca 0.00 1.15 -0.10 0.00 -0.26 0.00 0.00 58.87 59.67 1iny n SER 388 Cb 0.09 -1.34 -0.10 0.00 -0.26 0.00 0.00 64.21 62.60 1iny n SER 388 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1iny s LYS 389 N -1.70 0.79 0.14 4.33 -0.14 -1.26 -4.11 119.74 117.79 1iny s LYS 389 Ca 0.59 -1.32 -0.35 0.00 -1.36 0.00 0.00 55.97 53.53 1iny s LYS 389 Cb -0.65 -0.08 -0.15 0.00 -1.68 0.00 0.00 37.83 35.27 1iny s LYS 389 CO 0.60 -0.06 1.45 -2.30 -0.76 0.00 0.00 175.35 174.28 1iny n PRO 390 N -0.02 1.69 -0.06 -1.68 -0.02 -1.26 -4.54 135.00 129.11 1iny n PRO 390 Ca -0.12 0.61 -0.07 0.00 -2.02 0.00 0.00 63.50 61.90 1iny n PRO 390 Cb 0.61 -2.31 -0.09 0.00 -0.02 0.00 0.00 33.50 31.70 1iny n PRO 390 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1iny n THR 391 N 2.84 0.84 -3.49 3.45 -1.04 -0.10 -5.03 114.28 111.75 1iny n THR 391 Ca 0.17 -0.47 -0.11 0.00 -2.04 0.00 0.00 64.05 61.60 1iny n THR 391 Cb 0.25 -0.77 -0.02 0.00 -1.82 0.00 0.00 70.33 67.96 1iny n THR 391 CO 0.00 0.00 0.00 -1.58 -0.64 0.00 0.00 175.07 172.85 1iny s GLN 392 N -2.29 1.29 0.30 -2.82 0.74 -1.25 -5.01 119.66 110.63 1iny s GLN 392 Ca -0.10 -0.55 -0.20 0.00 0.05 0.00 0.00 55.36 54.57 1iny s GLN 392 Cb 0.04 0.57 0.03 0.00 1.10 0.00 0.00 33.01 34.75 1iny s GLN 392 CO 0.46 -0.56 0.73 0.20 -0.55 0.00 0.00 175.29 175.57 1iny s GLY 393 N -2.77 0.02 -0.24 2.59 0.00 -1.26 -1.12 107.32 104.53 1iny s GLY 393 Ca 0.02 -0.41 -0.17 0.00 0.00 0.00 0.00 44.72 44.16 1iny s GLY 393 CO -0.11 -0.14 0.62 1.62 0.00 0.00 0.00 173.10 175.08 1iny s GLN 394 N -3.57 0.66 0.02 2.90 0.74 -0.64 -5.01 119.66 114.75 1iny s GLN 394 Ca 0.12 1.02 -0.25 0.00 0.05 0.00 0.00 55.36 56.31 1iny s GLN 394 Cb -0.06 0.18 -0.05 0.00 1.10 0.00 0.00 33.01 34.18 1iny s GLN 394 CO 0.08 -0.13 0.76 0.99 -0.55 0.00 0.00 175.29 176.44 1iny s THR 395 N 1.16 4.80 -0.12 -0.34 2.01 -1.26 -0.86 115.64 121.03 1iny s THR 395 Ca -0.07 1.60 -0.04 0.00 0.31 0.00 0.00 61.69 63.50 1iny s THR 395 Cb -0.05 -4.10 -0.06 0.00 0.01 0.00 0.00 72.50 68.29 1iny s THR 395 CO -0.12 0.33 -0.14 -0.38 -0.69 0.00 0.00 174.62 173.63 1iny n ILE 396 N 3.04 0.69 -4.15 1.82 2.08 -0.49 -4.58 119.36 117.76 1iny n ILE 396 Ca -0.02 -0.21 -0.19 0.00 0.56 0.00 0.00 62.75 62.90 1iny n ILE 396 Cb 0.50 -1.38 -0.16 0.00 -0.75 0.00 0.00 39.64 37.85 1iny n ILE 396 CO 0.00 0.00 0.00 -0.69 0.56 0.00 0.00 176.55 176.42 1iny s VAL 397 N -2.23 0.48 0.78 1.39 1.01 -1.03 -1.08 120.40 119.70 1iny s VAL 397 Ca -0.17 -0.14 -0.11 0.00 0.00 0.00 0.00 61.98 61.57 1iny s VAL 397 Cb 0.06 -0.48 0.06 0.00 0.00 0.00 0.00 36.38 36.02 1iny s VAL 397 CO 0.24 0.19 1.10 -0.76 0.00 0.00 0.00 175.10 175.87 1iny s LEU 398 