#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ij1 s PHE 82 N 0.00 3.92 -0.01 0.66 0.08 -1.26 -4.50 117.98 116.87 3ij1 s PHE 82 Ca 0.00 1.86 0.06 0.00 0.12 0.00 0.00 56.93 58.96 3ij1 s PHE 82 Cb 0.00 -2.99 -0.02 0.00 -0.57 0.00 0.00 43.02 39.44 3ij1 s PHE 82 CO 0.00 0.37 -0.18 -1.59 -0.10 0.00 0.00 175.22 173.71 3ij1 s LYS 83 N -0.74 1.47 -0.19 0.44 -2.85 -0.09 -4.92 119.74 112.86 3ij1 s LYS 83 Ca 0.43 -0.69 -0.29 0.00 -1.00 0.00 0.00 55.97 54.42 3ij1 s LYS 83 Cb -0.25 -1.43 -0.01 0.00 -2.06 0.00 0.00 37.83 34.08 3ij1 s LYS 83 CO 0.31 0.39 1.18 0.00 0.10 0.00 0.00 175.35 177.33 3ij1 n VAL 85 N 5.37 0.00 -3.60 0.00 0.24 -0.07 -4.96 118.33 115.31 3ij1 n VAL 85 Ca 0.13 -0.28 -0.05 0.00 -2.04 0.00 0.00 64.34 62.11 3ij1 n VAL 85 Cb 0.45 0.45 -0.02 0.00 -1.47 0.00 0.00 33.84 33.26 3ij1 n VAL 85 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3ij1 s ASN 86 N -3.24 -0.23 0.10 -1.34 2.47 -1.22 -4.63 114.94 106.86 3ij1 s ASN 86 Ca -0.02 -0.11 -0.15 0.00 0.42 0.00 0.00 52.86 53.00 3ij1 s ASN 86 Cb 0.10 0.32 0.03 0.00 -1.45 0.00 0.00 41.25 40.25 3ij1 s ASN 86 CO 0.61 -0.55 0.36 -0.94 -3.72 0.00 0.00 177.10 172.86 3ij1 s SER 87 N -2.59 -0.17 0.28 -4.21 1.04 -1.26 -1.32 113.70 105.47 3ij1 s SER 87 Ca 0.09 -0.33 -0.10 0.00 0.48 0.00 0.00 55.95 56.10 3ij1 s SER 87 Cb -0.00 0.44 0.00 0.00 0.10 0.00 0.00 66.02 66.56 3ij1 s SER 87 CO -0.05 -0.80 0.49 -1.48 0.98 0.00 0.00 173.24 172.39 3ij1 s LEU 88 N -2.67 0.53 -0.03 2.42 0.05 -0.39 -4.96 118.68 113.63 3ij1 s LEU 88 Ca 0.02 -1.13 0.03 0.00 0.05 0.00 0.00 54.13 53.10 3ij1 s LEU 88 Cb 0.02 1.71 0.00 0.00 -2.05 0.00 0.00 46.19 45.87 3ij1 s LEU 88 CO -0.10 -1.22 -0.11 -0.75 -0.55 0.00 0.00 176.35 173.62 3ij1 s LYS 89 N -3.60 1.15 0.35 1.48 2.20 -1.26 0.56 119.74 120.61 3ij1 s LYS 89 Ca 0.25 -0.39 -0.17 0.00 -0.36 0.00 0.00 55.97 55.30 3ij1 s LYS 89 Cb -0.01 -1.06 -0.09 0.00 -1.51 0.00 0.00 37.83 35.16 3ij1 s LYS 89 CO 0.13 0.16 0.79 -1.21 -0.36 0.00 0.00 175.35 174.86 3ij1 s GLU 90 N 0.10 4.08 0.18 4.03 2.02 -0.10 -4.96 118.70 124.04 3ij1 s GLU 90 Ca -0.02 0.80 0.20 0.00 0.02 0.00 0.00 54.97 55.98 3ij1 s GLU 90 Cb -0.09 -2.39 0.87 0.00 0.10 0.00 0.00 34.13 32.62 3ij1 s GLU 90 CO 0.01 0.12 1.63 -0.40 0.02 0.00 0.00 175.26 176.63 3ij1 n ASP 91 N -0.38 0.46 0.12 -0.19 5.68 -1.26 -2.95 116.55 118.03 3ij1 n ASP 91 Ca 0.04 0.62 0.12 0.00 -0.50 0.00 0.00 54.79 55.07 3ij1 n ASP 91 Cb 0.53 -0.71 0.28 0.00 -1.14 0.00 0.00 41.12 40.08 3ij1 n ASP 91 CO 0.00 0.00 0.00 1.12 -1.33 0.00 0.00 177.20 176.99 3ij1 h HIS 92 N 0.00 0.00 -0.94 2.11 2.07 -1.96 -3.47 115.15 112.96 3ij1 h HIS 92 Ca 0.00 0.00 -0.29 0.00 -2.85 0.00 0.00 60.37 57.23 3ij1 h HIS 92 Cb 0.31 0.00 -0.11 0.00 2.57 0.00 0.00 27.41 30.18 3ij1 h HIS 92 CO 0.00 0.00 -0.26 0.09 -3.07 0.00 0.00 177.93 174.69 3ij1 n ASN 93 N -2.44 -4.71 -4.97 3.10 3.02 -1.15 -4.99 115.26 103.12 3ij1 n ASN 93 Ca 0.04 0.35 -0.21 0.00 -0.03 0.00 0.00 54.58 54.73 3ij1 n ASN 93 Cb 0.46 -3.94 -0.01 0.00 -0.61 0.00 0.00 39.78 35.68 3ij1 n ASN 93 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3ij1 s GLN 94 N -3.14 3.29 0.33 3.52 -1.52 -1.26 -4.61 119.66 116.28 3ij1 s GLN 94 Ca 0.00 -0.69 -0.29 0.00 -1.95 0.00 0.00 55.36 52.44 3ij1 s GLN 94 Cb 0.00 -2.76 -0.12 0.00 -0.22 0.00 0.00 33.01 29.91 3ij1 s GLN 94 CO 0.00 0.13 1.43 -2.30 -0.25 0.00 0.00 175.29 174.30 3ij1 n PRO 95 N -1.69 2.41 -2.96 2.91 -0.02 -1.08 -2.97 135.00 131.61 3ij1 n PRO 95 Ca -0.04 0.85 -0.43 0.00 -2.02 0.00 0.00 63.50 61.86 3ij1 n PRO 95 Cb 0.57 -2.53 -0.05 0.00 -0.02 0.00 0.00 33.50 31.47 3ij1 n PRO 95 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ij1 s LEU 96 N -1.16 4.29 0.22 2.45 1.43 -0.58 -3.69 118.68 121.64 3ij1 s LEU 96 Ca 0.58 -0.25 0.24 0.00 -1.03 0.00 0.00 54.13 53.67 3ij1 s LEU 96 Cb -0.53 -2.88 0.33 0.00 0.03 0.00 0.00 46.19 43.14 3ij1 s LEU 96 CO 0.59 -0.98 1.38 -0.26 0.23 0.00 0.00 176.35 177.31 3ij1 h PHE 97 N 9.05 0.00 -3.04 0.29 0.04 -1.19 -3.38 116.94 118.73 3ij1 h PHE 97 Ca -0.25 0.00 -0.12 0.00 2.80 0.00 0.00 57.97 60.40 3ij1 h PHE 97 Cb 1.08 0.00 -0.21 0.00 2.20 0.00 0.00 35.95 39.03 3ij1 h PHE 97 CO 0.82 0.00 -0.29 0.20 -0.60 0.00 0.00 178.31 178.44 3ij1 s GLY 98 N -3.94 -0.16 -0.07 -1.45 0.00 -1.16 -4.55 107.32 96.00 3ij1 s GLY 98 Ca 0.05 0.40 -0.06 0.00 0.00 0.00 0.00 44.72 45.12 3ij1 s GLY 98 CO 0.71 0.21 0.18 0.54 0.00 0.00 0.00 173.10 174.74 3ij1 s VAL 99 N -1.11 -0.01 -0.11 1.40 0.11 -1.26 -1.34 120.40 118.08 3ij1 s VAL 99 Ca -0.12 0.04 -0.05 0.00 -2.93 0.00 0.00 61.98 58.93 3ij1 s VAL 99 Cb -0.05 -0.27 0.06 0.00 -1.53 0.00 0.00 36.38 34.59 3ij1 s VAL 99 CO 0.04 0.02 0.24 -1.10 -3.33 0.00 0.00 175.10 170.96 3ij1 s GLN 100 N 0.40 0.14 0.46 1.54 -1.52 -0.56 -4.59 119.66 115.52 3ij1 s GLN 100 Ca -0.02 0.65 -0.24 0.00 -1.95 0.00 0.00 55.36 53.80 3ij1 s GLN 100 Cb -0.04 -0.10 -0.07 0.00 -0.22 0.00 0.00 33.01 32.58 3ij1 s GLN 100 CO -0.02 -0.26 1.26 -0.06 -0.25 0.00 0.00 175.29 175.96 3ij1 s PHE 101 N 2.08 2.73 -0.66 0.91 0.08 -1.26 -0.51 117.98 121.34 3ij1 s PHE 101 Ca -0.01 1.46 -0.28 0.00 0.12 0.00 0.00 56.93 58.22 3ij1 s PHE 101 Cb -0.12 -3.58 0.03 0.00 -0.57 0.00 0.00 43.02 38.79 3ij1 s PHE 101 CO -0.08 -2.02 1.23 1.21 -0.10 0.00 0.00 175.22 175.46 3ij1 s ASN 102 N -1.04 6.29 0.00 1.36 2.47 0.67 -4.86 114.94 119.84 3ij1 s ASN 102 Ca 0.63 -0.20 0.28 0.00 0.42 0.00 0.00 52.86 53.99 3ij1 s ASN 102 Cb -0.35 -2.55 1.56 0.00 -1.45 0.00 0.00 41.25 38.46 3ij1 s ASN 102 CO 0.43 -1.67 2.02 0.79 -3.72 0.00 0.00 177.10 174.95 3ij1 n TRP 103 N 8.92 0.01 -0.65 0.43 8.01 -1.26 -3.04 117.44 129.86 3ij1 n TRP 103 Ca 0.05 -0.00 0.08 0.00 -1.31 0.00 0.00 57.50 56.32 3ij1 n TRP 103 Cb 0.49 0.00 0.29 0.00 -2.01 0.00 0.00 31.31 30.08 3ij1 n TRP 103 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 3ij1 n HIS 104 N -0.76 1.13 -2.22 -5.99 8.25 -1.26 -5.01 115.22 109.35 3ij1 n HIS 104 Ca 0.21 -0.67 -0.40 0.00 -0.26 0.00 0.00 57.72 56.60 3ij1 n HIS 104 Cb 0.13 -0.23 -0.02 0.00 1.12 0.00 0.00 29.99 30.99 3ij1 n HIS 104 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3ij1 s SER 105 N -1.22 6.71 0.65 0.41 1.04 -1.17 -4.80 113.70 115.32 3ij1 s SER 105 Ca 0.42 2.50 -0.14 0.00 0.48 0.00 0.00 55.95 59.21 3ij1 s SER 105 Cb 0.29 -2.63 -0.01 0.00 0.10 0.00 0.00 66.02 63.77 3ij1 s SER 105 CO 0.17 -0.56 1.08 -0.54 0.98 0.00 0.00 173.24 174.38 3ij1 s LYS 106 N -1.96 2.96 0.21 4.02 -0.14 -1.26 -4.95 119.74 118.63 3ij1 s LYS 106 Ca 0.52 1.26 -0.32 0.00 -1.36 0.00 0.00 55.97 56.06 3ij1 s LYS 106 Cb -0.35 -1.98 -0.13 0.00 -1.68 0.00 0.00 37.83 33.69 3ij1 s LYS 106 CO 0.46 -1.10 1.62 -1.91 -0.76 0.00 0.00 175.35 173.66 3ij1 n GLU 107 N -2.44 2.49 -0.09 1.68 2.13 -1.26 -1.84 120.64 121.31 3ij1 n GLU 107 Ca 0.09 0.89 0.00 0.00 0.66 0.00 0.00 57.16 58.81 3ij1 n GLU 107 Cb 0.53 -2.69 0.00 0.00 0.27 0.00 0.00 31.44 29.55 3ij1 n GLU 107 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 3ij1 n GLY 108 N 3.26 2.28 3.82 8.31 0.00 -1.26 -5.03 105.19 116.57 3ij1 n GLY 108 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 3ij1 n GLY 108 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3ij1 s ASP 109 N -3.56 6.99 0.92 1.61 1.01 -0.77 -5.06 116.67 117.82 3ij1 s ASP 109 Ca 0.00 1.48 -0.11 0.00 0.71 0.00 0.00 52.55 54.63 3ij1 s ASP 109 Cb 0.00 -2.45 0.15 0.00 1.01 0.00 0.00 42.92 41.63 3ij1 s ASP 109 CO 0.00 -0.12 1.10 -2.84 0.21 0.00 0.00 175.17 173.52 3ij1 s PRO 110 N -2.49 1.00 0.09 8.23 0.02 -1.26 -4.85 135.00 135.75 3ij1 s PRO 110 Ca 0.50 1.14 -0.30 0.00 0.02 0.00 0.00 61.00 62.36 3ij1 s PRO 110 Cb -0.14 -1.76 -0.06 0.00 0.02 0.00 0.00 34.50 32.57 3ij1 s PRO 110 CO 0.19 -2.51 1.08 -0.51 -0.33 0.00 0.00 177.00 174.92 3ij1 s LEU 111 N -6.46 4.43 -0.02 -5.54 1.43 -1.26 -4.92 118.68 106.33 3ij1 s LEU 111 Ca 0.65 1.93 0.05 0.00 -1.03 0.00 0.00 54.13 55.73 3ij1 s LEU 111 Cb -0.21 -3.59 -0.01 0.00 0.03 0.00 0.00 46.19 42.42 3ij1 s LEU 111 CO 0.58 -0.28 -0.18 -0.69 0.23 0.00 0.00 176.35 176.01 3ij1 s VAL 112 N 0.48 1.42 0.10 -1.59 1.01 -1.26 -0.60 120.40 119.96 3ij1 s VAL 112 Ca 0.52 -0.75 0.05 0.00 0.00 0.00 0.00 61.98 61.80 3ij1 s VAL 112 Cb -0.27 -1.19 -0.03 0.00 0.00 0.00 0.00 36.38 34.89 3ij1 s VAL 112 CO 0.31 0.40 -0.13 0.72 0.00 0.00 0.00 175.10 176.41 3ij1 s PHE 113 N -0.30 1.21 -0.00 5.22 -0.12 -0.72 -0.23 117.98 123.04 3ij1 s PHE 113 Ca 0.04 -0.55 0.01 0.00 -0.05 0.00 0.00 56.93 56.38 3ij1 s PHE 113 Cb -0.08 -0.66 -0.04 0.00 -0.63 0.00 0.00 43.02 41.61 3ij1 s PHE 113 CO 0.00 0.07 0.01 0.00 -0.05 0.00 0.00 175.22 175.24 3ij1 s ALA 114 N -1.92 3.31 0.06 1.99 0.00 0.33 -1.54 121.76 123.98 3ij1 s ALA 114 Ca 0.04 -0.95 0.08 0.00 0.00 0.00 0.00 51.96 51.13 3ij1 s ALA 114 Cb -0.06 -1.36 -0.03 0.00 0.00 0.00 0.00 23.12 21.67 3ij1 s ALA 114 CO 0.02 0.65 -0.21 0.95 0.00 0.00 0.00 175.76 177.17 3ij1 s THR 115 N -1.10 2.56 -0.03 0.00 -4.23 -0.15 -1.50 115.64 111.19 3ij1 s THR 115 Ca 0.20 -1.33 0.04 0.00 -1.18 0.00 0.00 61.69 59.42 3ij1 s THR 115 Cb -0.12 -2.07 -0.00 0.00 1.34 0.00 0.00 72.50 71.65 3ij1 s THR 115 CO 0.11 0.30 -0.15 0.68 -0.54 0.00 0.00 174.62 175.01 3ij1 s VAL 116 N -0.92 1.27 0.00 2.29 -7.23 -0.45 -1.31 120.40 114.05 3ij1 s VAL 116 Ca 0.14 -0.64 0.00 0.00 -1.81 0.00 0.00 61.98 59.67 3ij1 s VAL 116 Cb -0.10 -1.08 0.00 0.00 0.56 0.00 0.00 36.38 35.75 3ij1 s VAL 116 CO 0.05 0.37 0.00 0.61 -0.31 0.00 0.00 175.10 175.82 3ij1 n GLY 117 N 3.03 0.92 7.00 2.32 0.00 -1.07 -0.72 105.19 116.68 3ij1 n GLY 117 Ca -0.17 -0.68 0.00 0.00 0.00 0.00 0.00 46.02 45.17 3ij1 n GLY 117 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3ij1 n SER 118 N 0.00 0.00 -2.20 1.61 2.88 -1.24 -1.64 113.62 113.03 3ij1 n SER 118 Ca 0.00 0.00 -0.25 0.00 -1.33 0.00 0.00 58.87 57.29 3ij1 n SER 118 Cb 0.00 0.00 0.15 0.00 -0.75 0.00 0.00 64.21 63.61 3ij1 n SER 118 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3ij1 n ASN 119 N -1.23 4.73 -4.19 -3.46 6.94 -1.24 -1.28 115.26 115.54 3ij1 n ASN 119 Ca 0.00 -3.58 -0.11 0.00 -0.02 0.00 0.00 54.58 50.87 3ij1 n ASN 119 Cb 0.00 -0.87 -0.10 0.00 -2.36 0.00 0.00 39.78 36.45 3ij1 n ASN 119 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3ij1 s ARG 120 N -3.26 0.91 -0.05 -3.83 1.70 -0.65 -1.36 118.95 112.40 3ij1 s ARG 120 Ca 0.56 -1.40 0.04 0.00 -0.47 0.00 0.00 55.73 54.46 3ij1 s ARG 120 Cb 0.46 -0.17 -0.00 0.00 -0.57 0.00 0.00 34.95 34.67 3ij1 s ARG 120 CO 0.07 -0.07 -0.17 0.54 -1.08 0.00 0.00 175.30 174.59 3ij1 s VAL 121 N -3.68 1.46 -0.01 4.99 0.11 -0.31 -2.60 120.40 120.37 3ij1 s VAL 121 Ca 0.16 -0.72 0.07 0.00 -2.93 0.00 0.00 61.98 58.56 3ij1 s VAL 121 Cb 0.06 -1.27 -0.02 0.00 -1.53 0.00 0.00 36.38 33.62 3ij1 s VAL 121 CO -0.02 0.42 -0.21 -0.89 -3.33 0.00 0.00 175.10 171.07 3ij1 s THR 122 N 0.17 1.66 -0.11 5.04 2.01 -0.43 -0.90 115.64 123.08 3ij1 s THR 122 Ca -0.07 -0.95 -0.04 0.00 0.31 0.00 0.00 61.69 60.95 3ij1 s THR 122 Cb -0.13 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 70.96 3ij1 s THR 122 CO 0.03 0.43 0.03 -0.76 -0.69 0.00 0.00 174.62 173.66 3ij1 s LEU 123 N -0.60 3.74 0.07 4.42 1.02 -0.90 -0.97 118.68 125.46 3ij1 s LEU 123 Ca 0.08 0.19 0.04 0.00 0.02 0.00 0.00 54.13 54.46 3ij1 s LEU 123 Cb -0.08 -1.88 -0.03 0.00 0.02 0.00 0.00 46.19 44.22 3ij1 s LEU 123 CO -0.00 0.35 -0.13 -0.31 0.02 0.00 0.00 176.35 176.28 3ij1 s TYR 124 N -0.71 1.09 -0.09 0.29 2.02 -0.59 -1.59 117.35 117.78 3ij1 s TYR 124 Ca 0.12 -0.48 0.02 0.00 -0.37 0.00 0.00 57.07 56.36 3ij1 s TYR 124 Cb -0.12 -0.62 -0.02 0.00 -0.40 0.00 0.00 41.96 40.81 3ij1 s TYR 124 CO 0.02 0.03 -0.16 -2.00 -1.57 0.00 0.00 175.55 171.87 3ij1 s GLU 125 N -1.76 2.91 -0.14 -0.62 2.12 0.05 -1.75 118.70 119.50 3ij1 s GLU 125 Ca -0.03 -0.73 -0.21 0.00 0.36 0.00 0.00 54.97 54.36 3ij1 s GLU 125 Cb -0.10 -2.45 -0.03 0.00 0.26 0.00 0.00 34.13 31.81 3ij1 s GLU 125 CO 0.02 0.39 0.61 0.00 -0.54 0.00 0.00 175.26 175.74 3ij1 s HIS 127 N 1.28 1.84 1.02 0.00 3.76 -0.31 -4.29 115.29 118.58 3ij1 s HIS 127 Ca 0.30 -1.14 -0.12 0.00 -0.15 0.00 0.00 55.06 53.96 3ij1 s HIS 127 Cb -0.16 -1.20 0.20 0.00 1.11 0.00 0.00 32.58 32.53 3ij1 s HIS 127 CO 0.12 -0.17 1.08 -1.54 -0.85 0.00 0.00 174.74 173.39 3ij1 s SER 128 N -3.55 2.21 -1.55 1.40 1.04 -1.26 -2.52 113.70 109.48 3ij1 s SER 128 Ca 0.29 1.73 -0.02 0.00 0.48 0.00 0.00 55.95 58.43 3ij1 s SER 128 Cb 0.05 -2.36 0.01 0.00 0.10 0.00 0.00 66.02 63.82 3ij1 s SER 128 CO 0.14 -3.47 0.24 0.00 0.98 0.00 0.00 173.24 171.13 3ij1 n GLN 129 N -4.44 -2.95 -1.00 4.02 3.00 -1.26 -2.27 117.38 112.47 3ij1 n GLN 129 Ca 0.07 0.87 0.00 0.00 -0.01 0.00 0.00 57.00 57.93 3ij1 n GLN 129 Cb 0.54 -5.59 0.00 0.00 0.00 0.00 0.00 30.24 25.18 3ij1 n GLN 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3ij1 n GLY 130 N -1.16 0.29 3.72 1.08 0.00 -1.23 -4.95 105.19 102.93 3ij1 n GLY 130 Ca -0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.43 3ij1 n GLY 130 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ij1 s GLU 131 N -0.86 4.22 -0.49 1.61 2.12 -0.96 -4.56 118.70 119.78 3ij1 s GLU 131 Ca 0.00 2.34 -0.02 0.00 0.36 0.00 0.00 54.97 57.65 3ij1 s GLU 131 Cb 0.00 -3.19 0.13 0.00 0.26 0.00 0.00 34.13 31.33 3ij1 s GLU 131 CO 0.00 -0.61 0.29 0.42 -0.54 0.00 0.00 175.26 174.82 3ij1 s ILE 132 N 1.26 3.38 -0.27 -3.70 1.01 -1.26 -1.16 121.20 120.45 3ij1 s ILE 132 Ca 0.70 -2.47 -0.27 0.00 0.00 0.00 0.00 60.65 58.61 3ij1 s ILE 132 Cb -0.43 -3.28 0.01 0.00 0.01 0.00 0.00 42.46 38.77 3ij1 s ILE 132 CO 0.31 -0.76 0.94 -0.60 0.00 0.00 0.00 174.94 174.82 3ij1 s ARG 133 N 0.60 4.13 0.09 2.79 3.52 0.38 -4.85 118.95 125.61 3ij1 s ARG 133 Ca 0.12 1.01 -0.31 0.00 -0.13 0.00 0.00 55.73 56.42 3ij1 s ARG 133 Cb -0.22 -3.68 -0.07 0.00 -1.56 0.00 0.00 34.95 29.41 3ij1 s ARG 133 CO -0.04 -0.67 1.40 -1.17 -0.81 0.00 0.00 175.30 174.00 3ij1 s LEU 134 N 3.16 4.36 0.00 -0.88 2.96 -1.26 -0.77 118.68 126.25 3ij1 s LEU 134 Ca 0.39 2.29 0.00 0.00 -0.22 0.00 0.00 54.13 56.59 3ij1 s LEU 134 Cb -0.14 -3.58 0.00 0.00 0.50 0.00 0.00 46.19 42.97 3ij1 s LEU 134 CO 0.10 -0.67 0.00 0.18 -1.32 0.00 0.00 176.35 174.64 3ij1 n LEU 135 N 4.25 0.00 -3.66 -0.68 4.77 -0.62 -4.95 117.00 116.10 3ij1 n LEU 135 Ca 0.12 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.95 3ij1 n LEU 135 Cb 0.43 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.44 3ij1 n LEU 135 CO 0.59 0.00 0.19 -1.58 -1.33 0.00 0.00 177.39 175.25 3ij1 s GLN 136 N 0.00 0.84 0.17 3.23 0.74 -1.25 -5.01 119.66 118.39 3ij1 s GLN 136 Ca 0.00 -0.07 0.08 0.00 0.05 0.00 0.00 55.36 55.42 3ij1 s GLN 136 Cb 0.00 0.38 -0.04 0.00 1.10 0.00 0.00 33.01 34.45 3ij1 s GLN 136 CO 0.00 -0.26 -0.06 -1.12 -0.55 0.00 0.00 175.29 173.31 3ij1 s SER 137 N -1.39 4.47 -0.21 6.67 0.01 -1.26 -2.11 113.70 119.87 3ij1 s SER 137 Ca -0.11 -0.49 -0.08 0.00 1.31 0.00 0.00 55.95 56.57 3ij1 s SER 137 Cb -0.03 -0.85 -0.04 0.00 0.21 0.00 0.00 66.02 65.32 3ij1 s SER 137 CO 0.05 0.10 0.09 -0.47 0.41 0.00 0.00 173.24 173.42 3ij1 s TYR 138 N -1.68 3.24 -0.17 2.43 5.04 -0.08 -4.93 117.35 121.20 3ij1 s TYR 138 Ca 0.26 0.03 -0.01 0.00 -2.44 0.00 0.00 57.07 54.90 3ij1 s TYR 138 Cb -0.09 -2.16 -0.01 0.00 0.35 0.00 0.00 41.96 40.05 3ij1 s TYR 138 CO 0.16 0.04 -0.11 0.08 -1.34 0.00 0.00 175.55 174.38 3ij1 s VAL 139 N 0.78 2.99 0.39 3.14 1.01 -1.26 -1.16 120.40 126.28 3ij1 s VAL 139 Ca 0.05 -0.65 -0.27 0.00 0.00 0.00 0.00 61.98 61.11 3ij1 s VAL 139 Cb -0.13 -2.30 -0.09 0.00 0.00 0.00 0.00 36.38 33.86 3ij1 s VAL 139 CO 0.02 0.49 1.32 -0.62 0.00 0.00 0.00 175.10 176.31 3ij1 s ASP 140 N 0.95 6.41 0.46 3.32 -1.08 -0.47 -4.91 116.67 121.36 3ij1 s ASP 140 Ca -0.02 2.70 0.14 0.00 -0.52 0.00 0.00 52.55 54.84 3ij1 s ASP 140 Cb -0.15 -2.64 1.09 0.00 -1.46 0.00 0.00 42.92 39.75 3ij1 s ASP 140 CO -0.01 -0.78 2.05 0.00 0.52 0.00 0.00 175.17 176.95 3ij1 h ALA 141 N 2.86 1.97 -2.14 3.66 0.00 -1.99 -3.39 119.26 120.23 3ij1 h ALA 141 Ca -0.50 -0.01 -0.61 0.00 0.00 0.00 0.00 54.91 53.79 3ij1 h ALA 141 Cb 1.24 -0.07 -0.11 0.00 0.00 0.00 0.00 17.79 18.85 3ij1 h ALA 141 CO 0.63 -0.04 0.39 0.34 0.00 0.00 0.00 179.25 180.58 3ij1 s ASP 142 N -6.61 6.54 0.62 0.00 -1.08 -1.26 -4.92 116.67 109.96 3ij1 s ASP 142 Ca -0.07 0.31 0.39 0.00 -0.52 0.00 0.00 52.55 52.66 3ij1 s ASP 142 Cb 0.18 -2.40 2.02 0.00 -1.46 0.00 0.00 42.92 41.26 3ij1 s ASP 142 CO 0.72 -0.77 2.24 0.00 0.52 0.00 0.00 175.17 177.88 3ij1 h ALA 143 N 8.55 1.07 -0.00 3.66 0.00 -1.98 -2.24 119.26 128.32 3ij1 h ALA 143 Ca -0.25 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.65 3ij1 h ALA 143 Cb 1.09 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3ij1 h ALA 143 CO 0.92 0.02 -0.41 -0.25 0.00 0.00 0.00 179.25 179.53 3ij1 n ASP 144 N -3.20 0.43 -4.76 0.00 8.00 -1.26 -4.80 116.55 110.96 3ij1 n ASP 144 Ca -0.02 -0.14 -0.39 0.00 0.71 0.00 0.00 54.79 54.95 3ij1 n ASP 144 Cb 0.15 0.12 0.03 0.00 -0.02 0.00 0.00 41.12 41.39 3ij1 n ASP 144 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3ij1 s GLU 145 N -2.98 3.41 -0.19 -1.24 2.56 -0.84 -4.91 118.70 114.50 3ij1 s GLU 145 Ca 0.12 2.21 -0.04 0.00 0.00 0.00 0.00 54.97 57.27 3ij1 s GLU 145 Cb 0.18 -2.41 0.06 0.00 2.00 0.00 0.00 34.13 33.96 3ij1 s GLU 145 CO 0.67 -0.97 0.06 1.21 -0.56 0.00 0.00 175.26 175.67 3ij1 s ASN 146 N -0.88 2.78 0.08 -1.70 3.84 -1.26 -3.64 114.94 114.16 3ij1 s ASN 146 Ca 0.67 -0.80 -0.30 0.00 0.21 0.00 0.00 52.86 52.64 3ij1 s ASN 146 Cb -0.40 -0.47 -0.06 0.00 -0.55 0.00 0.00 41.25 39.78 3ij1 s ASN 146 CO 0.48 -0.33 1.19 -0.36 -2.79 0.00 0.00 177.10 175.29 3ij1 s PHE 147 N 1.96 3.45 -0.15 0.43 0.08 -0.41 -0.91 117.98 122.44 3ij1 s PHE 147 Ca 0.01 1.34 0.10 0.00 0.12 0.00 0.00 56.93 58.50 3ij1 s PHE 147 Cb -0.17 -3.41 -0.16 0.00 -0.57 0.00 0.00 43.02 38.71 3ij1 s PHE 147 CO -0.10 -1.21 0.00 0.66 -0.10 0.00 0.00 175.22 174.47 3ij1 n TYR 148 N 3.72 0.00 -3.84 0.36 4.01 -0.03 -3.72 117.16 117.66 3ij1 n TYR 148 Ca 0.08 0.00 -0.12 0.00 -0.16 0.00 0.00 57.90 57.71 3ij1 n TYR 148 Cb 0.46 -0.70 -0.09 0.00 -0.31 0.00 0.00 39.34 38.70 3ij1 n TYR 148 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 3ij1 s THR 149 N -2.35 0.08 0.13 -0.72 -1.32 -0.76 -3.80 115.64 106.90 3ij1 s THR 149 Ca -0.11 -0.68 -0.05 0.00 -1.21 0.00 0.00 61.69 59.64 3ij1 s THR 149 Cb 0.05 -0.55 -0.02 0.00 -1.51 0.00 0.00 72.50 70.46 3ij1 s THR 149 CO 0.55 -0.37 0.15 0.00 -2.21 0.00 0.00 174.62 172.74 3ij1 s ALA 151 N -3.98 -1.57 0.10 0.00 0.00 -0.34 -4.81 121.76 111.16 3ij1 s ALA 151 Ca 0.17 1.82 -0.09 0.00 0.00 0.00 0.00 51.96 53.86 3ij1 s ALA 151 Cb 0.06 -1.06 -0.06 0.00 0.00 0.00 0.00 23.12 22.05 3ij1 s ALA 151 CO -0.02 -0.30 0.42 -1.58 0.00 0.00 0.00 175.76 174.27 3ij1 s TRP 152 N 0.45 3.56 0.00 0.00 0.52 -1.26 -0.86 118.94 121.36 3ij1 s TRP 152 Ca -0.01 0.78 0.00 0.00 0.02 0.00 0.00 56.10 56.89 3ij1 s TRP 152 Cb -0.05 -2.16 0.00 0.00 -1.15 0.00 0.00 33.47 30.12 3ij1 s TRP 152 CO -0.01 0.49 0.00 -2.37 0.02 0.00 0.00 176.95 175.08 3ij1 n THR 153 N 0.73 0.00 -4.08 2.01 5.66 -0.01 -4.82 114.28 113.76 3ij1 n THR 153 Ca -0.07 0.00 -0.10 0.00 -3.05 0.00 0.00 64.05 60.83 3ij1 n THR 153 Cb 0.52 0.00 -0.11 0.00 -1.55 0.00 0.00 70.33 69.20 3ij1 n THR 153 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 3ij1 s TYR 154 N -2.99 0.63 -0.01 1.09 1.13 -1.26 -0.16 117.35 115.78 3ij1 s TYR 154 Ca 0.00 -0.75 -0.30 0.00 -1.41 0.00 0.00 57.07 54.61 3ij1 s TYR 154 Cb 0.00 -0.39 -0.06 0.00 -1.10 0.00 0.00 41.96 40.40 3ij1 s TYR 154 CO 0.00 -0.18 1.64 0.34 -2.51 0.00 0.00 175.55 174.83 3ij1 s ASP 155 N -2.27 6.66 0.19 -0.18 -1.08 0.95 -4.78 116.67 116.16 3ij1 s ASP 155 Ca -0.01 2.31 0.21 0.00 -0.52 0.00 0.00 52.55 54.54 3ij1 s ASP 155 Cb -0.02 -2.55 0.88 0.00 -1.46 0.00 0.00 42.92 39.78 3ij1 s ASP 155 CO -0.04 -0.90 1.64 -1.54 0.52 0.00 0.00 175.17 174.85 3ij1 n SER 156 N 6.50 0.49 -0.11 -0.34 3.41 -1.26 -0.51 113.62 121.79 3ij1 n SER 156 Ca 0.16 0.63 -0.19 0.00 -0.26 0.00 0.00 58.87 59.21 3ij1 n SER 156 Cb 0.42 -0.73 -0.12 0.00 -0.26 0.00 0.00 64.21 63.52 3ij1 n SER 156 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3ij1 n ASN 157 N -2.05 2.00 -0.00 4.04 4.13 -1.26 -4.68 115.26 117.44 3ij1 n ASN 157 Ca 0.02 -0.06 0.11 0.00 1.68 0.00 0.00 54.58 56.33 3ij1 n ASN 157 Cb 0.20 -0.50 -0.14 0.00 -1.54 0.00 0.00 39.78 37.80 3ij1 n ASN 157 CO 0.00 0.00 0.00 0.35 0.28 0.00 0.00 177.26 177.89 3ij1 n THR 158 N -3.36 0.03 -0.19 3.41 -2.24 -1.18 -4.99 114.28 105.77 3ij1 n THR 158 Ca -0.44 -0.34 0.00 0.00 -2.27 0.00 0.00 64.05 61.00 3ij1 n THR 158 Cb 0.99 0.30 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 3ij1 n THR 158 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3ij1 n SER 159 N -2.02 0.00 -4.73 3.42 3.41 0.33 -5.00 113.62 109.02 3ij1 n SER 159 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 58.87 58.18 3ij1 n SER 159 Cb 0.49 -0.10 -0.03 0.00 -0.26 0.00 0.00 64.21 64.30 3ij1 n SER 159 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3ij1 s HIS 160 N -3.06 3.26 0.53 7.33 3.76 -1.26 -4.58 115.29 121.27 3ij1 s HIS 160 Ca 0.00 1.12 -0.21 0.00 -0.15 0.00 0.00 55.06 55.82 3ij1 s HIS 160 Cb 0.00 -3.62 -0.07 0.00 1.11 0.00 0.00 32.58 29.99 3ij1 s HIS 160 CO 0.00 -2.05 0.96 -2.30 -0.85 0.00 0.00 174.74 170.51 3ij1 n PRO 161 N 3.22 1.09 -4.19 8.40 -0.02 -1.26 -0.04 135.00 142.21 3ij1 n PRO 161 Ca 0.08 0.41 -0.17 0.00 -2.02 0.00 0.00 63.50 61.80 3ij1 n PRO 161 Cb 0.43 -2.11 -0.11 0.00 -0.02 0.00 0.00 33.50 31.69 3ij1 n PRO 161 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ij1 s LEU 162 N -1.29 2.34 -0.14 2.45 1.43 0.77 -4.40 118.68 119.83 3ij1 s LEU 162 Ca 0.70 -0.71 0.01 0.00 -1.03 0.00 0.00 54.13 53.10 3ij1 s LEU 162 Cb -0.47 -0.46 0.02 0.00 0.03 0.00 0.00 46.19 45.31 3ij1 s LEU 162 CO 0.52 -0.14 -0.14 -0.22 0.23 0.00 0.00 176.35 176.59 3ij1 s LEU 163 N -2.08 1.67 -0.12 1.79 2.96 -0.62 -0.83 118.68 121.44 3ij1 s LEU 163 Ca 0.02 -0.47 -0.14 0.00 -0.22 0.00 0.00 54.13 53.32 3ij1 s LEU 163 Cb -0.07 -1.15 -0.05 0.00 0.50 0.00 0.00 46.19 45.42 3ij1 s LEU 163 CO 0.02 -0.05 0.33 0.00 -1.32 0.00 0.00 176.35 175.33 3ij1 s ALA 164 N 1.42 3.61 0.08 5.97 0.00 -0.03 0.15 121.76 132.96 3ij1 s ALA 164 Ca 0.03 -0.38 0.06 0.00 0.00 0.00 0.00 51.96 51.66 3ij1 s ALA 164 Cb -0.13 -2.40 -0.03 0.00 0.00 0.00 0.00 23.12 20.56 3ij1 s ALA 164 CO -0.09 0.18 -0.15 0.14 0.00 0.00 0.00 175.76 175.84 3ij1 s VAL 165 N 0.13 1.24 0.13 0.00 -7.23 -0.25 -1.20 120.40 113.22 3ij1 s VAL 165 Ca 0.19 -1.41 -0.24 0.00 -1.81 0.00 0.00 61.98 58.71 3ij1 s VAL 165 Cb -0.14 -1.22 0.07 0.00 0.56 0.00 0.00 36.38 35.65 3ij1 s VAL 165 CO 0.06 -0.23 0.68 0.00 -0.31 0.00 0.00 175.10 175.31 3ij1 s ALA 166 N -1.40 -1.62 0.00 1.32 0.00 -0.81 -1.12 121.76 118.14 3ij1 s ALA 166 Ca 0.01 0.52 0.00 0.00 0.00 0.00 0.00 51.96 52.49 3ij1 s ALA 166 Cb -0.09 0.78 0.00 0.00 0.00 0.00 0.00 23.12 23.81 3ij1 s ALA 166 CO 0.03 -0.78 0.00 0.41 0.00 0.00 0.00 175.76 175.41 3ij1 n GLY 167 N -0.36 2.22 0.28 0.00 0.00 -1.26 -0.85 105.19 105.22 3ij1 n GLY 167 Ca -0.14 0.05 0.01 0.00 0.00 0.00 0.00 46.02 45.94 3ij1 n GLY 167 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3ij1 h SER 168 N 0.00 0.47 0.88 1.61 4.64 -1.29 0.13 113.55 119.99 3ij1 h SER 168 Ca 0.00 -0.07 0.00 0.00 -0.47 0.00 0.00 61.79 61.25 3ij1 h SER 168 Cb 0.00 -0.12 0.00 0.00 -0.31 0.00 0.00 62.40 61.97 3ij1 h SER 168 CO 0.00 0.49 0.00 0.03 -0.87 0.00 0.00 176.83 176.48 3ij1 h ARG 169 N 0.50 0.00 -0.96 4.77 3.08 -1.90 -3.11 114.38 116.76 3ij1 h ARG 169 Ca 0.12 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.01 3ij1 h ARG 169 Cb 0.22 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.25 3ij1 h ARG 169 CO -0.00 0.00 -0.19 0.41 -1.07 0.00 0.00 179.97 179.12 3ij1 n GLY 170 N -0.00 0.23 