N 0.62 3.04 0.00 3.92 1.43 -1.26 -1.40 118.68 125.03 1iny s LEU 398 Ca -0.08 1.88 0.13 0.00 -1.03 0.00 0.00 54.13 55.03 1iny s LEU 398 Cb -0.11 -4.53 0.57 0.00 0.03 0.00 0.00 46.19 42.15 1iny s LEU 398 CO -0.00 -2.11 1.39 -3.20 0.23 0.00 0.00 176.35 172.66 1iny n ASN 399 N -3.50 0.00 -0.35 2.29 4.05 -1.26 -0.90 115.26 115.59 1iny n ASN 399 Ca 0.09 0.41 0.14 0.00 0.45 0.00 0.00 54.58 55.67 1iny n ASN 399 Cb 0.53 -0.45 0.47 0.00 1.23 0.00 0.00 39.78 41.55 1iny n ASN 399 CO 0.00 0.00 0.00 0.35 -3.05 0.00 0.00 177.26 174.56 1iny n THR 400 N -1.45 0.00 -5.09 -0.44 -2.24 -1.26 -4.46 114.28 99.34 1iny n THR 400 Ca 0.04 -0.18 -0.32 0.00 -2.27 0.00 0.00 64.05 61.31 1iny n THR 400 Cb 0.14 0.42 -0.15 0.00 -2.10 0.00 0.00 70.33 68.64 1iny n THR 400 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1iny s ASP 401 N -2.25 3.52 0.71 3.42 1.01 -0.07 -5.01 116.67 118.00 1iny s ASP 401 Ca 0.32 -0.35 -0.14 0.00 0.71 0.00 0.00 52.55 53.08 1iny s ASP 401 Cb 0.20 -0.72 0.03 0.00 1.01 0.00 0.00 42.92 43.44 1iny s ASP 401 CO 0.42 0.31 1.12 0.26 0.21 0.00 0.00 175.17 177.50 1iny s TRP 402 N -0.52 2.46 0.00 4.23 0.52 -1.26 0.34 118.94 124.70 1iny s TRP 402 Ca 0.07 1.58 0.00 0.00 0.02 0.00 0.00 56.10 57.76 1iny s TRP 402 Cb -0.11 -3.21 0.00 0.00 -1.15 0.00 0.00 33.47 29.00 1iny s TRP 402 CO 0.01 -1.93 0.00 -1.13 0.02 0.00 0.00 176.95 173.92 1iny n SER 403 N -2.80 0.00 0.00 2.95 3.41 -1.15 -4.63 113.62 111.41 1iny n SER 403 Ca 0.11 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.72 1iny n SER 403 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 1iny n SER 403 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iny n GLY 404 N 0.00 -0.20 3.68 5.00 0.00 -0.68 -1.72 105.19 111.27 1iny n GLY 404 Ca 0.00 -0.57 -0.30 0.00 0.00 0.00 0.00 46.02 45.15 1iny n GLY 404 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1iny s TYR 405 N -2.38 2.06 -0.10 1.61 1.51 -1.26 -4.68 117.35 114.11 1iny s TYR 405 Ca 0.00 1.40 -0.27 0.00 -1.01 0.00 0.00 57.07 57.19 1iny s TYR 405 Cb 0.00 -3.17 0.06 0.00 -0.11 0.00 0.00 41.96 38.74 1iny s TYR 405 CO 0.00 -2.63 0.63 -1.54 -1.11 0.00 0.00 175.55 170.90 1iny s SER 406 N -3.13 -0.61 0.30 2.29 1.04 -1.16 -0.54 113.70 111.89 1iny s SER 406 Ca 0.65 0.81 -0.12 0.00 0.48 0.00 0.00 55.95 57.76 1iny s SER 406 Cb -0.20 0.73 0.01 0.00 0.10 0.00 0.00 66.02 66.66 1iny s SER 406 CO 0.58 -0.49 0.58 -0.83 0.98 0.00 0.00 173.24 174.06 1iny s GLY 407 N -0.79 0.61 0.11 7.32 0.00 -1.00 -3.54 107.32 110.03 1iny s GLY 407 Ca -0.08 -0.90 0.03 0.00 0.00 0.00 0.00 44.72 43.77 1iny s GLY 407 CO 0.07 -0.56 0.14 -1.35 0.00 0.00 0.00 173.10 171.40 1iny s SER 408 N -3.06 5.74 0.06 1.64 1.04 -1.26 -2.14 113.70 115.71 1iny s SER 408 Ca 0.21 0.01 -0.27 0.00 0.48 0.00 0.00 55.95 56.39 1iny s SER 408 Cb -0.02 -1.59 0.09 0.00 0.10 0.00 0.00 66.02 64.60 1iny s SER 408 CO 0.12 0.12 0.76 0.72 0.98 0.00 0.00 173.24 175.94 1iny s PHE 409 N -1.57 -0.45 0.02 5.02 -0.71 -1.22 -4.67 117.98 114.41 1iny s PHE 409 Ca 0.31 0.34 -0.17 0.00 -1.04 0.00 0.00 56.93 56.37 1iny s PHE 409 Cb -0.11 0.54 0.03 0.00 -1.21 0.00 0.00 43.02 42.26 1iny s PHE 409 CO 0.24 -0.67 0.38 -1.64 -1.34 0.00 0.00 175.22 172.20 1iny s MET 410 N -3.17 0.85 -0.92 1.99 -1.94 -1.26 -2.25 119.30 112.59 1iny s MET 410 Ca 0.02 -0.31 -0.16 0.00 -1.71 0.00 0.00 55.69 53.53 1iny s MET 410 Cb -0.01 0.38 0.17 0.00 2.01 0.00 0.00 34.83 37.38 1iny s MET 410 CO -0.09 -0.27 1.03 0.34 -0.01 0.00 0.00 175.02 176.01 1iny s ASP 411 N -1.79 6.74 0.23 3.03 -1.08 -1.26 -4.72 116.67 117.83 1iny s ASP 411 Ca -0.08 -2.41 0.17 0.00 -0.52 0.00 0.00 52.55 49.72 1iny s ASP 411 Cb -0.02 -2.33 0.89 0.00 -1.46 0.00 0.00 42.92 40.01 1iny s ASP 411 CO -0.00 -0.84 1.53 -1.22 0.52 0.00 0.00 175.17 175.17 1iny n TYR 412 N 5.42 0.57 -0.57 -5.34 4.01 -1.26 -2.30 117.16 117.69 1iny n TYR 412 Ca 0.21 0.28 0.08 0.00 -0.16 0.00 0.00 57.90 58.32 1iny n TYR 412 Cb 0.47 -0.95 0.27 0.00 -0.31 0.00 0.00 39.34 38.82 1iny n TYR 412 CO 0.00 0.00 0.00 0.91 -0.46 0.00 0.00 176.86 177.31 1iny n TRP 413 N -2.07 1.00 -2.93 -0.72 8.01 -1.26 -5.00 117.44 114.47 1iny n TRP 413 Ca -0.00 -0.64 -0.31 0.00 -1.31 0.00 0.00 57.50 55.23 1iny n TRP 413 Cb 0.07 -0.19 -0.05 0.00 -2.01 0.00 0.00 31.31 29.13 1iny n TRP 413 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 1iny s ALA 414 N -1.80 3.30 0.30 6.99 0.00 -0.97 -5.05 121.76 124.52 1iny s ALA 414 Ca 0.40 -0.04 -0.28 0.00 0.00 0.00 0.00 51.96 52.03 1iny s ALA 414 Cb 0.26 -2.79 -0.09 0.00 0.00 0.00 0.00 23.12 20.50 1iny s ALA 414 CO 0.18 0.12 1.04 -1.21 0.00 0.00 0.00 175.76 175.89 1iny s GLU 415 N -3.48 4.60 0.00 0.00 8.01 -1.26 -4.95 118.70 121.62 1iny s GLU 415 Ca 0.54 1.63 0.00 0.00 0.01 0.00 0.00 54.97 57.14 1iny s GLU 415 Cb -0.10 -3.05 0.00 0.00 -4.31 0.00 0.00 34.13 26.67 1iny s GLU 415 CO 0.25 0.22 0.00 0.41 0.01 0.00 0.00 175.26 176.15 1iny n GLY 416 N 1.04 -0.17 0.19 -1.39 0.00 -1.26 -4.93 105.19 98.67 1iny n GLY 416 Ca 0.00 -1.59 0.02 0.00 0.00 0.00 0.00 46.02 44.46 1iny n GLY 416 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1iny n GLU 417 N -0.05 -0.14 -4.11 1.61 0.28 -1.26 -5.04 120.64 111.94 1iny n GLU 417 Ca 0.00 -0.84 -0.13 0.00 -0.16 0.00 0.00 57.16 56.03 1iny n GLU 417 Cb 0.00 -1.09 -0.06 0.00 1.43 0.00 0.00 31.44 31.72 1iny n GLU 417 