3.42 0.04 0.00 -0.80 -4.75 105.19 103.33 3ij1 n GLY 170 Ca 0.01 -0.59 -0.33 0.00 0.00 0.00 0.00 46.02 45.11 3ij1 n GLY 170 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ij1 s ILE 171 N -2.37 3.40 -0.14 -0.61 1.01 -1.26 -4.30 121.20 116.93 3ij1 s ILE 171 Ca 0.00 -0.53 -0.18 0.00 0.00 0.00 0.00 60.65 59.94 3ij1 s ILE 171 Cb 0.00 -2.46 -0.04 0.00 0.01 0.00 0.00 42.46 39.97 3ij1 s ILE 171 CO 0.00 0.51 0.48 -0.63 0.00 0.00 0.00 174.94 175.30 3ij1 s ILE 172 N 0.40 5.17 -0.11 2.92 1.01 -0.26 -4.32 121.20 126.01 3ij1 s ILE 172 Ca -0.08 0.93 0.01 0.00 0.00 0.00 0.00 60.65 61.51 3ij1 s ILE 172 Cb -0.15 -3.81 -0.02 0.00 0.01 0.00 0.00 42.46 38.48 3ij1 s ILE 172 CO 0.04 0.29 -0.12 -0.13 0.00 0.00 0.00 174.94 175.02 3ij1 s ARG 173 N 0.91 3.14 -0.30 2.79 0.52 -0.27 -0.36 118.95 125.38 3ij1 s ARG 173 Ca 0.25 -0.66 -0.11 0.00 -0.52 0.00 0.00 55.73 54.68 3ij1 s ARG 173 Cb -0.15 -2.59 -0.04 0.00 0.52 0.00 0.00 34.95 32.69 3ij1 s ARG 173 CO 0.10 0.35 0.20 0.42 0.02 0.00 0.00 175.30 176.39 3ij1 s ILE 174 N -0.01 5.20 -0.12 1.52 -1.09 0.00 -1.09 121.20 125.62 3ij1 s ILE 174 Ca -0.03 0.00 -0.01 0.00 -2.23 0.00 0.00 60.65 58.38 3ij1 s ILE 174 Cb -0.14 -3.54 -0.02 0.00 -1.58 0.00 0.00 42.46 37.17 3ij1 s ILE 174 CO 0.04 0.17 -0.08 -0.63 -1.23 0.00 0.00 174.94 173.20 3ij1 s ILE 175 N 1.73 3.51 -0.38 2.92 -1.09 0.12 -0.39 121.20 127.62 3ij1 s ILE 175 Ca 0.07 -0.52 -0.29 0.00 -2.23 0.00 0.00 60.65 57.68 3ij1 s ILE 175 Cb -0.16 -2.48 0.01 0.00 -1.58 0.00 0.00 42.46 38.25 3ij1 s ILE 175 CO 0.10 0.54 1.23 0.21 -1.23 0.00 0.00 174.94 175.79 3ij1 s ASN 176 N -0.03 6.65 0.46 3.58 3.84 0.36 -1.59 114.94 128.22 3ij1 s ASN 176 Ca -0.01 0.88 0.26 0.00 0.21 0.00 0.00 52.86 54.20 3ij1 s ASN 176 Cb -0.14 -2.54 1.04 0.00 -0.55 0.00 0.00 41.25 39.06 3ij1 s ASN 176 CO 0.03 -1.16 1.88 -0.65 -2.79 0.00 0.00 177.10 174.41 3ij1 h PRO 177 N 9.30 0.00 0.30 0.43 0.11 -1.88 0.67 132.00 140.93 3ij1 h PRO 177 Ca -0.24 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.85 3ij1 h PRO 177 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3ij1 h PRO 177 CO 1.07 0.19 -0.14 0.82 -0.21 0.00 0.00 178.00 179.72 3ij1 h ILE 178 N 0.00 0.73 0.00 4.15 2.04 -1.91 -3.34 117.51 119.18 3ij1 h ILE 178 Ca -0.00 -0.48 0.00 0.00 1.00 0.00 0.00 64.86 65.38 3ij1 h ILE 178 Cb 0.67 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.73 3ij1 h ILE 178 CO 0.02 0.10 -1.35 0.35 0.00 0.00 0.00 178.15 177.27 3ij1 n THR 179 N -5.15 0.01 -1.72 -0.27 -2.24 -1.17 -4.98 114.28 98.76 3ij1 n THR 179 Ca -0.10 -0.19 -0.18 0.00 -2.27 0.00 0.00 64.05 61.30 3ij1 n THR 179 Cb 0.25 0.58 -0.06 0.00 -2.10 0.00 0.00 70.33 69.00 3ij1 n THR 179 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3ij1 n MET 180 N -1.80 -1.33 -2.40 -0.78 2.81 0.23 -5.01 117.12 108.85 3ij1 n MET 180 Ca 0.01 1.09 -0.40 0.00 -1.81 0.00 0.00 57.70 56.59 3ij1 n MET 180 Cb 0.42 -5.43 -0.04 0.00 -0.71 0.00 0.00 33.22 27.46 3ij1 n MET 180 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3ij1 s GLN 181 N -3.87 4.57 -0.41 0.03 -0.21 -1.22 -4.69 119.66 113.87 3ij1 s GLN 181 Ca 0.00 1.89 -0.29 0.00 0.02 0.00 0.00 55.36 56.98 3ij1 s GLN 181 Cb 0.00 -3.18 0.02 0.00 1.00 0.00 0.00 33.01 30.86 3ij1 s GLN 181 CO 0.00 0.10 1.12 0.00 -2.12 0.00 0.00 175.29 174.40 3ij1 h ILE 183 N 6.02 1.35 -2.33 0.00 2.04 -1.08 -3.49 117.51 120.04 3ij1 h ILE 183 Ca -0.22 -1.97 0.15 0.00 1.00 0.00 0.00 64.86 63.82 3ij1 h ILE 183 Cb 1.06 2.28 -0.11 0.00 -0.74 0.00 0.00 36.82 39.32 3ij1 h ILE 183 CO 1.09 0.59 0.48 -1.59 0.00 0.00 0.00 178.15 178.72 3ij1 s LYS 184 N -3.53 1.07 0.06 2.37 -2.85 -1.22 -5.03 119.74 110.61 3ij1 s LYS 184 Ca -0.12 -0.53 -0.03 0.00 -1.00 0.00 0.00 55.97 54.29 3ij1 s LYS 184 Cb 0.06 0.40 -0.03 0.00 -2.06 0.00 0.00 37.83 36.20 3ij1 s LYS 184 CO 0.85 -0.48 0.03 -3.38 0.10 0.00 0.00 175.35 172.47 3ij1 s HIS 185 N -3.24 0.41 -0.07 1.78 -3.43 -1.26 -0.82 115.29 108.67 3ij1 s HIS 185 Ca 0.10 -0.92 0.02 0.00 -0.80 0.00 0.00 55.06 53.46 3ij1 s HIS 185 Cb -0.01 -0.30 0.01 0.00 -1.43 0.00 0.00 32.58 30.86 3ij1 s HIS 185 CO -0.02 -0.42 -0.13 0.71 -2.00 0.00 0.00 174.74 172.89 3ij1 s TYR 186 N -3.81 1.56 0.09 0.38 2.02 0.51 -4.96 117.35 113.13 3ij1 s TYR 186 Ca 0.06 -0.61 0.08 0.00 -0.37 0.00 0.00 57.07 56.22 3ij1 s TYR 186 Cb 0.07 -1.14 -0.04 0.00 -0.40 0.00 0.00 41.96 40.45 3ij1 s TYR 186 CO -0.10 -0.32 -0.15 0.08 -1.57 0.00 0.00 175.55 173.49 3ij1 s VAL 187 N 0.75 3.03 0.00 0.71 1.01 -1.26 -1.10 120.40 123.54 3ij1 s VAL 187 Ca -0.13 -1.32 0.00 0.00 0.00 0.00 0.00 61.98 60.54 3ij1 s VAL 187 Cb -0.16 -2.37 0.00 0.00 0.00 0.00 0.00 36.38 33.86 3ij1 s VAL 187 CO 0.03 0.18 0.00 0.61 0.00 0.00 0.00 175.10 175.91 3ij1 n GLY 188 N 1.00 -1.32 3.48 4.51 0.00 -1.26 -5.06 105.19 106.53 3ij1 n GLY 188 Ca -0.15 0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.91 3ij1 n GLY 188 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ij1 n HIS 189 N 0.00 -0.03 0.38 1.61 8.25 -1.26 -4.85 115.22 119.31 3ij1 n HIS 189 Ca 0.00 0.69 0.12 0.00 -0.26 0.00 0.00 57.72 58.27 3ij1 n HIS 189 Cb 0.00 -2.05 0.51 0.00 1.12 0.00 0.00 29.99 29.56 3ij1 n HIS 189 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ij1 n GLY 190 N 1.67 -1.28 0.00 -1.41 0.00 -1.26 -4.90 105.19 98.01 3ij1 n GLY 190 Ca 0.12 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.24 3ij1 n GLY 190 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ij1 n ASN 191 N -2.28 0.00 -4.51 1.61 5.03 -1.26 -4.89 115.26 108.95 3ij1 n ASN 191 Ca 0.02 0.00 -0.48 0.00 0.87 0.00 0.00 54.58 54.99 3ij1 n ASN 191 Cb 0.23 0.00 -0.03 0.00 -1.02 0.00 0.00 39.78 38.95 3ij1 n ASN 191 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3ij1 n ALA 192 N 0.00 -1.54 -2.63 5.41 0.00 -1.18 -4.08 120.51 116.50 3ij1 n ALA 192 Ca 0.00 0.44 -0.37 0.00 0.00 0.00 0.00 53.44 53.51 3ij1 n ALA 192 Cb 0.00 -1.86 -0.10 0.00 0.00 0.00 0.00 19.45 17.49 3ij1 n ALA 192 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ij1 s ILE 193 N -0.76 5.31 -0.11 0.00 1.01 0.37 -1.04 121.20 125.99 3ij1 s ILE 193 Ca 0.66 0.24 0.16 0.00 0.00 0.00 0.00 60.65 61.72 3ij1 s ILE 193 Cb -0.86 -3.54 -0.16 0.00 0.01 0.00 0.00 42.46 37.91 3ij1 s ILE 193 CO 0.57 0.28 0.77 0.59 0.00 0.00 0.00 174.94 177.15 3ij1 n ASN 194 N 4.71 0.84 -3.65 3.58 3.02 0.19 -4.02 115.26 119.92 3ij1 n ASN 194 Ca -0.14 0.37 -0.15 0.00 -0.03 0.00 0.00 54.58 54.64 3ij1 n ASN 194 Cb 0.52 0.15 -0.08 0.00 -0.61 0.00 0.00 39.78 39.76 3ij1 n ASN 194 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3ij1 s GLU 195 N -2.86 0.82 -0.02 3.52 2.12 -1.20 -4.73 118.70 116.35 3ij1 s GLU 195 Ca -0.03 0.17 0.07 0.00 0.36 0.00 0.00 54.97 55.54 3ij1 s GLU 195 Cb 0.09 0.38 -0.02 0.00 0.26 0.00 0.00 34.13 34.84 3ij1 s GLU 195 CO 0.82 -0.22 -0.22 -0.51 -0.54 0.00 0.00 175.26 174.59 3ij1 s LEU 196 N -0.96 2.04 -0.05 2.70 1.43 -1.26 -1.43 118.68 121.15 3ij1 s LEU 196 Ca -0.10 -0.40 -0.04 0.00 -1.03 0.00 0.00 54.13 52.56 3ij1 s LEU 196 Cb -0.03 -1.13 0.02 0.00 0.03 0.00 0.00 46.19 45.08 3ij1 s LEU 196 CO 0.06 0.26 0.13 -0.54 0.23 0.00 0.00 176.35 176.49 3ij1 s LYS 197 N -0.47 0.12 0.05 1.70 -0.14 -0.11 -4.72 119.74 116.17 3ij1 s LYS 197 Ca 0.07 0.24 -0.11 0.00 -1.36 0.00 0.00 55.97 54.81 3ij1 s LYS 197 Cb -0.09 -0.02 -0.06 0.00 -1.68 0.00 0.00 37.83 35.99 3ij1 s LYS 197 CO -0.01 -0.07 0.39 -0.06 -0.76 0.00 0.00 175.35 174.85 3ij1 s PHE 198 N 0.44 3.63 0.32 3.18 0.08 -1.26 -0.03 117.98 124.33 3ij1 s PHE 198 Ca -0.03 0.84 -0.29 0.00 0.12 0.00 0.00 56.93 57.57 3ij1 s PHE 198 Cb -0.05 -2.19 -0.12 0.00 -0.57 0.00 0.00 43.02 40.09 3ij1 s PHE 198 CO -0.02 0.57 1.34 1.58 -0.10 0.00 0.00 175.22 178.59 3ij1 n HIS 199 N 1.23 2.31 0.25 0.36 -0.00 -0.03 -4.92 115.22 114.42 3ij1 n HIS 199 Ca -0.10 0.50 0.12 0.00 -0.00 0.00 0.00 57.72 58.24 3ij1 n HIS 199 Cb 0.52 -2.44 0.61 0.00 -0.00 0.00 0.00 29.99 28.68 3ij1 n HIS 199 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3ij1 h PRO 200 N 3.07 0.00 0.00 1.57 0.13 -1.87 -3.30 132.00 131.61 3ij1 h PRO 200 Ca -0.46 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 3ij1 h PRO 200 Cb 1.28 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.40 3ij1 h PRO 200 CO 0.67 0.16 -1.58 0.54 -0.23 0.00 0.00 178.00 177.55 3ij1 n ARG 201 N -3.43 0.83 -3.95 0.86 5.12 -1.26 -4.92 116.66 109.90 3ij1 n ARG 201 Ca -0.01 -0.08 -0.30 0.00 -1.93 0.00 0.00 57.85 55.53 3ij1 n ARG 201 Cb 0.34 -1.28 -0.16 0.00 -1.16 0.00 0.00 32.46 30.20 3ij1 n ARG 201 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3ij1 s ASP 202 N -3.59 3.77 0.17 0.55 -1.08 -1.24 -5.00 116.67 110.26 3ij1 s ASP 202 Ca -0.05 -1.12 0.19 0.00 -0.52 0.00 0.00 52.55 51.06 3ij1 s ASP 202 Cb 0.06 -1.20 0.83 0.00 -1.46 0.00 0.00 42.92 41.16 3ij1 s ASP 202 CO 0.47 -0.22 1.59 -0.81 0.52 0.00 0.00 175.17 176.72 3ij1 n PRO 203 N 4.67 0.12 0.01 4.34 -0.04 -1.26 -2.61 135.00 140.22 3ij1 n PRO 203 Ca -0.13 0.40 0.12 0.00 -0.04 0.00 0.00 63.50 63.86 3ij1 n PRO 203 Cb 0.44 -1.75 0.25 0.00 -0.04 0.00 0.00 33.50 32.40 3ij1 n PRO 203 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3ij1 n ASN 204 N -1.98 0.51 -4.43 3.54 3.02 -1.26 -4.63 115.26 110.02 3ij1 n ASN 204 Ca 0.02 -0.15 -0.44 0.00 -0.03 0.00 0.00 54.58 53.98 3ij1 n ASN 204 Cb 0.17 0.22 -0.07 0.00 -0.61 0.00 0.00 39.78 39.49 3ij1 n ASN 204 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3ij1 s LEU 205 N -3.24 5.22 -0.18 3.41 1.43 -1.07 -0.55 118.68 123.70 3ij1 s LEU 205 Ca 0.10 -1.03 -0.04 0.00 -1.03 0.00 0.00 54.13 52.13 3ij1 s LEU 205 Cb 0.17 -2.32 -0.03 0.00 0.03 0.00 0.00 46.19 44.04 3ij1 s LEU 205 CO 0.70 -0.72 -0.02 -0.22 0.23 0.00 0.00 176.35 176.32 3ij1 s LEU 206 N 2.10 3.26 -0.17 1.79 2.96 -0.34 -0.85 118.68 127.43 3ij1 s LEU 206 Ca 0.10 -0.16 -0.06 0.00 -0.22 0.00 0.00 54.13 53.78 3ij1 s LEU 206 Cb -0.21 -1.80 -0.04 0.00 0.50 0.00 0.00 46.19 44.64 3ij1 s LEU 206 CO 0.10 0.12 0.03 -0.22 -1.32 0.00 0.00 176.35 175.06 3ij1 s LEU 207 N 0.67 3.66 -0.00 -0.68 2.96 0.95 -0.29 118.68 125.95 3ij1 s LEU 207 Ca -0.01 0.04 0.08 0.00 -0.22 0.00 0.00 54.13 54.02 3ij1 s LEU 207 Cb -0.14 -1.91 -0.02 0.00 0.50 0.00 0.00 46.19 44.62 3ij1 s LEU 207 CO 0.02 0.19 -0.25 -0.94 -1.32 0.00 0.00 176.35 174.06 3ij1 s SER 208 N 0.24 2.95 -0.01 3.68 1.04 -0.31 -0.93 113.70 120.36 3ij1 s SER 208 Ca 0.02 -0.49 0.08 0.00 0.48 0.00 0.00 55.95 56.04 3ij1 s SER 208 Cb -0.13 -0.31 -0.02 0.00 0.10 0.00 0.00 66.02 65.66 3ij1 s SER 208 CO 0.01 0.29 -0.24 0.68 0.98 0.00 0.00 173.24 174.96 3ij1 s VAL 209 N -0.65 1.92 0.06 5.02 -7.23 -0.51 -1.06 120.40 117.95 3ij1 s VAL 209 Ca 0.10 -1.09 0.04 0.00 -1.81 0.00 0.00 61.98 59.22 3ij1 s VAL 209 Cb -0.10 -1.60 -0.03 0.00 0.56 0.00 0.00 36.38 35.21 3ij1 s VAL 209 CO -0.00 0.49 -0.12 -0.55 -0.31 0.00 0.00 175.10 174.61 3ij1 s SER 210 N -0.70 1.44 0.63 4.85 0.15 -0.72 -0.64 113.70 118.71 3ij1 s SER 210 Ca 0.09 -0.60 0.27 0.00 0.70 0.00 0.00 55.95 56.41 3ij1 s SER 210 Cb -0.09 -0.02 1.41 0.00 -1.71 0.00 0.00 66.02 65.60 3ij1 s SER 210 CO -0.00 -0.12 1.81 0.50 1.20 0.00 0.00 173.24 176.63 3ij1 h LYS 211 N 4.32 0.00 0.00 5.44 3.64 -1.28 -0.58 116.57 128.12 3ij1 h LYS 211 Ca -0.39 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.99 3ij1 h LYS 211 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 3ij1 h LYS 211 CO 0.41 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 177.19 3ij1 n ASP 212 N -3.19 0.00 0.00 4.20 5.68 -1.26 -4.16 116.55 117.82 3ij1 n ASP 212 Ca 0.03 -1.87 0.00 0.00 -0.50 0.00 0.00 54.79 52.46 3ij1 n ASP 212 Cb 0.59 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.57 3ij1 n ASP 212 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3ij1 n HIS 213 N -0.53 0.00 -4.37 2.11 8.25 -0.31 -4.94 115.22 115.43 3ij1 n HIS 213 Ca 0.02 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.23 3ij1 n HIS 213 Cb 0.01 0.00 -0.09 0.00 1.12 0.00 0.00 29.99 31.02 3ij1 n HIS 213 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ij1 s ALA 214 N -3.57 2.87 0.06 -1.41 0.00 -1.25 -4.03 121.76 114.42 3ij1 s ALA 214 Ca 0.00 -1.69 0.02 0.00 0.00 0.00 0.00 51.96 50.29 3ij1 s ALA 214 Cb 0.00 -0.52 -0.04 0.00 0.00 0.00 0.00 23.12 22.56 3ij1 s ALA 214 CO 0.00 0.34 0.10 -0.51 0.00 0.00 0.00 175.76 175.69 3ij1 s LEU 215 N -3.26 3.91 -0.03 0.00 1.02 -0.46 -1.76 118.68 118.09 3ij1 s LEU 215 Ca 0.28 0.07 0.04 0.00 0.02 0.00 0.00 54.13 54.53 3ij1 s LEU 215 Cb -0.07 -2.51 -0.00 0.00 0.02 0.00 0.00 46.19 43.63 3ij1 s LEU 215 CO 0.15 0.19 -0.13 -0.13 0.02 0.00 0.00 176.35 176.46 3ij1 s ARG 216 N -2.26 1.29 -0.22 1.70 0.52 -0.22 0.07 118.95 119.83 3ij1 s ARG 216 Ca 0.29 -0.46 -0.05 0.00 -0.52 0.00 0.00 55.73 54.99 3ij1 s ARG 216 Cb -0.12 -1.18 -0.02 0.00 0.52 0.00 0.00 34.95 34.15 3ij1 s ARG 216 CO 0.21 0.20 -0.00 -1.17 0.02 0.00 0.00 175.30 174.56 3ij1 s LEU 217 N 0.02 3.17 0.10 2.53 2.96 -0.16 -1.17 118.68 126.13 3ij1 s LEU 217 Ca -0.01 -0.27 0.06 0.00 -0.22 0.00 0.00 54.13 53.69 3ij1 s LEU 217 Cb -0.09 -1.81 -0.04 0.00 0.50 0.00 0.00 46.19 44.75 3ij1 s LEU 217 CO 0.01 0.02 -0.07 0.26 -1.32 0.00 0.00 176.35 175.25 3ij1 s TRP 218 N 1.27 2.81 -0.38 5.38 0.52 0.60 0.45 118.94 129.59 3ij1 s TRP 218 Ca 0.04 -0.12 -0.07 0.00 0.02 0.00 0.00 56.10 55.97 3ij1 s TRP 218 Cb -0.15 -1.47 0.06 0.00 -1.15 0.00 0.00 33.47 30.77 3ij1 s TRP 218 CO 0.01 0.44 0.17 1.21 0.02 0.00 0.00 176.95 178.80 3ij1 s ASN 219 N -2.21 5.42 -0.01 2.95 3.84 0.64 -1.20 114.94 124.38 3ij1 s ASN 219 Ca 0.22 -1.38 0.08 0.00 0.21 0.00 0.00 52.86 52.00 3ij1 s ASN 219 Cb -0.11 -1.91 0.25 0.00 -0.55 0.00 0.00 41.25 38.93 3ij1 s ASN 219 CO 0.15 -0.43 1.19 2.30 -2.79 0.00 0.00 177.10 177.52 3ij1 n ILE 220 N 4.82 0.41 -0.09 -5.21 -5.35 0.29 -0.63 119.36 113.61 3ij1 n ILE 220 Ca -0.10 -0.38 -0.13 0.00 -0.27 0.00 0.00 62.75 61.86 3ij1 n ILE 220 Cb 0.44 0.15 -0.07 0.00 -1.74 0.00 0.00 39.64 38.41 3ij1 n ILE 220 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 3ij1 h GLN 221 N 1.61 0.00 -0.19 6.28 5.75 -1.94 -3.40 115.11 123.22 3ij1 h GLN 221 Ca 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.50 3ij1 h GLN 221 Cb 0.42 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.97 3ij1 h GLN 221 CO 0.01 0.52 0.00 0.25 -2.65 0.00 0.00 178.83 176.96 3ij1 n THR 222 N -4.53 0.23 -3.61 2.39 -2.24 -1.22 -4.96 114.28 100.34 3ij1 n THR 222 Ca -0.19 -0.50 -0.23 0.00 -2.27 0.00 0.00 64.05 60.86 3ij1 n THR 222 Cb 0.47 0.86 0.07 0.00 -2.10 0.00 0.00 70.33 69.63 3ij1 n THR 222 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3ij1 n ASP 223 N 0.94 -4.35 -4.51 3.42 8.00 0.20 -4.96 116.55 115.28 3ij1 n ASP 223 Ca 0.17 -0.63 -0.32 0.00 0.71 0.00 0.00 54.79 54.73 3ij1 n ASP 223 Cb 0.49 -4.80 -0.12 0.00 -0.02 0.00 0.00 41.12 36.67 3ij1 n ASP 223 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3ij1 s THR 224 N -3.37 3.18 -0.46 -3.53 -4.23 -0.70 -4.96 115.64 101.58 3ij1 s THR 224 Ca 0.37 -0.87 -0.26 0.00 -1.18 0.00 0.00 61.69 59.75 3ij1 s THR 224 Cb -0.17 -2.32 0.03 0.00 1.34 0.00 0.00 72.50 71.38 3ij1 s THR 224 CO 0.75 0.45 0.97 -0.22 -0.54 0.00 0.00 174.62 176.04 3ij1 s LEU 225 N -1.16 3.93 -0.00 4.79 2.96 -1.26 -0.26 118.68 127.68 3ij1 s LEU 225 Ca 0.14 0.21 -0.20 0.00 -0.22 0.00 0.00 54.13 54.07 3ij1 s LEU 225 Cb -0.11 -3.27 -0.25 0.00 0.50 0.00 0.00 46.19 43.07 3ij1 s LEU 225 CO 0.04 -1.08 1.07 0.58 -1.32 0.00 0.00 176.35 175.64 3ij1 h VAL 226 N 6.10 1.44 -2.41 1.68 2.07 -0.34 -3.37 116.25 121.41 3ij1 h VAL 226 Ca -0.24 -2.15 -0.00 0.00 0.82 0.00 0.00 66.70 65.13 3ij1 h VAL 226 Cb 1.07 2.68 -0.16 0.00 -1.52 0.00 0.00 31.29 33.36 3ij1 h VAL 226 CO 1.05 0.62 0.28 0.00 0.02 0.00 0.00 177.57 179.54 3ij1 s ALA 227 N -3.10 -1.72 -0.12 1.67 0.00 -1.12 -1.28 121.76 116.08 3ij1 s ALA 227 Ca -0.13 0.96 0.03 0.00 0.00 0.00 0.00 51.96 52.81 3ij1 s ALA 227 Cb 0.03 0.36 0.01 0.00 0.00 0.00 0.00 23.12 23.52 3ij1 s ALA 227 CO 0.83 -0.58 -0.21 0.42 0.00 0.00 0.00 175.76 176.22 3ij1 s ILE 228 N -2.53 1.88 -0.42 0.00 1.01 0.33 -0.99 121.20 120.48 3ij1 s ILE 228 Ca -0.03 -0.89 -0.10 0.00 0.00 0.00 0.00 60.65 59.63 3ij1 s ILE 228 Cb -0.01 -1.67 0.07 0.00 0.01 0.00 0.00 42.46 40.87 3ij1 s ILE 228 CO -0.03 0.52 0.27 -0.36 0.00 0.00 0.00 174.94 175.33 3ij1 s PHE 229 N 0.70 3.31 0.00 3.97 0.08 0.11 -0.67 117.98 125.48 3ij1 s PHE 229 Ca -0.11 -1.35 0.00 0.00 0.12 0.00 0.00 56.93 55.59 3ij1 s PHE 229 Cb -0.16 -2.89 0.00 0.00 -0.57 0.00 0.00 43.02 39.39 3ij1 s PHE 229 CO 0.02 -0.81 0.00 0.41 -0.10 0.00 0.00 175.22 174.74 3ij1 n GLY 230 N 4.97 4.23 0.00 4.36 0.00 -0.23 -1.36 105.19 117.16 3ij1 n GLY 230 Ca -0.11 -0.34 0.00 0.00 0.00 0.00 0.00 46.02 45.57 3ij1 n GLY 230 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ij1 n GLY 231 N 0.00 -1.22 0.37 -0.02 0.00 -1.26 -2.87 105.19 100.18 3ij1 n GLY 231 Ca 0.00 -1.61 0.05 0.00 0.00 0.00 0.00 46.02 44.46 3ij1 n GLY 231 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ij1 h VAL 232 N 0.00 1.02 -0.01 1.61 2.07 -1.92 -1.63 116.25 117.40 3ij1 h VAL 232 Ca 0.00 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.17 3ij1 h VAL 232 Cb 0.00 -0.08 0.00 0.00 -1.52 0.00 0.00 31.29 29.69 3ij1 h VAL 232 CO 0.00 0.19 -0.15 -0.62 0.02 0.00 0.00 177.57 177.00 3ij1 n GLU 233 N -4.52 0.88 -0.03 1.57 -0.58 -1.25 -4.82 120.64 111.88 3ij1 n GLU 233 Ca 0.15 -0.42 0.00 0.00 -0.42 0.00 0.00 57.16 56.47 3ij1 n GLU 233 Cb 0.25 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 3ij1 n GLU 233 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ij1 n GLY 234 N 1.28 -0.38 3.76 0.62 0.00 -0.61 -4.49 105.19 105.37 3ij1 n GLY 234 Ca 0.14 -1.71 -0.39 0.00 0.00 0.00 0.00 46.02 44.07 3ij1 n GLY 234 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3ij1 s HIS 235 N 0.12 2.57 -1.18 1.61 3.76 -1.26 -4.92 115.29 115.98 3ij1 s HIS 235 Ca 0.00 1.39 0.13 0.00 -0.15 0.00 0.00 55.06 56.42 3ij1 s HIS 235 Cb 0.00 -3.72 0.31 0.00 1.11 0.00 0.00 32.58 30.28 3ij1 s HIS 235 CO 0.00 -2.45 1.23 0.54 -0.85 0.00 0.00 174.74 173.21 3ij1 n ARG 236 N -0.44 2.50 -3.78 1.40 1.74 -1.26 -4.85 116.66 111.97 3ij1 n ARG 236 Ca 0.07 -1.99 -0.11 0.00 -0.77 0.00 0.00 57.85 55.05 3ij1 n ARG 236 Cb 0.44 -1.30 0.01 0.00 -1.02 0.00 0.00 32.46 30.59 3ij1 n ARG 236 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 3ij1 n ASP 237 N 0.70 -1.89 -4.57 0.55 -0.08 -1.26 -4.94 116.55 105.06 3ij1 n ASP 237 Ca 0.13 -2.66 -0.50 0.00 -1.51 0.00 0.00 54.79 50.24 3ij1 n ASP 237 Cb 0.43 3.25 -0.05 0.00 2.34 0.00 0.00 41.12 47.10 3ij1 n ASP 237 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 3ij1 n GLU 238 N -0.54 1.07 -3.00 -0.67 1.02 -1.26 -4.23 120.64 113.05 3ij1 n GLU 238 Ca -0.05 0.38 -0.40 0.00 -0.02 0.00 0.00 57.16 57.07 3ij1 n GLU 238 Cb 0.58 -1.89 -0.05 0.00 -0.02 0.00 0.00 31.44 30.06 3ij1 n GLU 238 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3ij1 s VAL 239 N -0.09 5.00 -0.11 2.62 1.01 -0.71 -0.97 120.40 127.14 3ij1 s VAL 239 Ca 0.76 1.50 0.13 0.00 0.00 0.00 0.00 61.98 64.37 3ij1 s VAL 239 Cb -0.89 -4.07 -0.19 0.00 0.00 0.00 0.00 36.38 31.23 3ij1 s VAL 239 CO 0.52 0.18 0.12 0.18 0.00 0.00 0.00 175.10 176.10 3ij1 n LEU 240 N 4.22 0.00 -3.58 3.92 4.77 -0.22 -3.86 117.00 122.24 3ij1 n LEU 240 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.87 3ij1 n LEU 240 Cb 0.51 0.26 -0.04 0.00 -2.33 0.00 0.00 43.42 41.82 3ij1 n LEU 240 CO 0.47 0.26 0.22 -0.55 -1.33 0.00 0.00 177.39 176.47 3ij1 s SER 241 N -4.49 -0.33 0.10 -1.43 0.15 -1.06 -4.39 113.70 102.25 3ij1 s SER 241 Ca -0.07 -0.17 -0.24 0.00 0.70 0.00 0.00 55.95 56.18 3ij1 s SER 241 Cb 0.06 0.50 0.06 0.00 -1.71 0.00 0.00 66.02 64.93 3ij1 s SER 241 CO 0.59 -0.85 0.58 0.00 1.20 0.00 0.00 173.24 174.76 3ij1 s ALA 242 N -3.54 -1.51 -0.09 5.45 0.00 -1.26 -1.12 121.76 119.68 3ij1 s ALA 242 Ca 0.01 0.61 -0.07 0.00 0.00 0.00 0.00 51.96 52.51 3ij1 s ALA 242 Cb 0.01 0.61 0.03 0.00 0.00 0.00 0.00 23.12 23.78 3ij1 s ALA 242 CO -0.10 -0.64 0.24 0.34 0.00 0.00 0.00 175.76 175.60 3ij1 s ASP 243 N -2.33 -0.25 0.35 0.00 2.15 0.10 -4.89 116.67 111.81 3ij1 s ASP 243 Ca -0.02 0.49 -0.26 0.00 0.43 0.00 0.00 52.55 53.19 3ij1 s ASP 243 Cb -0.00 0.44 -0.09 0.00 -0.30 0.00 0.00 42.92 42.96 3ij1 s ASP 243 CO -0.07 -0.12 1.05 -0.31 -0.17 0.00 0.00 175.17 175.55 3ij1 s TYR 244 N 0.64 3.42 1.24 -5.34 2.02 -1.26 -1.24 117.35 116.83 3ij1 s TYR 244 Ca -0.04 1.68 -0.20 0.00 -0.37 0.00 0.00 57.07 58.14 3ij1 s TYR 244 Cb -0.06 -3.14 0.30 0.00 -0.40 0.00 0.00 41.96 38.66 3ij1 s TYR 244 CO -0.04 -0.48 1.09 0.16 -1.57 0.00 0.00 175.55 174.71 3ij1 s ASP 245 N -1.37 0.60 0.22 2.29 -4.77 -0.42 -4.69 116.67 108.54 3ij1 s ASP 245 Ca 0.53 0.62 -0.12 0.00 -3.30 0.00 0.00 52.55 50.28 3ij1 s ASP 245 Cb -0.25 -0.85 0.29 0.00 -1.09 0.00 0.00 42.92 41.02 3ij1 s ASP 245 CO 0.31 -4.32 1.62 0.25 0.70 0.00 0.00 175.17 173.73 3ij1 h LEU 246 N -2.71 -0.58 -1.09 2.11 5.85 -1.91 -1.90 115.31 115.08 3ij1 h LEU 246 Ca -0.44 0.20 0.00 0.00 0.84 0.00 0.00 57.88 58.48 3ij1 h LEU 246 Cb 1.30 0.41 0.00 0.00 0.37 0.00 0.00 40.66 42.73 3ij1 h LEU 246 CO 0.32 -0.22 -0.19 0.18 -0.34 0.00 0.00 178.44 178.20 3ij1 n LEU 247 N -5.44 1.88 -1.48 2.25 4.77 -1.26 -4.79 117.00 112.94 3ij1 n LEU 247 Ca 0.09 -0.63 -0.11 0.00 -0.03 0.00 0.00 56.01 55.34 3ij1 n LEU 247 Cb 0.37 -0.03 0.01 0.00 -2.33 0.00 0.00 43.42 41.44 3ij1 n LEU 247 CO 0.03 0.33 -0.03 0.61 -1.33 0.00 0.00 177.39 177.00 3ij1 n GLY 248 N 1.32 0.07 0.11 -0.72 0.00 -0.72 -4.67 105.19 100.59 3ij1 n GLY 248 Ca 0.14 -0.37 0.10 0.00 0.00 0.00 0.00 46.02 45.88 3ij1 n GLY 248 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ij1 h GLU 249 N -0.51 0.00 -3.47 1.61 5.08 -1.93 -3.45 114.58 111.92 3ij1 h GLU 249 Ca -0.25 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 58.05 3ij1 h GLU 249 Cb 1.18 0.00 -0.13 0.00 0.50 0.00 0.00 28.75 30.30 3ij1 h GLU 249 CO 0.28 0.04 -0.11 -1.59 -1.00 0.00 0.00 179.01 176.62 3ij1 s LYS 250 N -3.30 1.08 -0.02 2.33 -2.85 -1.26 -0.45 119.74 115.27 3ij1 s LYS 250 Ca -0.01 -0.79 0.06 0.00 -1.00 0.00 0.00 55.97 54.24 3ij1 s LYS 250 Cb 0.09 0.45 -0.01 0.00 -2.06 0.00 0.00 37.83 36.30 3ij1 s LYS 250 CO 0.79 -0.42 -0.20 0.42 0.10 0.00 0.00 175.35 176.04 3ij1 s ILE 251 N -3.83 1.61 -0.16 3.79 1.01 -0.07 -1.30 121.20 122.26 3ij1 s ILE 251 Ca 0.05 -0.86 -0.03 0.00 0.00 0.00 0.00 60.65 59.81 3ij1 s ILE 251 Cb 0.02 -1.35 -0.02 0.00 0.01 0.00 0.00 42.46 41.12 3ij1 s ILE 251 CO -0.10 0.46 -0.06 -0.32 0.00 0.00 0.00 174.94 174.91 3ij1 s MET 252 N -0.40 3.55 0.31 2.79 1.75 -0.37 -0.72 119.30 126.21 3ij1 s MET 252 Ca 0.06 -0.58 0.10 0.00 -1.25 0.00 0.00 55.69 54.02 3ij1 s MET 252 Cb -0.09 -2.85 -0.05 0.00 2.84 0.00 0.00 34.83 34.68 3ij1 s MET 252 CO -0.00 0.17 -0.10 -1.54 -0.65 0.00 0.00 175.02 172.90 3ij1 s SER 253 N 0.52 3.88 0.13 1.11 1.04 0.26 -0.72 113.70 119.91 3ij1 s SER 253 Ca -0.05 -1.01 -0.16 0.00 0.48 0.00 0.00 55.95 55.21 3ij1 s SER 253 Cb -0.15 -0.44 0.03 0.00 0.10 0.00 0.00 66.02 65.57 3ij1 s SER 253 CO 0.03 -0.09 0.40 0.00 0.98 0.00 0.00 173.24 174.56 3ij1 n GLY 255 N -0.22 1.98 0.27 0.00 0.00 -1.14 -1.06 105.19 105.02 3ij1 n GLY 255 Ca -0.15 -0.61 0.18 0.00 0.00 0.00 0.00 46.02 45.43 3ij1 n GLY 255 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3ij1 h MET 256 N 0.00 0.00 0.00 1.61 2.86 -1.29 -1.75 114.93 116.36 3ij1 h MET 256 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3ij1 h MET 256 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3ij1 h MET 256 CO 0.00 0.00 0.00 -0.40 1.06 0.00 0.00 176.91 177.57 3ij1 n ASP 257 N -2.93 0.00 0.00 1.22 5.68 -1.26 -4.55 116.55 114.71 3ij1 n ASP 257 Ca -0.00 -1.63 0.00 0.00 -0.50 0.00 0.00 54.79 52.66 3ij1 n ASP 257 Cb 0.23 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.21 