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1iny s TYR 419 N -3.51 3.25 -0.28 0.00 2.02 0.29 -4.83 117.35 114.28 1iny s TYR 419 Ca 0.31 0.10 -0.23 0.00 -0.37 0.00 0.00 57.07 56.88 1iny s TYR 419 Cb 0.01 -2.30 -0.01 0.00 -0.40 0.00 0.00 41.96 39.27 1iny s TYR 419 CO 0.17 -0.07 0.75 0.50 -1.57 0.00 0.00 175.55 175.33 1iny s ARG 420 N 1.35 4.05 0.20 -0.62 3.52 -1.26 -1.38 118.95 124.80 1iny s ARG 420 Ca 0.07 0.64 -0.30 0.00 -0.13 0.00 0.00 55.73 56.01 1iny s ARG 420 Cb -0.15 -3.69 -0.08 0.00 -1.56 0.00 0.00 34.95 29.48 1iny s ARG 420 CO 0.07 -0.57 0.94 0.00 -0.81 0.00 0.00 175.30 174.93 1iny s ALA 421 N 2.79 3.31 0.33 6.12 0.00 -1.26 -4.43 121.76 128.62 1iny s ALA 421 Ca 0.31 0.60 0.03 0.00 0.00 0.00 0.00 51.96 52.90 1iny s ALA 421 Cb -0.15 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 19.70 1iny s ALA 421 CO 0.10 0.14 0.10 0.00 0.00 0.00 0.00 175.76 176.10 1iny s PHE 423 N -3.43 -0.42 0.10 0.00 -0.71 -0.74 -3.42 117.98 109.36 1iny s PHE 423 Ca 0.34 0.18 0.04 0.00 -1.04 0.00 0.00 56.93 56.45 1iny s PHE 423 Cb 0.07 0.58 -0.04 0.00 -1.21 0.00 0.00 43.02 42.42 1iny s PHE 423 CO 0.15 -0.85 -0.11 1.52 -1.34 0.00 0.00 175.22 174.59 1iny s TYR 424 N -3.63 1.14 -0.07 3.49 -0.85 -0.91 -2.03 117.35 114.50 1iny s TYR 424 Ca 0.04 -0.64 0.01 0.00 -0.52 0.00 0.00 57.07 55.96 1iny s TYR 424 Cb -0.02 -0.61 0.02 0.00 0.38 0.00 0.00 41.96 41.73 1iny s TYR 424 CO -0.08 0.03 -0.08 0.08 -1.52 0.00 0.00 175.55 173.98 1iny s VAL 425 N -2.42 0.88 0.07 -3.49 1.01 -0.92 -2.38 120.40 113.16 1iny s VAL 425 Ca 0.07 -0.30 -0.26 0.00 0.00 0.00 0.00 61.98 61.49 1iny s VAL 425 Cb -0.03 -0.86 -0.06 0.00 0.00 0.00 0.00 36.38 35.43 1iny s VAL 425 CO 0.01 0.31 0.81 -0.70 0.00 0.00 0.00 175.10 175.53 1iny s GLU 426 N 1.01 4.55 -0.36 2.72 2.12 0.30 -3.21 118.70 125.83 1iny s GLU 426 Ca -0.09 1.17 -0.01 0.00 0.36 0.00 0.00 54.97 56.39 1iny s GLU 426 Cb -0.15 -3.35 0.09 0.00 0.26 0.00 0.00 34.13 30.98 1iny s GLU 426 CO -0.00 0.30 0.11 -0.51 -0.54 0.00 0.00 175.26 174.62 1iny s LEU 427 N -0.18 4.73 0.11 2.70 1.43 -0.70 -1.69 118.68 125.09 1iny s LEU 427 Ca 0.40 -1.81 -0.25 0.00 -1.03 0.00 0.00 54.13 51.44 1iny s LEU 427 Cb -0.21 -1.76 -0.07 0.00 0.03 0.00 0.00 46.19 44.18 1iny s LEU 427 CO 0.25 -0.42 0.78 -0.63 0.23 0.00 0.00 176.35 176.55 1iny s ILE 428 N 1.14 4.53 0.09 -0.59 1.01 -0.70 -0.87 121.20 125.80 1iny s ILE 428 Ca 0.04 1.68 0.08 0.00 0.00 0.00 0.00 60.65 62.45 1iny s ILE 428 Cb -0.21 -4.13 -0.03 0.00 0.01 0.00 0.00 42.46 38.09 1iny s ILE 428 CO -0.04 0.45 -0.21 -0.13 0.00 0.00 0.00 174.94 175.01 1iny s ARG 429 N -0.64 1.20 0.65 2.79 1.81 0.10 -4.72 118.95 120.13 1iny s ARG 429 Ca 