3ij1 n ASP 257 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3ij1 n HIS 258 N -0.59 0.00 -3.96 2.11 8.25 -0.93 -4.99 115.22 115.12 3ij1 n HIS 258 Ca 0.04 0.00 -0.25 0.00 -0.26 0.00 0.00 57.72 57.25 3ij1 n HIS 258 Cb 0.02 -0.44 -0.03 0.00 1.12 0.00 0.00 29.99 30.66 3ij1 n HIS 258 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3ij1 s SER 259 N -2.68 6.31 -0.10 0.41 1.04 -1.26 -4.56 113.70 112.85 3ij1 s SER 259 Ca 0.00 0.14 0.03 0.00 0.48 0.00 0.00 55.95 56.60 3ij1 s SER 259 Cb 0.00 -1.88 -0.00 0.00 0.10 0.00 0.00 66.02 64.24 3ij1 s SER 259 CO 0.00 0.03 -0.22 -0.76 0.98 0.00 0.00 173.24 173.26 3ij1 s LEU 260 N -3.39 2.18 -0.03 2.42 1.43 0.14 -3.04 118.68 118.40 3ij1 s LEU 260 Ca 0.34 -0.53 0.05 0.00 -1.03 0.00 0.00 54.13 52.97 3ij1 s LEU 260 Cb -0.11 -1.44 -0.01 0.00 0.03 0.00 0.00 46.19 44.67 3ij1 s LEU 260 CO 0.28 0.16 -0.18 -0.54 0.23 0.00 0.00 176.35 176.31 3ij1 s LYS 261 N 0.34 1.59 -0.17 1.70 1.02 0.42 -1.66 119.74 122.98 3ij1 s LYS 261 Ca -0.18 -0.63 -0.11 0.00 0.02 0.00 0.00 55.97 55.08 3ij1 s LYS 261 Cb -0.18 -1.47 -0.05 0.00 -0.52 0.00 0.00 37.83 35.62 3ij1 s LYS 261 CO 0.08 0.33 0.18 -1.17 -0.92 0.00 0.00 175.35 173.86 3ij1 s LEU 262 N -0.24 4.26 -0.19 3.17 2.96 -0.11 -0.58 118.68 127.96 3ij1 s LEU 262 Ca 0.03 0.37 -0.01 0.00 -0.22 0.00 0.00 54.13 54.30 3ij1 s LEU 262 Cb -0.09 -2.17 0.05 0.00 0.50 0.00 0.00 46.19 44.48 3ij1 s LEU 262 CO 0.00 0.21 -0.03 0.26 -1.32 0.00 0.00 176.35 175.47 3ij1 s TRP 263 N 0.07 1.74 -0.05 5.38 0.52 0.10 0.65 118.94 127.35 3ij1 s TRP 263 Ca 0.12 -1.23 -0.29 0.00 0.02 0.00 0.00 56.10 54.71 3ij1 s TRP 263 Cb -0.12 -1.32 -0.02 0.00 -1.15 0.00 0.00 33.47 30.86 3ij1 s TRP 263 CO 0.01 -0.66 0.97 1.03 0.02 0.00 0.00 176.95 178.32 3ij1 s ARG 264 N 1.62 4.49 -0.08 4.98 0.52 -1.26 -0.89 118.95 128.32 3ij1 s ARG 264 Ca -0.02 1.37 0.13 0.00 -0.52 0.00 0.00 55.73 56.69 3ij1 s ARG 264 Cb -0.17 -3.50 0.35 0.00 0.52 0.00 0.00 34.95 32.16 3ij1 s ARG 264 CO -0.07 -0.17 1.28 0.44 0.02 0.00 0.00 175.30 176.80 3ij1 n ILE 265 N 4.20 1.60 -0.38 1.52 -5.35 0.40 -4.37 119.36 116.98 3ij1 n ILE 265 Ca 0.07 -1.48 0.08 0.00 -0.27 0.00 0.00 62.75 61.15 3ij1 n ILE 265 Cb 0.50 0.13 0.25 0.00 -1.74 0.00 0.00 39.64 38.77 3ij1 n ILE 265 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3ij1 n ASN 266 N -0.23 3.62 -4.71 7.28 6.94 -0.96 -4.12 115.26 123.08 3ij1 n ASN 266 Ca 0.14 -2.16 -0.32 0.00 -0.02 0.00 0.00 54.58 52.23 3ij1 n ASN 266 Cb 0.61 -0.39 0.13 0.00 -2.36 0.00 0.00 39.78 37.76 3ij1 n ASN 266 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3ij1 s SER 267 N -1.06 3.66 0.24 0.53 1.04 -1.26 -4.76 113.70 112.09 3ij1 s SER 267 Ca 0.37 2.12 -0.04 0.00 0.48 0.00 0.00 55.95 58.88 3ij1 s SER 267 Cb 0.21 -2.56 0.43 0.00 0.10 0.00 0.00 66.02 64.21 3ij1 s SER 267 CO 0.22 -2.61 1.75 0.50 0.98 0.00 0.00 173.24 174.08 3ij1 h LYS 268 N -1.30 0.50 -0.22 4.02 3.64 -1.98 -0.54 116.57 120.69 3ij1 h LYS 268 Ca -0.44 -0.03 -0.01 0.00 -1.27 0.00 0.00 60.65 58.90 3ij1 h LYS 268 Cb 1.26 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.96 3ij1 h LYS 268 CO 0.46 0.33 0.12 -0.09 -2.27 0.00 0.00 179.45 178.00 3ij1 h ARG 269 N 0.51 0.32 -0.14 1.90 2.43 -1.98 -2.04 114.38 115.38 3ij1 h ARG 269 Ca 0.40 -0.04 -0.17 0.00 -0.81 0.00 0.00 59.98 59.36 3ij1 h ARG 269 Cb 0.56 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 3ij1 h ARG 269 CO -0.36 0.31 -0.63 0.52 -1.51 0.00 0.00 179.97 178.30 3ij1 h MET 270 N 0.24 0.52 -0.37 0.20 2.86 -1.76 -1.38 114.93 115.25 3ij1 h MET 270 Ca 0.08 -0.37 -0.12 0.00 -2.06 0.00 0.00 59.70 57.23 3ij1 h MET 270 Cb 0.09 0.06 -0.01 0.00 0.06 0.00 0.00 31.60 31.80 3ij1 h MET 270 CO -0.01 0.99 -0.26 0.52 1.06 0.00 0.00 176.91 179.20 3ij1 h MET 271 N 0.38 0.75 -0.45 1.72 2.86 -1.09 -1.46 114.93 117.64 3ij1 h MET 271 Ca -0.01 -0.32 -0.13 0.00 -2.06 0.00 0.00 59.70 57.18 3ij1 h MET 271 Cb 1.19 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.82 3ij1 h MET 271 CO 0.12 0.93 -0.24 -0.97 1.06 0.00 0.00 176.91 177.81 3ij1 h ASN 272 N 0.65 0.98 -0.42 1.22 -1.24 -1.32 -2.35 115.58 113.10 3ij1 h ASN 272 Ca 0.08 -0.41 0.01 0.00 0.71 0.00 0.00 56.30 56.69 3ij1 h ASN 272 Cb 0.78 -0.27 -0.02 0.00 0.73 0.00 0.00 38.32 39.53 3ij1 h ASN 272 CO 0.06 1.18 0.26 0.00 -1.29 0.00 0.00 177.43 177.64 3ij1 h ALA 273 N 0.84 0.53 -0.40 1.57 0.00 -1.04 0.67 119.26 121.43 3ij1 h ALA 273 Ca 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3ij1 h ALA 273 Cb 0.81 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 3ij1 h ALA 273 CO 0.07 -0.05 0.25 0.82 0.00 0.00 0.00 179.25 180.34 3ij1 h ILE 274 N 0.53 1.12 -0.32 0.00 2.04 -1.25 -0.75 117.51 118.87 3ij1 h ILE 274 Ca 0.16 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.78 3ij1 h ILE 274 Cb -0.03 0.56 -0.02 0.00 -0.74 0.00 0.00 36.82 36.60 3ij1 h ILE 274 CO -0.05 0.11 0.20 0.50 0.00 0.00 0.00 178.15 178.90 3ij1 h LYS 275 N 0.53 0.43 -0.58 2.37 3.64 -1.11 -2.31 116.57 119.53 3ij1 h LYS 275 Ca 0.14 -0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.48 3ij1 h LYS 275 Cb -0.03 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.67 3ij1 h LYS 275 CO -0.03 0.32 0.34 0.93 -2.27 0.00 0.00 179.45 178.75 3ij1 h GLU 276 N 0.41 0.79 -0.68 1.90 4.39 -0.72 -2.05 114.58 118.62 3ij1 h GLU 276 Ca 0.11 -0.07 0.03 0.00 0.34 0.00 0.00 59.36 59.77 3ij1 h GLU 276 Cb -0.00 -0.17 -0.04 0.00 -0.10 0.00 0.00 28.75 28.44 3ij1 h GLU 276 CO -0.02 0.56 0.45 0.66 -1.16 0.00 0.00 179.01 179.50 3ij1 h SER 277 N 0.80 0.72 0.51 1.42 4.64 -0.60 -1.98 113.55 119.06 3ij1 h SER 277 Ca 0.21 -0.01 -0.13 0.00 -0.47 0.00 0.00 61.79 61.39 3ij1 h SER 277 Cb -0.02 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 61.89 3ij1 h SER 277 CO -0.04 0.50 -0.60 1.88 -0.87 0.00 0.00 176.83 177.71 3ij1 h TYR 278 N 0.84 0.12 -0.00 4.77 -1.99 -0.96 -3.08 116.97 116.67 3ij1 h TYR 278 Ca 0.27 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.95 3ij1 h TYR 278 Cb 0.03 -0.02 0.00 0.00 2.00 0.00 0.00 36.73 38.74 3ij1 h TYR 278 CO -0.00 0.66 -0.06 -0.25 -0.00 0.00 0.00 178.16 178.51 3ij1 n ASP 279 N -3.85 0.13 -4.66 3.88 8.00 -0.80 -4.85 116.55 114.41 3ij1 n ASP 279 Ca -0.02 -0.01 -0.42 0.00 0.71 0.00 0.00 54.79 55.05 3ij1 n ASP 279 Cb 0.60 -0.27 -0.03 0.00 -0.02 0.00 0.00 41.12 41.40 3ij1 n ASP 279 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3ij1 s TYR 280 N -2.74 3.37 -0.22 1.24 5.04 -0.88 -5.01 117.35 118.15 3ij1 s TYR 280 Ca 0.22 1.36 -0.03 0.00 -2.44 0.00 0.00 57.07 56.19 3ij1 s TYR 280 Cb 0.20 -3.16 0.07 0.00 0.35 0.00 0.00 41.96 39.42 3ij1 s TYR 280 CO 0.51 -0.39 0.05 1.21 -1.34 0.00 0.00 175.55 175.59 3ij1 s ASN 281 N 1.22 3.16 0.61 4.32 3.84 -1.26 -4.88 114.94 121.95 3ij1 s ASN 281 Ca 0.41 -1.00 0.33 0.00 0.21 0.00 0.00 52.86 52.81 3ij1 s ASN 281 Cb -0.16 -0.63 1.92 0.00 -0.55 0.00 0.00 41.25 41.83 3ij1 s ASN 281 CO 0.09 -0.33 2.23 1.55 -2.79 0.00 0.00 177.10 177.84 3ij1 h PRO 282 N 8.23 0.00 0.00 0.43 0.13 -1.92 0.08 132.00 138.96 3ij1 h PRO 282 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 3ij1 h PRO 282 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3ij1 h PRO 282 CO 0.37 0.00 -0.02 0.09 -0.23 0.00 0.00 178.00 178.21 3ij1 n ASN 283 N -3.60 0.15 -0.55 1.44 3.02 -1.26 -3.63 115.26 110.82 3ij1 n ASN 283 Ca -0.02 0.48 0.05 0.00 -0.03 0.00 0.00 54.58 55.07 3ij1 n ASN 283 Cb 0.16 -0.52 0.12 0.00 -0.61 0.00 0.00 39.78 38.93 3ij1 n ASN 283 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3ij1 n LYS 284 N -1.62 2.26 -3.95 3.52 4.76 0.01 -5.04 118.16 118.10 3ij1 n LYS 284 Ca 0.07 -1.79 -0.09 0.00 -2.87 0.00 0.00 58.31 53.63 3ij1 n LYS 284 Cb 0.35 -1.24 -0.05 0.00 -1.84 0.00 0.00 35.03 32.25 3ij1 n LYS 284 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3ij1 s THR 285 N -0.97 0.01 -0.11 -0.18 -1.32 -1.20 -5.02 115.64 106.85 3ij1 s THR 285 Ca 0.19 -1.31 0.20 0.00 -1.21 0.00 0.00 61.69 59.57 3ij1 s THR 285 Cb 0.11 -2.05 -0.28 0.00 -1.51 0.00 0.00 72.50 68.76 3ij1 s THR 285 CO 0.14 -0.06 0.35 0.59 -2.21 0.00 0.00 174.62 173.43 3ij1 n ASN 286 N -0.35 0.07 -4.78 8.08 4.13 -1.26 -4.87 115.26 116.29 3ij1 n ASN 286 Ca -0.04 0.03 -0.37 0.00 1.68 0.00 0.00 54.58 55.89 3ij1 n ASN 286 Cb 0.62 1.45 -0.02 0.00 -1.54 0.00 0.00 39.78 40.29 3ij1 n ASN 286 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ij1 s ARG 287 N -3.07 3.90 0.71 3.52 1.70 -1.26 -5.05 118.95 119.39 3ij1 s ARG 287 Ca -0.08 1.67 -0.11 0.00 -0.47 0.00 0.00 55.73 56.74 3ij1 s ARG 287 Cb 0.10 -2.44 0.01 0.00 -0.57 0.00 0.00 34.95 32.06 3ij1 s ARG 287 CO 0.87 -0.41 1.06 -1.25 -1.08 0.00 0.00 175.30 174.50 3ij1 s PRO 288 N -2.65 2.86 0.01 3.89 0.04 -1.26 -4.93 135.00 132.95 3ij1 s PRO 288 Ca 0.62 0.90 -0.30 0.00 0.04 0.00 0.00 61.00 62.26 3ij1 s PRO 288 Cb -0.26 -1.98 -0.04 0.00 0.04 0.00 0.00 34.50 32.26 3ij1 s PRO 288 CO 0.32 -1.14 1.03 0.12 0.04 0.00 0.00 177.00 177.36 3ij1 s PHE 289 N -3.07 3.60 -0.20 0.56 5.36 -1.26 -5.02 117.98 117.96 3ij1 s PHE 289 Ca 0.58 1.61 -0.16 0.00 -0.96 0.00 0.00 56.93 57.99 3ij1 s PHE 289 Cb -0.14 -3.19 -0.04 0.00 -0.34 0.00 0.00 43.02 39.31 3ij1 s PHE 289 CO 0.55 -0.31 0.42 0.42 -1.46 0.00 0.00 175.22 174.84 3ij1 s ILE 290 N 1.05 5.19 0.26 3.12 1.01 -1.26 -4.95 121.20 125.62 3ij1 s ILE 290 Ca 0.53 0.75 -0.20 0.00 0.00 0.00 0.00 60.65 61.74 3ij1 s ILE 290 Cb -0.23 -3.75 -0.09 0.00 0.01 0.00 0.00 42.46 38.41 3ij1 s ILE 290 CO 0.28 0.25 0.77 -0.44 0.00 0.00 0.00 174.94 175.80 3ij1 s SER 291 N 1.02 7.06 0.23 3.58 0.01 -1.26 -4.94 113.70 119.40 3ij1 s SER 291 Ca 0.20 1.48 -0.30 0.00 1.31 0.00 0.00 55.95 58.64 3ij1 s SER 291 Cb -0.15 -2.44 -0.09 0.00 0.21 0.00 0.00 66.02 63.55 3ij1 s SER 291 CO 0.08 -0.03 1.14 -1.10 0.41 0.00 0.00 173.24 173.74 3ij1 s GLN 292 N -2.18 4.57 -0.42 12.44 -1.52 -0.41 -4.92 119.66 127.22 3ij1 s GLN 292 Ca 0.47 1.83 -0.11 0.00 -1.95 0.00 0.00 55.36 55.59 3ij1 s GLN 292 Cb -0.16 -3.22 0.06 0.00 -0.22 0.00 0.00 33.01 29.48 3ij1 s GLN 292 CO 0.21 0.07 0.28 0.15 -0.25 0.00 0.00 175.29 175.74 3ij1 s LYS 293 N -0.84 2.76 -0.42 2.91 3.01 -1.26 -0.52 119.74 125.37 3ij1 s LYS 293 Ca 0.48 -1.32 -0.14 0.00 -1.01 0.00 0.00 55.97 53.98 3ij1 s LYS 293 Cb -0.32 -3.86 0.05 0.00 -1.01 0.00 0.00 37.83 32.69 3ij1 s LYS 293 CO 0.39 -0.90 0.31 0.42 0.51 0.00 0.00 175.35 176.08 3ij1 s ILE 294 N 1.52 4.99 -1.67 2.17 -1.09 0.16 -4.95 121.20 122.31 3ij1 s ILE 294 Ca 0.03 -0.93 0.16 0.00 -2.23 0.00 0.00 60.65 57.68 3ij1 s ILE 294 Cb -0.22 -3.88 0.31 0.00 -1.58 0.00 0.00 42.46 37.09 3ij1 s ILE 294 CO 0.05 -0.41 1.22 1.41 -1.23 0.00 0.00 174.94 175.98 3ij1 n HIS 295 N 5.11 0.38 -3.65 3.97 8.25 -1.26 -1.06 115.22 126.96 3ij1 n HIS 295 Ca -0.12 -0.28 -0.20 0.00 -0.26 0.00 0.00 57.72 56.86 3ij1 n HIS 295 Cb 0.45 -0.01 -0.17 0.00 1.12 0.00 0.00 29.99 31.38 3ij1 n HIS 295 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3ij1 s PHE 296 N -1.16 -0.00 0.75 4.41 0.08 -1.26 -3.94 117.98 116.85 3ij1 s PHE 296 Ca 0.28 0.26 -0.12 0.00 0.12 0.00 0.00 56.93 57.46 3ij1 s PHE 296 Cb 0.16 -0.45 0.05 0.00 -0.57 0.00 0.00 43.02 42.21 3ij1 s PHE 296 CO 0.22 -0.29 1.12 -2.14 -0.10 0.00 0.00 175.22 174.03 3ij1 s PRO 297 N 2.21 2.21 0.00 0.24 0.02 -1.26 -4.95 135.00 133.47 3ij1 s PRO 297 Ca 0.04 1.38 0.27 0.00 0.02 0.00 0.00 61.00 62.70 3ij1 s PRO 297 Cb -0.13 -1.88 0.82 0.00 0.02 0.00 0.00 34.50 33.33 3ij1 s PRO 297 CO -0.05 -1.70 1.63 -0.25 -0.33 0.00 0.00 177.00 176.29 3ij1 n ASP 298 N -3.19 0.34 -3.55 2.53 8.00 0.21 -4.82 116.55 116.08 3ij1 n ASP 298 Ca 0.10 -0.04 -0.12 0.00 0.71 0.00 0.00 54.79 55.45 3ij1 n ASP 298 Cb 0.52 -0.03 -0.05 0.00 -0.02 0.00 0.00 41.12 41.54 3ij1 n ASP 298 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3ij1 s PHE 299 N -2.95 -0.45 -0.13 1.24 5.36 -1.23 -2.66 117.98 117.16 3ij1 s PHE 299 Ca 0.14 0.70 -0.11 0.00 -0.96 