0.37 -1.11 0.00 0.00 -1.72 0.00 0.00 55.73 53.27 1iny s ARG 429 Cb -0.22 -1.44 0.00 0.00 -0.45 0.00 0.00 34.95 32.84 1iny s ARG 429 CO 0.25 0.34 0.00 0.41 -0.68 0.00 0.00 175.30 175.62 1iny n GLY 430 N 1.27 0.05 3.76 -3.53 0.00 -1.26 -2.03 105.19 103.44 1iny n GLY 430 Ca -0.19 -1.65 -0.35 0.00 0.00 0.00 0.00 46.02 43.83 1iny n GLY 430 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iny s ARG 431 N 0.00 2.98 0.13 1.61 0.52 -0.90 0.23 118.95 123.52 1iny s ARG 431 Ca 0.00 1.68 -0.03 0.00 -0.52 0.00 0.00 55.73 56.86 1iny s ARG 431 Cb 0.00 -1.95 -0.09 0.00 0.52 0.00 0.00 34.95 33.43 1iny s ARG 431 CO 0.00 -1.16 1.30 -1.35 0.02 0.00 0.00 175.30 174.11 1iny h PRO 432 N 0.72 0.35 -0.29 3.54 0.11 -1.92 -3.44 132.00 131.07 1iny h PRO 432 Ca -0.49 -0.39 -0.08 0.00 0.11 0.00 0.00 66.00 65.14 1iny h PRO 432 Cb 1.28 0.12 -0.02 0.00 0.11 0.00 0.00 31.00 32.49 1iny h PRO 432 CO 0.55 1.08 -0.18 0.87 -0.21 0.00 0.00 178.00 180.11 1iny h LYS 433 N 0.19 0.52 -3.24 1.05 1.79 -1.98 -3.33 116.57 111.56 1iny h LYS 433 Ca -0.08 -0.17 -0.75 0.00 -2.18 0.00 0.00 60.65 57.47 1iny h LYS 433 Cb 1.60 -0.04 -0.32 0.00 -1.58 0.00 0.00 32.23 31.88 1iny h LYS 433 CO 0.16 0.68 0.22 0.39 -1.08 0.00 0.00 179.45 179.82 1iny n GLU 434 N -4.16 3.27 -0.12 3.15 1.02 0.14 -4.94 120.64 118.99 1iny n GLU 434 Ca 0.00 -4.50 0.02 0.00 -0.02 0.00 0.00 57.16 52.66 1iny n GLU 434 Cb 0.36 -2.46 0.07 0.00 -0.02 0.00 0.00 31.44 29.39 1iny n GLU 434 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1iny n ASP 435 N 2.14 1.30 0.01 1.62 5.75 -1.25 -3.04 116.55 123.07 1iny n ASP 435 Ca 0.24 -2.08 0.14 0.00 -0.01 0.00 0.00 54.79 53.07 1iny n ASP 435 Cb 0.37 -0.30 0.56 0.00 -1.03 0.00 0.00 41.12 40.73 1iny n ASP 435 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1iny n LYS 436 N 0.02 0.02 -4.19 0.11 5.02 -1.26 -4.75 118.16 113.11 1iny n LYS 436 Ca 0.05 0.01 -0.30 0.00 -2.02 0.00 0.00 58.31 56.06 1iny n LYS 436 Cb 0.26 -1.52 -0.09 0.00 -0.02 0.00 0.00 35.03 33.66 1iny n LYS 436 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1iny s VAL 437 N -3.01 3.57 -2.07 -0.18 -7.23 -1.24 -4.98 120.40 105.26 1iny s VAL 437 Ca 0.13 -1.19 0.25 0.00 -1.81 0.00 0.00 61.98 59.37 1iny s VAL 437 Cb 0.18 -2.68 0.24 0.00 0.56 0.00 0.00 36.38 34.68 1iny s VAL 437 CO 0.56 0.11 1.45 0.79 -0.31 0.00 0.00 175.10 177.69 1iny n TRP 438 N 0.64 0.00 -3.61 2.82 7.02 -1.26 -4.58 117.44 118.46 1iny n TRP 438 Ca -0.13 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.11 1iny n TRP 438 Cb 0.52 -0.06 0.02 0.00 -2.42 0.00 0.00 31.31 29.38 1iny n TRP 438 CO 0.00 0.00 0.00 1.67 -2.02 0.00 0.00 177.69 177.34 1iny s TRP 439 N -2.36 1.38 -0.13 -5.99 1.48 -1.22 -2.10 118.94 110.00 1iny s TRP 439 Ca 0.26 -0.85 -0.05 0.00 -1.06 0.00 0.00 56.10 54.39 1iny s TRP 439 Cb 0.19 -1.99 0.06 0.00 -1.16 0.00 0.00 33.47 30.58 1iny s TRP 439 CO 0.48 -0.79 0.27 0.99 -4.06 0.00 0.00 176.95 173.85 1iny s THR 440 N -2.78 -0.29 0.30 0.66 2.01 -1.26 -2.12 115.64 112.16 1iny s THR 440 Ca 0.42 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.66 1iny s THR 440 Cb -0.03 -0.44 -0.00 0.00 0.01 0.00 0.00 72.50 72.04 1iny s THR 440 CO 0.27 0.09 0.39 -0.24 -0.69 0.00 0.00 174.62 174.44 1iny n SER 441 N 4.96 -1.06 -3.96 3.53 2.88 -0.86 -4.65 113.62 114.45 1iny n SER 441 Ca -0.13 -2.72 -0.12 0.00 -1.33 0.00 0.00 58.87 54.57 1iny n SER 441 Cb 0.51 2.05 -0.08 0.00 -0.75 0.00 0.00 64.21 65.94 1iny n SER 441 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1iny s ASN 442 N -2.93 0.32 0.32 -3.46 4.22 -1.24 -0.73 114.94 111.43 1iny s ASN 442 Ca 0.28 -1.32 0.03 0.00 -2.14 0.00 0.00 52.86 49.71 1iny s ASN 442 Cb -0.00 0.48 -0.06 0.00 1.28 0.00 0.00 41.25 42.95 1iny s ASN 442 CO 0.20 -0.99 0.07 -0.55 -2.04 0.00 0.00 177.10 173.79 1iny s SER 443 N -3.15 2.17 0.01 3.54 0.15 -0.05 -4.59 113.70 111.79 1iny s SER 443 Ca 0.34 -1.40 0.02 0.00 0.70 0.00 0.00 55.95 55.61 1iny s SER 443 Cb 0.04 -0.01 -0.01 0.00 -1.71 0.00 0.00 66.02 64.33 1iny s SER 443 CO 0.14 -0.65 -0.05 -0.63 1.20 0.00 0.00 173.24 173.24 1iny s ILE 444 N -3.38 0.39 0.01 6.45 1.01 -1.26 -1.71 121.20 122.70 1iny s ILE 444 Ca 0.36 -0.56 0.01 0.00 0.00 0.00 0.00 60.65 60.46 1iny s ILE 444 Cb 0.08 -0.40 -0.01 0.00 0.01 0.00 0.00 42.46 42.15 1iny s ILE 444 CO 0.15 -0.13 -0.04 0.54 0.00 0.00 0.00 174.94 175.47 1iny s VAL 445 N -0.67 0.26 -0.02 2.92 0.11 -1.20 -1.54 120.40 120.26 1iny s VAL 445 Ca -0.04 -0.39 -0.03 0.00 -2.93 0.00 0.00 61.98 58.59 1iny s VAL 445 Cb -0.05 -0.27 0.00 0.00 -1.53 0.00 0.00 36.38 34.53 1iny s VAL 445 CO -0.00 -0.09 0.06 -0.55 -3.33 0.00 0.00 175.10 171.19 1iny s SER 446 N -0.52 -0.03 0.09 3.54 0.15 0.35 -2.15 113.70 115.12 1iny s SER 446 Ca -0.03 0.04 0.02 0.00 0.70 0.00 0.00 55.95 56.68 1iny s SER 446 Cb -0.04 0.14 -0.04 0.00 -1.71 0.00 0.00 66.02 64.38 1iny s SER 446 CO -0.00 -0.08 -0.08 -0.04 1.20 0.00 0.00 173.24 174.24 1iny s MET 447 N -0.25 0.80 0.22 5.44 -1.94 -0.86 -0.54 119.30 122.17 1iny s MET 447 Ca -0.03 -1.20 0.03 0.00 -1.71 0.00 0.00 55.69 52.78 1iny s MET 447 Cb -0.02 -0.32 -0.05 0.00 2.01 0.00 0.00 34.83 36.45 1iny s MET 447 CO 0.00 0.02 -0.01 0.00 -0.01 0.00 0.00 175.02 175.03 1iny s SER 449 N -3.28 6.40 0.10 0.00 1.04 -0.24 -0.67 113.70 117.04 1iny s SER 449 Ca 0.27 1.25 0.03 0.00 0.48 0.00 0.00 55.95 57.98 1iny s SER 449 Cb 0.06 -2.38 -0.04 0.00 0.10 0.00 0.00 66.02 63.76 1iny s SER 449 CO 0.08 -0.61 -0.09 -0.55 0.98 0.00 0.00 173.24 173.05 1iny s SER 450 N -3.66 1.33 0.00 7.02 0.15 -0.05 -4.81 113.70 113.68 1iny s SER 450 Ca 0.53 -0.86 0.26 0.00 0.70 0.00 0.00 55.95 56.58 1iny s SER 450 Cb -0.10 0.03 0.68 0.00 -1.71 0.00 0.00 66.02 64.92 1iny s SER 450 CO 0.41 -0.32 1.53 0.35 1.20 0.00 0.00 173.24 176.41 1iny n THR 451 N 0.42 0.00 -3.08 6.45 -2.24 -1.26 -1.54 114.28 113.03 1iny n THR 451 Ca -0.15 -0.32 -0.20 0.00 -2.27 0.00 0.00 64.05 61.11 1iny n THR 451 Cb 0.58 0.86 0.05 0.00 -2.10 0.00 0.00 70.33 69.73 1iny n THR 451 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1iny s GLU 452 N -2.07 2.34 -0.75 -0.78 0.41 -1.26 -4.73 118.70 111.86 1iny s GLU 452 Ca 0.32 -1.63 -0.00 0.00 -0.41 0.00 0.00 54.97 53.25 1iny s GLU 452 Cb 0.20 -2.63 0.19 0.00 -1.78 0.00 0.00 34.13 30.11 1iny s GLU 452 CO 0.35 -0.81 0.59 -0.06 -0.49 0.00 0.00 175.26 174.84 1iny s PHE 453 N -2.65 3.63 0.67 1.61 0.08 -1.26 -3.70 117.98 116.37 1iny s PHE 453 Ca 0.60 -3.02 -0.11 0.00 0.12 0.00 0.00 56.93 54.52 1iny s PHE 453 Cb -0.06 -3.09 -0.01 0.00 -0.57 0.00 0.00 43.02 39.29 1iny s PHE 453 CO 0.38 -0.73 1.05 -0.51 -0.10 0.00 0.00 175.22 175.31 1iny s LEU 454 N -0.93 3.18 0.62 -0.37 1.43 -1.26 -5.06 118.68 116.30 1iny s LEU 454 Ca 0.23 1.58 -0.14 0.00 -1.03 0.00 0.00 54.13 54.77 1iny s LEU 454 Cb -0.12 -4.49 -0.02 0.00 0.03 0.00 0.00 46.19 41.59 1iny s LEU 454 CO -0.10 -1.28 1.06 -0.83 0.23 0.00 0.00 176.35 175.43 1iny s GLY 455 N -3.81 1.99 0.26 -3.19 0.00 -1.26 -4.93 107.32 96.38 1iny s GLY 455 Ca 0.58 0.30 0.08 0.00 0.00 0.00 0.00 44.72 45.68 1iny s GLY 455 CO 0.53 0.62 0.11 -0.86 0.00 0.00 0.00 173.10 173.50 1iny s GLN 456 N -4.35 2.64 0.04 2.90 -2.07 -1.26 -5.02 119.66 112.54 1iny s GLN 456 Ca 0.62 -1.22 -0.18 0.00 -1.82 0.00 0.00 55.36 52.75 1iny s GLN 456 Cb -0.15 -2.38 0.04 0.00 -1.09 0.00 0.00 33.01 29.42 1iny s GLN 456 CO 0.42 0.37 0.42 -0.46 -1.32 0.00 0.00 175.29 174.72 1iny s TRP 457 N -2.23 -0.28 -0.02 9.60 -0.00 -1.26 -5.12 118.94 119.63 1iny s TRP 457 Ca 0.33 0.25 -0.02 0.00 -0.00 0.00 0.00 56.10 56.65 1iny s TRP 457 Cb -0.07 0.23 -0.04 0.00 -0.00 0.00 0.00 33.47 33.59 1iny s TRP 457 CO 0.23 -0.58 0.16 0.16 -0.00 0.00 0.00 176.95 176.92 1iny s ASP 458 N -1.99 6.21 -0.61 5.86 -4.77 -1.26 -4.67 116.67 115.43 1iny s ASP 458 Ca -0.05 0.31 0.04 0.00 -3.30 0.00 0.00 52.55 49.55 1iny s ASP 458 Cb -0.01 -1.92 0.16 0.00 -1.09 0.00 0.00 42.92 40.06 1iny s ASP 458 CO -0.02 0.28 0.40 0.26 0.70 0.00 0.00 175.17 176.78 1iny s TRP 459 N -1.27 3.15 0.99 2.11 0.52 -0.24 -4.99 118.94 119.20 1iny s TRP 459 Ca 0.25 -3.15 -0.16 0.00 0.02 0.00 0.00 56.10 53.06 1iny s TRP 459 Cb -0.12 -2.53 0.20 0.00 -1.15 0.00 0.00 33.47 29.86 1iny s TRP 459 CO 0.17 -0.64 1.27 -1.25 0.02 0.00 0.00 176.95 176.52 1iny s PRO 460 N -0.90 0.46 -0.03 4.98 0.04 -1.26 -4.83 135.00 133.46 1iny s PRO 460 Ca 0.23 -0.28 -0.24 0.00 0.04 0.00 0.00 61.00 60.74 1iny s PRO 460 Cb -0.11 -1.81 -0.21 0.00 0.04 0.00 0.00 34.50 32.41 1iny s PRO 460 CO -0.11 -2.55 1.15 0.22 0.04 0.00 0.00 177.00 175.74 1iny h ASP 461 N -1.74 0.18 0.00 6.66 3.58 -1.96 -3.49 116.42 119.65 1iny h ASP 461 Ca -0.45 -0.64 0.00 0.00 0.42 0.00 0.00 57.03 56.36 1iny h ASP 461 Cb 1.26 -0.05 0.00 0.00 1.72 0.00 0.00 39.33 42.25 1iny h ASP 461 CO 0.41 0.80 0.00 0.61 -2.88 0.00 0.00 179.24 178.17 1iny n GLY 462 N 0.66 2.89 3.71 -0.78 0.00 -1.26 -4.77 105.19 105.65 1iny n GLY 462 Ca -0.09 -0.92 -0.39 0.00 0.00 0.00 0.00 46.02 44.62 1iny n GLY 462 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iny n ALA 463 N 0.00 1.29 -2.96 4.61 0.00 -1.26 -4.98 120.51 117.21 1iny n ALA 463 Ca 0.00 0.16 -0.41 0.00 0.00 0.00 0.00 53.44 53.19 1iny n ALA 463 Cb 0.00 -2.29 -0.10 0.00 0.00 0.00 0.00 19.45 17.06 1iny n ALA 463 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1iny s LYS 464 N -2.62 2.77 0.32 0.00 1.02 -1.26 -4.97 119.74 115.00 1iny s LYS 464 Ca 0.68 -1.23 0.07 0.00 0.02 0.00 0.00 55.97 55.51 1iny s LYS 464 Cb -0.45 -3.80 0.75 0.00 -0.52 0.00 0.00 37.83 33.81 1iny s LYS 464 CO 0.52 -0.82 1.80 0.82 -0.92 0.00 0.00 175.35 176.75 1iny h ILE 465 N 5.92 0.75 0.00 2.17 1.08 -2.00 -1.62 117.51 123.80 1iny h ILE 465 Ca -0.25 -0.26 0.00 0.00 -0.39 0.00 0.00 64.86 63.96 1iny h ILE 465 Cb 1.10 -0.08 0.00 0.00 -3.07 0.00 0.00 36.82 34.77 1iny h ILE 465 CO 0.72 0.14 0.00 -1.84 -0.69 0.00 0.00 178.15 176.48 1iny n GLU 466 N -4.70 0.14 0.00 2.37 0.00 -1.26 -0.57 120.64 116.63 1iny n GLU 466 Ca 0.22 0.64 0.15 0.00 0.00 0.00 0.00 57.16 58.16 1iny n GLU 466 Cb 0.55 -1.97 0.71 0.00 0.00 0.00 0.00 31.44 30.72 1iny n GLU 466 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.13 177.79 1iny n TYR 467 N -2.28 0.00 0.61 -1.84 4.01 -0.61 -3.06 117.16 113.99 1iny n TYR 467 Ca -0.01 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.83 1iny n TYR 467 Cb 0.04 -0.29 0.13 0.00 -0.31 0.00 0.00 39.34 38.91 1iny n TYR 467 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1iny n PHE 468 N -1.26 0.19 1.16 -0.72 3.01 0.27 -5.12 117.46 114.99 1iny n PHE 468 Ca 0.13 -0.11 0.13 0.00 1.01 0.00 0.00 57.45 58.61 1iny n PHE 468 Cb 0.26 -0.00 0.23 0.00 -0.01 0.00 0.00 39.48 39.96 1iny n PHE 468 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05