0.00 0.00 56.93 56.70 3ij1 s PHE 299 Cb 0.18 0.45 0.04 0.00 -0.34 0.00 0.00 43.02 43.35 3ij1 s PHE 299 CO 0.62 -0.45 0.34 0.45 -1.46 0.00 0.00 175.22 174.73 3ij1 s SER 300 N -1.33 -0.37 0.00 6.13 0.15 -1.26 -0.93 113.70 116.08 3ij1 s SER 300 Ca -0.03 0.70 -0.01 0.00 0.70 0.00 0.00 55.95 57.31 3ij1 s SER 300 Cb -0.00 0.68 -0.01 0.00 -1.71 0.00 0.00 66.02 64.98 3ij1 s SER 300 CO 0.02 -0.13 0.01 0.28 1.20 0.00 0.00 173.24 174.62 3ij1 s THR 301 N 0.46 0.04 -0.14 6.45 -1.32 -0.66 -4.96 115.64 115.51 3ij1 s THR 301 Ca -0.02 -0.33 0.15 0.00 -1.21 0.00 0.00 61.69 60.27 3ij1 s THR 301 Cb -0.04 -0.13 0.27 0.00 -1.51 0.00 0.00 72.50 71.08 3ij1 s THR 301 CO -0.02 -0.18 1.16 0.54 -2.21 0.00 0.00 174.62 173.90 3ij1 n ARG 302 N 2.51 1.85 -0.16 7.08 1.74 -1.26 -0.68 116.66 127.74 3ij1 n ARG 302 Ca -0.16 -2.40 0.11 0.00 -0.77 0.00 0.00 57.85 54.63 3ij1 n ARG 302 Cb 0.58 -1.44 0.28 0.00 -1.02 0.00 0.00 32.46 30.85 3ij1 n ARG 302 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3ij1 n ASP 303 N -1.09 2.66 -0.12 0.55 8.00 -1.26 -4.44 116.55 120.85 3ij1 n ASP 303 Ca 0.14 -1.89 -0.26 0.00 0.71 0.00 0.00 54.79 53.49 3ij1 n ASP 303 Cb 0.59 -0.21 -0.10 0.00 -0.02 0.00 0.00 41.12 41.38 3ij1 n ASP 303 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3ij1 n ILE 304 N 0.97 1.53 -4.52 0.53 2.08 -1.26 -5.02 119.36 113.67 3ij1 n ILE 304 Ca 0.18 -0.23 -0.24 0.00 0.56 0.00 0.00 62.75 63.02 3ij1 n ILE 304 Cb 0.48 -1.96 -0.11 0.00 -0.75 0.00 0.00 39.64 37.30 3ij1 n ILE 304 CO 0.00 0.00 0.00 -1.00 0.56 0.00 0.00 176.55 176.11 3ij1 s HIS 305 N -2.45 2.24 -0.13 1.39 3.76 -1.26 -5.05 115.29 113.79 3ij1 s HIS 305 Ca -0.34 -0.67 0.15 0.00 -0.15 0.00 0.00 55.06 54.04 3ij1 s HIS 305 Cb 0.11 -1.39 0.31 0.00 1.11 0.00 0.00 32.58 32.73 3ij1 s HIS 305 CO 0.53 0.38 1.16 0.54 -0.85 0.00 0.00 174.74 176.50 3ij1 n ARG 306 N -0.76 1.12 -2.07 1.40 3.00 -1.26 -4.97 116.66 113.12 3ij1 n ARG 306 Ca -0.05 -2.60 -0.04 0.00 -0.01 0.00 0.00 57.85 55.16 3ij1 n ARG 306 Cb 0.65 -1.29 0.00 0.00 0.00 0.00 0.00 32.46 31.82 3ij1 n ARG 306 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 3ij1 n ASN 307 N -0.98 -0.57 -4.66 0.55 2.85 -1.26 -5.08 115.26 106.10 3ij1 n ASN 307 Ca 0.14 -1.54 -0.53 0.00 -0.11 0.00 0.00 54.58 52.55 3ij1 n ASN 307 Cb 0.71 0.99 -0.06 0.00 1.24 0.00 0.00 39.78 42.66 3ij1 n ASN 307 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 3ij1 n TYR 308 N -0.17 1.91 -3.31 1.20 0.53 -1.26 -4.32 117.16 111.73 3ij1 n TYR 308 Ca -0.01 0.48 -0.42 0.00 -1.02 0.00 0.00 57.90 56.92 3ij1 n TYR 308 Cb 0.18 -2.45 -0.09 0.00 -1.03 0.00 0.00 39.34 35.96 3ij1 n TYR 308 CO 0.00 0.00 0.00 0.08 -1.02 0.00 0.00 176.86 175.92 3ij1 s VAL 309 N 2.13 5.08 -1.24 -0.72 1.01 -0.71 -3.57 120.40 122.38 3ij1 s VAL 309 Ca 0.90 -0.12 0.10 0.00 0.00 0.00 0.00 61.98 62.87 3ij1 s VAL 309 Cb -0.93 -3.99 0.11 0.00 0.00 0.00 0.00 36.38 31.57 3ij1 s VAL 309 CO 0.53 -0.32 0.88 -0.90 0.00 0.00 0.00 175.10 175.29 3ij1 n ASP 310 N 5.61 1.99 -3.64 3.32 5.75 -0.88 -2.89 116.55 125.81 3ij1 n ASP 310 Ca -0.07 -1.50 -0.06 0.00 -0.01 0.00 0.00 54.79 53.15 3ij1 n ASP 310 Cb 0.48 -0.03 -0.07 0.00 -1.03 0.00 0.00 41.12 40.48 3ij1 n ASP 310 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ij1 s VAL 312 N 1.64 0.20 -0.05 0.00 0.11 -1.26 -1.81 120.40 119.22 3ij1 s VAL 312 Ca -0.10 -0.13 -0.04 0.00 -2.93 0.00 0.00 61.98 58.78 3ij1 s VAL 312 Cb -0.05 -0.18 0.02 0.00 -1.53 0.00 0.00 36.38 34.64 3ij1 s VAL 312 CO -0.19 0.04 0.13 -0.60 -3.33 0.00 0.00 175.10 171.15 3ij1 s ARG 313 N -0.11 0.12 0.30 1.54 6.06 0.52 -4.40 118.95 122.99 3ij1 s ARG 313 Ca 0.00 0.24 -0.29 0.00 -2.50 0.00 0.00 55.73 53.18 3ij1 s ARG 313 Cb -0.01 -0.02 -0.10 0.00 0.06 0.00 0.00 34.95 34.88 3ij1 s ARG 313 CO -0.00 -0.07 1.19 -1.58 -2.50 0.00 0.00 175.30 172.34 3ij1 s TRP 314 N 0.45 3.34 -0.57 5.12 0.52 -1.26 0.30 118.94 126.84 3ij1 s TRP 314 Ca -0.03 1.57 0.04 0.00 0.02 0.00 0.00 56.10 57.70 3ij1 s TRP 314 Cb -0.05 -3.47 0.15 0.00 -1.15 0.00 0.00 33.47 28.96 3ij1 s TRP 314 CO -0.02 -1.15 0.37 -1.17 0.02 0.00 0.00 176.95 175.00 3ij1 s LEU 315 N -1.61 3.80 0.00 2.99 2.96 0.12 -4.84 118.68 122.10 3ij1 s LEU 315 Ca 0.46 -3.33 0.00 0.00 -0.22 0.00 0.00 54.13 51.05 3ij1 s LEU 315 Cb -0.36 -1.34 0.00 0.00 0.50 0.00 0.00 46.19 44.99 3ij1 s LEU 315 CO 0.47 -0.16 0.00 0.61 -1.32 0.00 0.00 176.35 175.94 3ij1 n GLY 316 N 2.64 3.40 0.31 7.98 0.00 -1.26 -2.02 105.19 116.23 3ij1 n GLY 316 Ca 0.16 -0.11 0.14 0.00 0.00 0.00 0.00 46.02 46.21 3ij1 n GLY 316 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ij1 n ASP 317 N 7.75 1.06 -4.97 1.61 8.00 -1.26 -4.77 116.55 123.97 3ij1 n ASP 317 Ca 0.00 -1.11 -0.21 0.00 0.71 0.00 0.00 54.79 54.18 3ij1 n ASP 317 Cb 0.00 0.03 -0.00 0.00 -0.02 0.00 0.00 41.12 41.13 3ij1 n ASP 317 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ij1 s LEU 318 N -2.24 3.94 -0.05 0.64 1.43 -0.86 -4.87 118.68 116.67 3ij1 s LEU 318 Ca 0.33 0.06 0.04 0.00 -1.03 0.00 0.00 54.13 53.53 3ij1 s LEU 318 Cb 0.20 -2.95 -0.02 0.00 0.03 0.00 0.00 46.19 43.45 3ij1 s LEU 318 CO 0.42 -0.44 -0.17 -0.63 0.23 0.00 0.00 176.35 175.76 3ij1 s ILE 319 N -2.27 2.79 -0.19 -0.59 -1.09 0.65 0.14 121.20 120.64 3ij1 s ILE 319 Ca 0.44 -0.82 -0.04 0.00 -2.23 0.00 0.00 60.65 58.00 3ij1 s ILE 319 Cb -0.10 -2.08 -0.02 0.00 -1.58 0.00 0.00 42.46 38.69 3ij1 s ILE 319 CO 0.33 0.58 -0.03 -0.76 -1.23 0.00 0.00 174.94 173.83 3ij1 s LEU 320 N -0.56 3.13 0.03 2.97 1.43 0.15 -1.37 118.68 124.46 3ij1 s LEU 320 Ca 0.08 -0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 52.91 3ij1 s LEU 320 Cb -0.11 -1.78 -0.02 0.00 0.03 0.00 0.00 46.19 44.31 3ij1 s LEU 320 CO 0.01 0.08 0.05 -0.94 0.23 0.00 0.00 176.35 175.78 3ij1 s SER 321 N 0.88 0.22 0.10 2.29 1.04 -0.67 -0.36 113.70 117.21 3ij1 s SER 321 Ca -0.00 -0.56 0.03 0.00 0.48 0.00 0.00 55.95 55.90 3ij1 s SER 321 Cb -0.14 0.19 -0.04 0.00 0.10 0.00 0.00 66.02 66.13 3ij1 s SER 321 CO 0.01 -0.46 -0.09 -1.59 0.98 0.00 0.00 173.24 172.10 3ij1 s LYS 322 N -2.41 0.84 0.00 4.02 -2.85 -0.75 -0.16 119.74 118.43 3ij1 s LYS 322 Ca -0.07 -1.22 0.00 0.00 -1.00 0.00 0.00 55.97 53.68 3ij1 s LYS 322 Cb -0.03 -0.40 0.00 0.00 -2.06 0.00 0.00 37.83 35.34 3ij1 s LYS 322 CO -0.04 0.04 0.00 0.45 0.10 0.00 0.00 175.35 175.90 3ij1 n SER 323 N 0.33 1.94 -2.02 0.03 2.88 -1.25 -2.07 113.62 113.45 3ij1 n SER 323 Ca -0.14 -0.16 -0.22 0.00 -1.33 0.00 0.00 58.87 57.01 3ij1 n SER 323 Cb 0.59 0.00 0.10 0.00 -0.75 0.00 0.00 64.21 64.15 3ij1 n SER 323 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ij1 n GLU 325 N -0.58 2.32 -3.24 0.00 1.02 -1.26 -4.23 120.64 114.68 3ij1 n GLU 325 Ca 0.47 -2.87 -0.22 0.00 -0.02 0.00 0.00 57.16 54.52 3ij1 n GLU 325 Cb 1.07 -1.76 0.05 0.00 -0.02 0.00 0.00 31.44 30.78 3ij1 n GLU 325 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3ij1 n ASN 326 N -0.85 -5.99 -3.72 1.62 3.02 -1.26 -5.01 115.26 103.08 3ij1 n ASN 326 Ca 0.22 -0.38 -0.13 0.00 -0.03 0.00 0.00 54.58 54.26 3ij1 n ASN 326 Cb 0.86 -4.71 -0.10 0.00 -0.61 0.00 0.00 39.78 35.22 3ij1 n ASN 326 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ij1 s ALA 327 N -3.22 -1.08 -0.23 5.41 0.00 -1.26 -2.48 121.76 118.90 3ij1 s ALA 327 Ca 0.41 1.25 -0.13 0.00 0.00 0.00 0.00 51.96 53.49 3ij1 s ALA 327 Cb -0.18 -0.73 -0.04 0.00 0.00 0.00 0.00 23.12 22.16 3ij1 s ALA 327 CO 0.51 -0.21 0.27 0.42 0.00 0.00 0.00 175.76 176.75 3ij1 s ILE 328 N 0.30 5.28 -0.16 0.00 1.01 -0.64 -3.86 121.20 123.13 3ij1 s ILE 328 Ca -0.01 0.42 -0.08 0.00 0.00 0.00 0.00 60.65 60.98 3ij1 s ILE 328 Cb -0.03 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 3ij1 s ILE 328 CO -0.00 0.29 0.09 -0.69 0.00 0.00 0.00 174.94 174.63 3ij1 s VAL 329 N 1.26 5.09 -0.28 2.92 1.01 0.77 -0.51 120.40 130.66 3ij1 s VAL 329 Ca 0.13 0.07 -0.11 0.00 0.00 0.00 0.00 61.98 62.06 3ij1 s VAL 329 Cb -0.14 -3.27 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 3ij1 s VAL 329 CO 0.06 0.50 0.20 0.00 0.00 0.00 0.00 175.10 175.87 3ij1 s TRP 331 N 1.71 0.54 0.02 0.00 1.48 -0.47 -0.37 118.94 121.84 3ij1 s TRP 331 Ca 0.08 -0.87 -0.02 0.00 -1.06 0.00 0.00 56.10 54.23 3ij1 s TRP 331 Cb -0.16 -0.03 -0.01 0.00 -1.16 0.00 0.00 33.47 32.11 3ij1 s TRP 331 CO 0.10 -0.85 0.02 -1.59 -4.06 0.00 0.00 176.95 170.57 3ij1 s LYS 332 N -4.04 0.36 0.63 3.25 -2.85 -0.46 -0.25 119.74 116.38 3ij1 s LYS 332 Ca 0.25 -0.56 -0.18 0.00 -1.00 0.00 0.00 55.97 54.48 3ij1 s LYS 332 Cb 0.02 0.14 -0.01 0.00 -2.06 0.00 0.00 37.83 35.91 3ij1 s LYS 332 CO 0.07 -0.07 1.22 -2.14 0.10 0.00 0.00 175.35 174.54 3ij1 s PRO 333 N -1.46 2.71 1.82 1.78 0.02 -1.26 -0.74 135.00 137.87 3ij1 s PRO 333 Ca -0.15 1.85 0.00 0.00 0.02 0.00 0.00 61.00 62.72 3ij1 s PRO 333 Cb -0.09 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.54 3ij1 s PRO 333 CO -0.00 -1.42 0.00 0.41 -0.33 0.00 0.00 177.00 175.66 3ij1 n GLY 334 N 0.54 -1.24 3.95 0.52 0.00 0.94 -4.74 105.19 105.16 3ij1 n GLY 334 Ca 0.14 -1.23 -0.24 0.00 0.00 0.00 0.00 46.02 44.69 3ij1 n GLY 334 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ij1 s LYS 335 N 0.00 2.33 0.37 1.61 1.02 -1.26 -2.88 119.74 120.93 3ij1 s LYS 335 Ca 0.00 -0.52 0.16 0.00 0.02 0.00 0.00 55.97 55.63 3ij1 s LYS 335 Cb 0.00 -2.32 1.06 0.00 -0.52 0.00 0.00 37.83 36.05 3ij1 s LYS 335 CO 0.00 -1.01 1.73 1.98 -0.92 0.00 0.00 175.35 177.13 3ij1 h MET 336 N -0.30 0.41 -0.01 1.68 -1.53 -1.93 0.32 114.93 113.56 3ij1 h MET 336 Ca -0.43 -0.02 0.00 0.00 -3.44 0.00 0.00 59.70 55.80 3ij1 h MET 336 Cb 1.31 -0.09 0.00 0.00 -0.55 0.00 0.00 31.60 32.26 3ij1 h MET 336 CO 0.56 0.27 -0.31 -0.85 0.14 0.00 0.00 176.91 176.72 3ij1 n GLU 337 N -4.77 1.09 -2.40 0.39 0.00 -1.26 -4.94 120.64 108.75 3ij1 n GLU 337 Ca 0.28 -0.76 -0.43 0.00 0.00 0.00 0.00 57.16 56.25 3ij1 n GLU 337 Cb 0.90 -1.48 -0.02 0.00 0.00 0.00 0.00 31.44 30.83 3ij1 n GLU 337 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3ij1 s ASP 338 N -2.44 6.97 0.10 -1.84 1.01 0.10 -5.00 116.67 115.56 3ij1 s ASP 338 Ca 0.23 1.81 -0.31 0.00 0.71 0.00 0.00 52.55 54.99 3ij1 s ASP 338 Cb 0.19 -2.55 -0.07 0.00 1.01 0.00 0.00 42.92 41.50 3ij1 s ASP 338 CO 0.52 -0.69 1.38 -0.62 0.21 0.00 0.00 175.17 175.96 3ij1 s ASP 339 N 1.81 6.85 0.42 0.27 3.68 -1.26 -4.86 116.67 123.59 3ij1 s ASP 339 Ca 0.57 2.28 0.16 0.00 2.13 0.00 0.00 52.55 57.69 3ij1 s ASP 339 Cb -0.24 -2.58 1.06 0.00 -1.45 0.00 0.00 42.92 39.71 3ij1 s ASP 339 CO 0.19 -0.65 1.89 -0.29 0.13 0.00 0.00 175.17 176.45 3ij1 h ILE 340 N 4.35 0.75 -0.00 4.11 6.09 -1.91 0.23 117.51 131.13 3ij1 h ILE 340 Ca -0.42 -0.14 0.00 0.00 -1.37 0.00 0.00 64.86 62.93 3ij1 h ILE 340 Cb 1.21 0.30 0.00 0.00 0.47 0.00 0.00 36.82 38.80 3ij1 h ILE 340 CO 0.86 0.08 -0.07 0.47 -3.07 0.00 0.00 178.15 176.42 3ij1 n ASP 341 N -4.49 0.57 -0.53 2.19 8.00 -1.26 -3.00 116.55 118.03 3ij1 n ASP 341 Ca 0.16 -0.83 0.11 0.00 0.71 0.00 0.00 54.79 54.94 3ij1 n ASP 341 Cb 0.59 -0.04 0.01 0.00 -0.02 0.00 0.00 41.12 41.66 3ij1 n ASP 341 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3ij1 n LYS 342 N -0.76 1.39 -2.21 -1.24 4.76 0.06 -4.96 118.16 115.19 3ij1 n LYS 342 Ca 0.17 -1.09 -0.42 0.00 -2.87 0.00 0.00 58.31 54.10 3ij1 n LYS 342 Cb 0.26 -1.45 -0.03 0.00 -1.84 0.00 0.00 35.03 31.97 3ij1 n LYS 342 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 3ij1 s ILE 343 N -2.35 3.55 0.18 -0.18 -1.09 -1.13 -4.99 121.20 115.20 3ij1 s ILE 343 Ca 0.19 1.05 -0.00 0.00 -2.23 0.00 0.00 60.65 59.65 3ij1 s ILE 343 Cb 0.18 -3.67 -0.04 0.00 -1.58 0.00 0.00 42.46 37.34 3ij1 s ILE 343 CO 0.52 0.04 0.36 -0.54 -1.23 0.00 0.00 174.94 174.09 3ij1 s LYS 344 N 1.68 3.50 0.64 2.79 1.02 -1.26 -4.97 119.74 123.14 3ij1 s LYS 344 Ca 0.64 -0.40 0.30 0.00 0.02 0.00 0.00 55.97 56.54 3ij1 s LYS 344 Cb -0.34 -2.88 1.64 0.00 -0.52 0.00 0.00 37.83 35.74 3ij1 s LYS 344 CO 0.29 0.44 1.96 -1.35 -0.92 0.00 0.00 175.35 175.77 3ij1 h PRO 345 N 2.10 0.00 -0.00 -1.68 0.11 -1.82 -0.17 132.00 130.53 3ij1 h PRO 345 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 3ij1 h PRO 345 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.30 3ij1 h PRO 345 CO 0.69 0.00 -0.12 -1.13 -0.21 0.00 0.00 178.00 177.22 3ij1 n SER 346 N -3.23 0.54 -4.70 -2.05 3.41 -1.26 -4.58 113.62 101.75 3ij1 n SER 346 Ca 0.01 -0.63 -0.58 0.00 -0.26 0.00 0.00 58.87 57.42 3ij1 n SER 346 Cb 0.43 -0.05 -0.07 0.00 -0.26 0.00 0.00 64.21 64.25 3ij1 n SER 346 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3ij1 n GLU 347 N -0.90 1.07 0.03 4.33 4.07 -0.08 -4.87 120.64 124.29 3ij1 n GLU 347 Ca 0.14 0.39 0.11 0.00 -0.06 0.00 0.00 57.16 57.75 3ij1 n GLU 347 Cb 0.28 -2.06 -0.02 0.00 -0.06 0.00 0.00 31.44 29.59 3ij1 n GLU 347 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 3ij1 n SER 348 N 5.00 0.56 -4.75 4.31 7.64 -1.26 -4.76 113.62 120.37 3ij1 n SER 348 Ca 0.26 -0.13 -0.28 0.00 1.01 0.00 0.00 58.87 59.73 3ij1 n SER 348 Cb 0.12 0.95 -0.06 0.00 -1.01 0.00 0.00 64.21 64.21 3ij1 n SER 348 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3ij1 s ASN 349 N -4.19 5.32 0.16 6.43 0.02 -1.26 -5.02 114.94 116.40 3ij1 s ASN 349 Ca 0.01 -0.15 0.06 0.00 -1.02 0.00 0.00 52.86 51.76 3ij1 s ASN 349 Cb 0.14 -1.34 -0.04 0.00 0.02 0.00 0.00 41.25 40.02 3ij1 s ASN 349 CO 0.82 0.11 -0.13 0.68 0.02 0.00 0.00 177.10 178.61 3ij1 s VAL 350 N -1.59 1.39 -0.13 1.60 -7.23 -1.24 -0.04 120.40 113.15 3ij1 s VAL 350 Ca 0.29 -2.01 0.02 0.00 -1.81 0.00 0.00 61.98 58.47 3ij1 s VAL 350 Cb -0.11 -1.81 0.01 0.00 0.56 0.00 0.00 36.38 35.03 3ij1 s VAL 350 CO 0.21 -0.61 -0.19 -0.89 -0.31 0.00 0.00 175.10 173.32 3ij1 s THR 351 N -2.87 1.81 -0.31 5.32 2.01 0.08 -4.84 115.64 116.84 3ij1 s THR 351 Ca 0.16 -0.82 -0.18 0.00 0.31 0.00 0.00 61.69 61.16 3ij1 s THR 351 Cb -0.01 -1.63 -0.01 0.00 0.01 0.00 0.00 72.50 70.86 3ij1 s THR 351 CO 0.03 0.50 0.53 -0.63 -0.69 0.00 0.00 174.62 174.37 3ij1 s ILE 352 N 0.98 5.02 -1.03 1.82 -1.09 -1.26 -1.36 121.20 124.28 3ij1 s ILE 352 Ca -0.05 0.64 0.22 0.00 -2.23 0.00 0.00 60.65 59.23 3ij1 s ILE 352 Cb -0.15 -3.91 -0.18 0.00 -1.58 0.00 0.00 42.46 36.63 3ij1 s ILE 352 CO -0.03 -0.08 0.99 0.18 -1.23 0.00 0.00 174.94 174.76 3ij1 n LEU 353 N 5.69 0.94 0.00 2.97 4.77 0.50 -5.00 117.00 126.88 3ij1 n LEU 353 Ca -0.04 -0.42 0.00 0.00 -0.03 0.00 0.00 56.01 55.52 3ij1 n LEU 353 Cb 0.49 -0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.54 3ij1 n LEU 353 CO 0.43 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 3ij1 n GLY 354 N 1.50 1.43 3.26 -0.72 0.00 -1.11 -3.62 105.19 105.93 3ij1 n GLY 354 Ca 0.04 -1.00 -0.10 0.00 0.00 0.00 0.00 46.02 44.96 3ij1 n GLY 354 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ij1 s ARG 355 N -2.00 0.38 -0.48 1.61 3.52 -1.26 -1.64 118.95 119.08 3ij1 s ARG 355 Ca 0.00 0.82 -0.15 0.00 -0.13 0.00 0.00 55.73 56.27 3ij1 s ARG 355 Cb 0.00 0.03 0.08 0.00 -1.56 0.00 0.00 34.95 33.50 3ij1 s ARG 355 CO 0.00 -0.17 0.40 -0.06 -0.81 0.00 0.00 175.30 174.66 3ij1 s PHE 356 N 1.60 3.26 0.43 5.12 0.08 0.33 -4.96 117.98 123.84 3ij1 s PHE 356 Ca -0.08 -1.05 -0.11 0.00 0.12 0.00 0.00 56.93 55.80 3ij1 s PHE 356 Cb -0.09 -3.27 -0.06 0.00 -0.57 0.00 0.00 43.02 39.02 3ij1 s PHE 356 CO -0.13 -0.84 0.81 -0.51 -0.10 0.00 0.00 175.22 174.45 3ij1 s ASP 357 N 2.75 6.52 0.06 1.36 1.01 -1.26 -1.62 116.67 125.49 3ij1 s ASP 357 Ca 0.04 1.21 -0.02 0.00 0.71 0.00 0.00 52.55 54.48 3ij1 s ASP 357 Cb -0.25 -2.36 0.01 0.00 1.01 0.00 0.00 42.92 41.33 3ij1 s ASP 357 CO 0.06 -0.45 0.12 0.00 0.21 0.00 0.00 175.17 175.11 3ij1 n TYR 358 N -1.41 -1.13 -4.28 4.23 0.18 -1.03 -4.99 117.16 108.73 3ij1 n TYR 358 Ca 0.03 -0.32 -0.19 0.00 1.88 0.00 0.00 57.90 59.30 3ij1 n TYR 358 Cb 0.54 0.14 -0.11 0.00 -0.38 0.00 0.00 39.34 39.53 3ij1 n TYR 358 CO 0.00 0.00 0.00 -1.12 -2.08 0.00 0.00 176.86 173.66 3ij1 s SER 359 N -1.35 2.24 -1.16 9.48 0.01 -1.26 -4.79 113.70 116.87 3ij1 s SER 359 Ca 0.03 -0.84 -0.11 0.00 1.31 0.00 0.00 55.95 56.34 3ij1 s SER 359 Cb -0.01 -0.10 -0.02 0.00 0.21 0.00 0.00 66.02 66.10 3ij1 s SER 359 CO 0.02 -0.11 0.81 0.00 0.41 0.00 0.00 173.24 174.37 3ij1 n GLN 360 N 0.41 -2.54 -3.17 12.44 6.02 -1.26 -4.75 117.38 124.54 3ij1 n GLN 360 Ca -0.14 0.62 -0.19 0.00 -0.01 0.00 0.00 57.00 57.28 3ij1 n GLN 360 Cb 0.57 -4.92 -0.04 0.00 1.02 0.00 0.00 30.24 26.87 3ij1 n GLN 360 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3ij1 n ASP 362 N 0.61 0.70 -4.87 0.00 8.00 -1.26 -4.06 116.55 115.67 3ij1 n ASP 362 Ca 0.23 -0.53 -0.31 0.00 0.71 0.00 0.00 54.79 54.89 3ij1 n ASP 362 Cb 0.63 0.60 -0.04 0.00 -0.02 0.00 0.00 41.12 42.28 3ij1 n ASP 362 CO 0.00 0.00 0.00 0.27 -0.39 0.00 0.00 177.20 177.08 3ij1 s ILE 363 N -3.02 4.84 0.37 0.53 -4.36 -1.26 -4.86 121.20 113.43 3ij1 s ILE 363 Ca 0.09 0.57 0.03 0.00 -0.26 0.00 0.00 60.65 61.07 3ij1 s ILE 363 Cb 0.17 -3.67 -0.01 0.00 1.25 0.00 0.00 42.46 40.19 3ij1 s ILE 363 CO 0.78 -0.29 0.56 -1.66 0.24 0.00 0.00 174.94 174.57 3ij1 s TRP 364 N -2.08 3.27 -0.37 1.37 1.48 -1.26 -4.63 118.94 116.72 3ij1 s TRP 364 Ca 0.50 0.10 -0.02 0.00 -1.06 0.00 0.00 56.10 55.62 3ij1 s TRP 364 Cb -0.11 -2.06 -0.02 0.00 -1.16 0.00 0.00 33.47 30.12 3ij1 s TRP 364 CO 0.25 -0.08 0.32 0.98 -4.06 0.00 0.00 176.95 174.36 3ij1 n TYR 365 N -1.83 -0.83 -3.75 1.66 9.36 -1.26 -5.07 117.16 115.44 3ij1 n TYR 365 Ca -0.01 0.30 -0.27 0.00 3.32 0.00 0.00 57.90 61.24 3ij1 n TYR 365 Cb 0.57 -3.06 -0.17 0.00 -0.63 0.00 0.00 39.34 36.06 3ij1 n TYR 365 CO 0.00 0.00 0.00 -1.64 0.22 0.00 0.00 176.86 175.44 3ij1 s MET 366 N -3.64 0.72 -0.12 2.98 -1.94 -1.26 -4.86 119.30 111.17 3ij1 s MET 366 Ca 0.13 -0.36 -0.03 0.00 -1.71 0.00 0.00 55.69 53.72 3ij1 s MET 366 Cb -0.02 -1.95 -0.03 0.00 2.01 0.00 0.00 34.83 34.84 3ij1 s MET 366 CO 0.25 -0.58 -0.03 1.03 -0.01 0.00 0.00 175.02 175.69 3ij1 s ARG 367 N 1.85 3.33 0.53 2.03 3.00 0.15 -4.76 118.95 125.08 3ij1 s ARG 367 Ca -0.00 -0.48 -0.06 0.00 0.00 0.00 0.00 55.73 55.19 3ij1 s ARG 367 Cb -0.16 -2.84 -0.02 0.00 0.00 0.00 0.00 34.95 31.93 3ij1 s ARG 367 CO -0.07 0.45 0.84 -0.59 0.00 0.00 0.00 175.30 175.93 3ij1 s PHE 368 N -0.21 3.47 0.09 -0.53 -0.12 -1.26 -4.09 117.98 115.33 3ij1 s PHE 368 Ca 0.04 0.79 0.01 0.00 -0.05 0.00 0.00 56.93 57.72 3ij1 s PHE 368 Cb -0.13 -2.47 -0.04 0.00 -0.63 0.00 0.00 43.02 39.75 3ij1 s PHE 368 CO 0.02 -0.48 -0.05 -1.54 -0.05 0.00 0.00 175.22 173.13 3ij1 s SER 369 N -4.17 0.94 0.28 1.98 1.04 -0.19 -4.88 113.70 108.70 3ij1 s SER 369 Ca 0.50 -1.03 0.12 0.00 0.48 0.00 0.00 55.95 56.02 3ij1 s SER 369 Cb -0.10 0.13 -0.05 0.00 0.10 0.00 0.00 66.02 66.10 3ij1 s SER 369 CO 0.46 -0.52 -0.19 0.42 0.98 0.00 0.00 173.24 174.39 3ij1 s THR 370 N -3.72 2.48 1.02 2.02 -4.23 -1.26 -0.65 115.64 111.29 3ij1 s THR 370 Ca 0.12 -2.39 -0.14 0.00 -1.18 0.00 0.00 61.69 58.10 3ij1 s THR 370 Cb 0.06 -2.33 0.20 0.00 1.34 0.00 0.00 72.50 71.77 3ij1 s THR 370 CO -0.05 -0.38 1.13 1.51 -0.54 0.00 0.00 174.62 176.29 3ij1 s ASP 371 N -3.52 2.51 0.22 3.99 -4.77 -1.12 -4.70 116.67 109.28 3ij1 s ASP 371 Ca 0.30 0.87 -0.08 0.00 -3.30 0.00 0.00 52.55 50.34 3ij1 s ASP 371 Cb -0.04 -1.34 0.33 0.00 -1.09 0.00 0.00 42.92 40.78 3ij1 s ASP 371 CO 0.15 -3.17 1.73 0.15 0.70 0.00 0.00 175.17 174.73 3ij1 h PHE 372 N -1.92 0.37 -0.00 2.11 3.57 -1.83 -2.41 116.94 116.82 3ij1 h PHE 372 Ca -0.50 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.03 3ij1 h PHE 372 Cb 1.31 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.99 3ij1 h PHE 372 CO -0.46 0.05 -0.21 0.91 -2.23 0.00 0.00 178.31 176.36 3ij1 n TRP 373 N -5.04 0.00 -3.08 0.41 7.02 -1.26 -4.93 117.44 110.56 3ij1 n TRP 373 Ca 0.10 0.00 -0.19 0.00 -1.02 0.00 0.00 57.50 56.39 3ij1 n TRP 373 Cb 0.32 -0.32 0.04 0.00 -2.42 0.00 0.00 31.31 28.94 3ij1 n TRP 373 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 3ij1 n GLN 374 N -1.34 -5.01 0.14 -0.99 6.02 -0.91 -4.93 117.38 110.35 3ij1 n GLN 374 Ca 0.08 0.73 0.08 0.00 -0.01 0.00 0.00 57.00 57.89 3ij1 n GLN 374 Cb 0.32 -5.30 0.05 0.00 1.02 0.00 0.00 30.24 26.32 3ij1 n GLN 374 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 3ij1 h LYS 375 N -1.55 0.00 -4.15 -1.09 1.57 -1.92 -3.46 116.57 105.97 3ij1 h LYS 375 Ca -0.45 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.19 3ij1 h LYS 375 Cb 1.31 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.47 3ij1 h LYS 375 CO 0.47 0.13 -0.53 0.00 -0.57 0.00 0.00 179.45 178.95 3ij1 s MET 376 N -3.17 0.88 -0.03 3.15 0.23 -1.26 -0.38 119.30 118.72 3ij1 s MET 376 Ca 0.02 -1.24 -0.00 0.00 -1.03 0.00 0.00 55.69 53.44 3ij1 s MET 376 Cb 0.08 0.28 0.03 0.00 -1.53 0.00 0.00 34.83 33.69 3ij1 s MET 376 CO 0.75 -0.26 0.03 -1.17 -2.03 0.00 0.00 175.02 172.34 3ij1 s LEU 377 N -2.96 0.87 -0.02 0.18 2.96 -0.46 -2.80 118.68 116.44 3ij1 s LEU 377 Ca 0.15 0.04 0.06 0.00 -0.22 0.00 0.00 54.13 54.16 3ij1 s LEU 377 Cb 0.06 -0.11 -0.01 0.00 0.50 0.00 0.00 46.19 46.62 3ij1 s LEU 377 CO -0.04 -0.15 -0.21 0.00 -1.32 0.00 0.00 176.35 174.63 3ij1 s ALA 378 N 1.32 1.73 -0.03 5.97 0.00 0.18 -0.18 121.76 130.75 3ij1 s ALA 378 Ca -0.06 -0.89 -0.02 0.00 0.00 0.00 0.00 51.96 51.00 3ij1 s ALA 378 Cb -0.13 -0.46 0.02 0.00 0.00 0.00 0.00 23.12 22.56 3ij1 s ALA 378 CO -0.03 0.41 0.08 -1.17 0.00 0.00 0.00 175.76 175.05 3ij1 s LEU 379 N -0.43 1.31 0.12 0.00 2.96 0.32 -1.02 118.68 121.94 3ij1 s LEU 379 Ca 0.07 0.15 -0.01 0.00 -0.22 0.00 0.00 54.13 54.11 3ij1 s LEU 379 Cb -0.09 0.18 -0.04 0.00 0.50 0.00 0.00 46.19 46.74 3ij1 s LEU 379 CO -0.00 -0.08 0.31 -0.83 -1.32 0.00 0.00 176.35 174.42 3ij1 s GLY 380 N 0.60 2.07 0.21 7.98 0.00 -1.26 -0.12 107.32 116.80 3ij1 s GLY 380 Ca -0.05 -0.77 0.02 0.00 0.00 0.00 0.00 44.72 43.93 3ij1 s GLY 380 CO -0.02 -0.73 0.20 1.16 0.00 0.00 0.00 173.10 173.70 3ij1 n ASN 381 N -0.06 1.40 0.00 1.64 0.23 -0.31 -4.72 115.26 113.44 3ij1 n ASN 381 Ca -0.04 -1.67 0.13 0.00 -0.53 0.00 0.00 54.58 52.46 3ij1 n ASN 381 Cb 0.52 -0.06 0.66 0.00 -2.08 0.00 0.00 39.78 38.82 3ij1 n ASN 381 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 3ij1 n GLN 382 N -1.13 0.35 -0.07 -3.83 10.64 -0.12 -1.29 117.38 121.93 3ij1 n GLN 382 Ca 0.01 0.04 0.08 0.00 -1.83 0.00 0.00 57.00 55.30 3ij1 n GLN 382 Cb 0.23 -1.50 0.11 0.00 -0.86 0.00 0.00 30.24 28.22 3ij1 n GLN 382 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.06 176.56 3ij1 n VAL 383 N -1.30 1.67 -0.77 -0.39 0.24 -1.26 -2.96 118.33 113.57 3ij1 n VAL 383 Ca 0.12 -1.98 0.00 0.00 -2.04 0.00 0.00 64.34 60.44 3ij1 n VAL 383 Cb 0.22 -0.08 0.00 0.00 -1.47 0.00 0.00 33.84 32.50 3ij1 n VAL 383 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ij1 n GLY 384 N -1.23 0.66 3.81 7.63 0.00 -0.95 -4.23 105.19 110.89 3ij1 n GLY 384 Ca 0.13 -0.69 -0.37 0.00 0.00 0.00 0.00 46.02 45.09 3ij1 n GLY 384 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ij1 s LYS 385 N -1.60 3.84 -0.17 1.61 2.20 -1.26 -4.64 119.74 119.72 3ij1 s LYS 385 Ca 0.00 0.03 -0.08 0.00 -0.36 0.00 0.00 55.97 55.56 3ij1 s LYS 385 Cb 0.00 -3.28 -0.04 0.00 -1.51 0.00 0.00 37.83 33.00 3ij1 s LYS 385 CO 0.00 0.57 0.09 -0.51 -0.36 0.00 0.00 175.35 175.14 3ij1 s LEU 386 N -0.51 4.00 -0.13 5.43 1.43 -0.03 -1.17 118.68 127.71 3ij1 s LEU 386 Ca 0.16 0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.44 3ij1 s LEU 386 Cb -0.13 -2.00 -0.02 0.00 0.03 0.00 0.00 46.19 44.06 3ij1 s LEU 386 CO 0.05 0.23 -0.07 -0.31 0.23 0.00 0.00 176.35 176.49 3ij1 s TYR 387 N 0.01 2.94 -0.11 0.29 2.02 0.83 -0.55 117.35 122.78 3ij1 s TYR 387 Ca 0.07 -0.34 0.01 0.00 -0.37 0.00 0.00 57.07 56.45 3ij1 s TYR 387 Cb -0.12 -1.88 0.02 0.00 -0.40 0.00 0.00 41.96 39.58 3ij1 s TYR 387 CO 0.00 -0.02 -0.13 0.08 -1.57 0.00 0.00 175.55 173.92 3ij1 s VAL 388 N 0.14 1.38 -0.17 0.71 1.01 0.19 -0.52 120.40 123.12 3ij1 s VAL 388 Ca -0.03 -0.55 -0.05 0.00 0.00 0.00 0.00 61.98 61.35 3ij1 s VAL 388 Cb -0.14 -1.29 -0.03 0.00 0.00 0.00 0.00 36.38 34.92 3ij1 s VAL 388 CO 0.03 0.42 -0.00 0.26 0.00 0.00 0.00 175.10 175.81 3ij1 s TRP 389 N 1.22 3.08 -0.45 5.22 0.51 0.75 -0.22 118.94 129.04 3ij1 s TRP 389 Ca -0.02 -0.26 -0.28 0.00 -2.12 0.00 0.00 56.10 53.42 3ij1 s TRP 389 Cb -0.14 -2.02 0.03 0.00 -0.81 0.00 0.00 33.47 30.53 3ij1 s TRP 389 CO -0.05 -0.05 1.05 0.34 -0.51 0.00 0.00 176.95 177.73 3ij1 s ASP 390 N 0.54 6.62 0.00 2.95 2.15 0.10 -1.36 116.67 127.68 3ij1 s ASP 390 Ca -0.01 0.42 0.25 0.00 0.43 0.00 0.00 52.55 53.64 3ij1 s ASP 390 Cb -0.14 -2.51 0.61 0.00 -0.30 0.00 0.00 42.92 40.58 3ij1 s ASP 390 CO 0.02 -1.13 1.49 0.18 -0.17 0.00 0.00 175.17 175.57 3ij1 n LEU 391 N 7.47 2.34 -3.65 -1.34 4.77 0.49 -2.14 117.00 124.94 3ij1 n LEU 391 Ca 0.10 -0.84 -0.41 0.00 -0.03 0.00 0.00 56.01 54.82 3ij1 n LEU 391 Cb 0.49 -0.05 -0.01 0.00 -2.33 0.00 0.00 43.42 41.52 3ij1 n LEU 391 CO 0.67 0.42 2.82 1.21 -1.33 0.00 0.00 177.39 181.18 3ij1 n GLU 392 N 0.81 3.06 -4.06 3.23 4.07 -1.23 -4.81 120.64 121.71 3ij1 n GLU 392 Ca 0.17 -2.55 -0.10 0.00 -0.06 0.00 0.00 57.16 54.62 3ij1 n GLU 392 Cb 0.48 -3.17 -0.07 0.00 -0.06 0.00 0.00 31.44 28.61 3ij1 n GLU 392 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 3ij1 s VAL 393 N 2.87 0.02 0.20 6.31 -7.23 -1.26 -5.07 120.40 116.25 3ij1 s VAL 393 Ca 0.52 -1.62 0.12 0.00 -1.81 0.00 0.00 61.98 59.19 3ij1 s VAL 393 Cb 0.15 -2.19 -0.01 0.00 0.56 0.00 0.00 36.38 34.89 3ij1 s VAL 393 CO -0.08 -0.11 1.58 -0.33 -0.31 0.00 0.00 175.10 175.85 3ij1 h GLU 394 N 2.48 0.00 -4.58 4.82 5.08 -1.94 -3.45 114.58 117.00 3ij1 h GLU 394 Ca -0.31 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 57.78 3ij1 h GLU 394 Cb 1.24 0.00 -0.21 0.00 0.50 0.00 0.00 28.75 30.28 3ij1 h GLU 394 CO 0.46 0.61 -0.73 -0.51 -1.00 0.00 0.00 179.01 177.83 3ij1 s ASP 395 N -6.70 0.89 0.24 1.42 1.01 -1.26 -5.06 116.67 107.21 3ij1 s ASP 395 Ca -0.00 -0.58 -0.05 0.00 0.71 0.00 0.00 52.55 52.63 3ij1 s ASP 395 Cb 0.12 0.04 0.44 0.00 1.01 0.00 0.00 42.92 44.52 3ij1 s ASP 395 CO 0.75 -0.22 1.73 -0.65 0.21 0.00 0.00 175.17 177.00 3ij1 h PRO 396 N 4.40 0.44 0.00 8.23 0.11 -1.87 -2.12 132.00 141.19 3ij1 h PRO 396 Ca -0.36 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.73 3ij1 h PRO 396 Cb 1.20 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3ij1 h PRO 396 CO 0.42 0.29 0.00 -2.39 -0.21 0.00 0.00 178.00 176.11 3ij1 n HIS 397 N -4.99 0.00 0.67 0.65 1.44 -1.24 -2.29 115.22 109.46 3ij1 n HIS 397 Ca 0.14 0.00 0.10 0.00 -2.01 0.00 0.00 57.72 55.95 3ij1 n HIS 397 Cb 0.40 -0.31 0.28 0.00 0.12 0.00 0.00 29.99 30.47 3ij1 n HIS 397 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3ij1 n LYS 398 N -1.31 2.14 -1.72 -1.40 5.02 -0.80 -4.98 118.16 115.11 3ij1 n LYS 398 Ca 0.06 -1.73 -0.42 0.00 -2.02 0.00 0.00 58.31 54.21 3ij1 n LYS 398 Cb 0.12 -1.44 -0.00 0.00 -0.02 0.00 0.00 35.03 33.69 3ij1 n LYS 398 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ij1 n ALA 399 N 0.93 1.66 -2.75 7.82 0.00 -0.97 -4.93 120.51 122.27 3ij1 n ALA 399 Ca 0.18 0.35 -0.37 0.00 0.00 0.00 0.00 53.44 53.59 3ij1 n ALA 399 Cb 0.46 -2.31 -0.11 0.00 0.00 0.00 0.00 19.45 17.49 3ij1 n ALA 399 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3ij1 s LYS 400 N -1.99 3.90 -0.02 0.00 1.02 -0.91 -4.89 119.74 116.85 3ij1 s LYS 400 Ca 0.55 -0.35 -0.11 0.00 0.02 0.00 0.00 55.97 56.08 3ij1 s LYS 400 Cb -0.53 -3.50 -0.05 0.00 -0.52 0.00 0.00 37.83 33.22 3ij1 s LYS 400 CO 0.62 -0.09 0.33 0.00 -0.92 0.00 0.00 175.35 175.30 3ij1 s THR 402 N -1.13 0.83 0.09 0.00 2.01 0.69 -5.00 115.64 113.13 3ij1 s THR 402 Ca 0.23 -0.86 0.09 0.00 0.31 0.00 0.00 61.69 61.46 3ij1 s THR 402 Cb -0.15 -0.78 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 3ij1 s THR 402 CO 0.12 -0.07 -0.22 0.42 -0.69 0.00 0.00 174.62 174.19 3ij1 s THR 403 N -0.84 2.58 -0.14 -0.82 -4.23 -1.26 -0.64 115.64 110.29 3ij1 s THR 403 Ca -0.01 -1.47 -0.00 0.00 -1.18 0.00 0.00 61.69 59.02 3ij1 s THR 403 Cb -0.07 -2.13 0.03 0.00 1.34 0.00 0.00 72.50 71.67 3ij1 s THR 403 CO 0.01 0.19 -0.07 -0.76 -0.54 0.00 0.00 174.62 173.45 3ij1 s LEU 404 N -1.82 1.47 0.09 4.79 1.43 0.29 -4.99 118.68 119.94 3ij1 s LEU 404 Ca 0.15 -0.51 0.07 0.00 -1.03 0.00 0.00 54.13 52.81 3ij1 s LEU 404 Cb -0.10 -0.92 -0.03 0.00 0.03 0.00 0.00 46.19 45.17 3ij1 s LEU 404 CO 0.07 -0.15 -0.19 0.42 0.23 0.00 0.00 176.35 176.73 3ij1 s THR 405 N 1.64 1.52 -0.01 5.49 -4.23 -1.26 -0.85 115.64 117.94 3ij1 s THR 405 Ca 0.03 -1.45 0.02 0.00 -1.18 0.00 0.00 61.69 59.10 3ij1 s THR 405 Cb -0.14 -1.39 0.00 0.00 1.34 0.00 0.00 72.50 72.31 3ij1 s THR 405 CO -0.08 -0.10 -0.05 -2.28 -0.54 0.00 0.00 174.62 171.56 3ij1 s HIS 406 N -1.18 0.54 0.15 3.99 2.46 -1.26 -5.01 115.29 114.97 3ij1 s HIS 406 Ca 0.04 -0.11 0.34 0.00 0.47 0.00 0.00 55.06 55.80 3ij1 s HIS 406 Cb -0.10 -0.38 1.61 0.00 -0.13 0.00 0.00 32.58 33.58 3ij1 s HIS 406 CO 0.03 -0.04 2.02 1.12 -2.47 0.00 0.00 174.74 175.41 3ij1 h HIS 407 N 6.24 0.00 -0.05 3.88 2.07 -2.01 -1.70 115.15 123.59 3ij1 h HIS 407 Ca -0.31 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.21 3ij1 h HIS 407 Cb 1.18 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.16 3ij1 h HIS 407 CO 0.42 0.00 0.00 1.63 -3.07 0.00 0.00 177.93 176.91 3ij1 n LYS 408 N -2.85 1.58 -3.26 5.12 5.02 -1.26 -4.79 118.16 117.72 3ij1 n LYS 408 Ca -0.01 -1.62 -0.46 0.00 -2.02 0.00 0.00 58.31 54.20 3ij1 n LYS 408 Cb 0.19 -1.35 -0.03 0.00 -0.02 0.00 0.00 35.03 33.82 3ij1 n LYS 408 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ij1 n GLY 410 N 4.43 0.35 3.90 0.00 0.00 -1.26 -4.33 105.19 108.28 3ij1 n GLY 410 Ca 0.10 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.84 3ij1 n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ij1 s ALA 411 N -0.62 3.32 0.20 4.61 0.00 -1.26 -4.14 121.76 123.87 3ij1 s ALA 411 Ca 0.00 -0.45 -0.31 0.00 0.00 0.00 0.00 51.96 51.20 3ij1 s ALA 411 Cb 0.00 -2.69 -0.11 0.00 0.00 0.00 0.00 23.12 20.32 3ij1 s ALA 411 CO 0.00 -0.50 1.59 0.00 0.00 0.00 0.00 175.76 176.86 3ij1 s ALA 412 N -2.87 3.80 -0.23 0.00 0.00 -1.16 -2.23 121.76 119.06 3ij1 s ALA 412 Ca 0.50 1.44 -0.18 0.00 0.00 0.00 0.00 51.96 53.71 3ij1 s ALA 412 Cb -0.10 -3.64 -0.03 0.00 0.00 0.00 0.00 23.12 19.35 3ij1 s ALA 412 CO 0.47 -0.83 0.53 0.42 0.00 0.00 0.00 175.76 176.35 3ij1 s ILE 413 N 0.92 5.07 -0.05 0.00 1.01 -0.41 -1.06 121.20 126.68 3ij1 s ILE 413 Ca 0.69 0.95 0.03 0.00 0.00 0.00 0.00 60.65 62.32 3ij1 s ILE 413 Cb -0.45 -3.85 -0.25 0.00 0.01 0.00 0.00 42.46 37.92 3ij1 s ILE 413 CO 0.34 0.12 0.62 0.03 0.00 0.00 0.00 174.94 176.05 3ij1 h ARG 414 N 7.76 0.14 -2.59 2.79 2.47 -1.39 -3.40 114.38 120.16 3ij1 h ARG 414 Ca -0.31 -0.24 -0.02 0.00 -1.26 0.00 0.00 59.98 58.16 3ij1 h ARG 414 Cb 1.14 0.09 -0.15 0.00 -1.65 0.00 0.00 29.97 29.40 3ij1 h ARG 414 CO 0.73 0.87 0.24 -1.14 0.56 0.00 0.00 179.97 181.24 3ij1 s GLN 415 N -2.59 1.15 0.28 0.04 0.74 -1.25 -0.67 119.66 117.36 3ij1 s GLN 415 Ca -0.11 -0.22 0.10 0.00 0.05 0.00 0.00 55.36 55.18 3ij1 s GLN 415 Cb 0.07 0.53 -0.05 0.00 1.10 0.00 0.00 33.01 34.66 3ij1 s GLN 415 CO 0.81 -0.46 -0.15 0.95 -0.55 0.00 0.00 175.29 175.90 3ij1 s THR 416 N -2.85 2.19 -0.15 -0.34 -4.23 -1.26 -2.15 115.64 106.85 3ij1 s THR 416 Ca -0.02 -2.29 -0.08 0.00 -1.18 0.00 0.00 61.69 58.12 3ij1 s THR 416 Cb -0.01 -2.37 0.06 0.00 1.34 0.00 0.00 72.50 71.52 3ij1 s THR 416 CO -0.05 -0.37 0.35 -0.55 -0.54 0.00 0.00 174.62 173.46 3ij1 s SER 417 N -3.50 -0.36 0.19 3.99 0.15 -0.09 -4.62 113.70 109.46 3ij1 s SER 417 Ca 0.29 0.78 -0.19 0.00 0.70 0.00 0.00 55.95 57.53 3ij1 s SER 417 Cb -0.01 0.71 -0.08 0.00 -1.71 0.00 0.00 66.02 64.93 3ij1 s SER 417 CO 0.14 -0.19 0.68 -0.36 1.20 0.00 0.00 173.24 174.71 3ij1 s PHE 418 N 1.54 3.68 0.93 3.44 0.08 -1.26 -0.94 117.98 125.44 3ij1 s PHE 418 Ca -0.08 1.34 -0.11 0.00 0.12 0.00 0.00 56.93 58.21 3ij1 s PHE 418 Cb -0.10 -2.58 0.15 0.00 -0.57 0.00 0.00 43.02 39.93 3ij1 s PHE 418 CO -0.11 0.39 1.12 -1.54 -0.10 0.00 0.00 175.22 174.98 3ij1 s SER 419 N -1.56 2.91 0.29 1.36 1.04 0.08 -4.61 113.70 113.21 3ij1 s SER 419 Ca 0.40 2.02 -0.01 0.00 0.48 0.00 0.00 55.95 58.85 3ij1 s SER 419 Cb -0.17 -2.51 0.44 0.00 0.10 0.00 0.00 66.02 63.88 3ij1 s SER 419 CO 0.21 -3.08 1.87 -0.09 0.98 0.00 0.00 173.24 173.13 3ij1 h ARG 420 N -1.86 0.86 -0.03 4.02 2.43 -1.91 -1.63 114.38 116.28 3ij1 h ARG 420 Ca -0.46 -0.14 0.00 0.00 -0.81 0.00 0.00 59.98 58.58 3ij1 h ARG 420 Cb 1.27 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 30.67 3ij1 h ARG 420 CO 0.45 0.71 0.00 -0.40 -1.51 0.00 0.00 179.97 179.22 3ij1 n ASP 421 N -4.32 0.39 -0.51 -3.80 5.68 -1.26 -4.43 116.55 108.29 3ij1 n ASP 421 Ca 0.05 -1.35 -0.07 0.00 -0.50 0.00 0.00 54.79 52.92 3ij1 n ASP 421 Cb 0.17 -0.02 -0.03 0.00 -1.14 0.00 0.00 41.12 40.11 3ij1 n ASP 421 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3ij1 n SER 422 N -0.59 -5.43 0.20 -1.12 7.64 -0.61 -4.88 113.62 108.82 3ij1 n SER 422 Ca 0.18 0.16 0.09 0.00 1.01 0.00 0.00 58.87 60.31 3ij1 n SER 422 Cb 0.14 -3.52 0.26 0.00 -1.01 0.00 0.00 64.21 60.08 3ij1 n SER 422 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 3ij1 h SER 423 N 0.00 0.00 -3.90 6.43 4.64 -1.92 -3.44 113.55 115.36 3ij1 h SER 423 Ca -0.14 0.00 -0.46 0.00 -0.47 0.00 0.00 61.79 60.72 3ij1 h SER 423 Cb 0.98 0.00 -0.31 0.00 -0.31 0.00 0.00 62.40 62.76 3ij1 h SER 423 CO 0.20 0.23 -0.80 -0.63 -0.87 0.00 0.00 176.83 174.96 3ij1 s ILE 424 N -3.30 0.97 -0.15 0.95 1.01 -1.26 -0.66 121.20 118.75 3ij1 s ILE 424 Ca 0.04 -0.47 0.02 0.00 0.00 0.00 0.00 60.65 60.23 3ij1 s ILE 424 Cb 0.08 -0.84 0.01 0.00 0.01 0.00 0.00 42.46 41.72 3ij1 s ILE 424 CO 0.67 0.29 -0.20 -0.22 0.00 0.00 0.00 174.94 175.48 3ij1 s LEU 425 N 0.06 2.17 -0.11 2.97 2.96 0.65 -0.74 118.68 126.63 3ij1 s LEU 425 Ca -0.02 -0.60 -0.02 0.00 -0.22 0.00 0.00 54.13 53.28 3ij1 s LEU 425 Cb -0.08 -1.47 -0.03 0.00 0.50 0.00 0.00 46.19 45.10 3ij1 s LEU 425 CO 0.01 0.06 -0.04 -0.63 -1.32 0.00 0.00 176.35 174.43 3ij1 s ILE 426 N 0.94 3.94 -0.03 6.68 -1.09 -0.11 -0.60 121.20 130.92 3ij1 s ILE 426 Ca -0.04 -0.37 0.06 0.00 -2.23 0.00 0.00 60.65 58.08 3ij1 s ILE 426 Cb -0.15 -2.68 -0.02 0.00 -1.58 0.00 0.00 42.46 38.03 3ij1 s ILE 426 CO -0.04 0.55 -0.22 0.00 -1.23 0.00 0.00 174.94 173.99 3ij1 s ALA 427 N -0.26 2.32 0.11 9.38 0.00 -0.44 -0.91 121.76 131.95 3ij1 s ALA 427 Ca 0.05 -1.07 0.09 0.00 0.00 0.00 0.00 51.96 51.03 3ij1 s ALA 427 Cb -0.13 -0.70 -0.04 0.00 0.00 0.00 0.00 23.12 22.26 3ij1 s ALA 427 CO 0.02 0.52 -0.23 0.14 0.00 0.00 0.00 175.76 176.21 3ij1 s VAL 428 N -0.59 1.94 0.29 0.00 -7.23 -0.91 -0.38 120.40 113.50 3ij1 s VAL 428 Ca 0.09 -1.59 0.05 0.00 -1.81 0.00 0.00 61.98 58.72 3ij1 s VAL 428 Cb -0.11 -1.73 -0.06 0.00 0.56 0.00 0.00 36.38 35.05 3ij1 s VAL 428 CO -0.00 0.04 -0.02 0.00 -0.31 0.00 0.00 175.10 174.81 3ij1 h ASP 430 N 2.25 0.00 -0.54 0.00 5.19 -1.35 -1.40 116.42 120.56 3ij1 h ASP 430 Ca -0.40 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.01 3ij1 h ASP 430 Cb 1.23 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.74 3ij1 h ASP 430 CO 0.68 0.00 0.00 -0.90 -3.12 0.00 0.00 179.24 175.90 3ij1 n ASP 431 N -3.11 5.24 -0.33 6.45 5.75 -1.26 -2.65 116.55 126.63 3ij1 n ASP 431 Ca -0.02 -2.80 -0.04 0.00 -0.01 0.00 0.00 54.79 51.92 3ij1 n ASP 431 Cb 0.17 -0.66 -0.02 0.00 -1.03 0.00 0.00 41.12 39.58 3ij1 n ASP 431 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ij1 n ALA 432 N 0.64 -0.07 -2.17 2.12 0.00 -0.87 -4.74 120.51 115.42 3ij1 n ALA 432 Ca 0.25 0.07 -0.30 0.00 0.00 0.00 0.00 53.44 53.46 3ij1 n ALA 432 Cb 1.09 -1.04 -0.03 0.00 0.00 0.00 0.00 19.45 19.46 3ij1 n ALA 432 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3ij1 s SER 433 N -2.32 6.54 -0.06 0.00 1.04 -1.26 -0.92 113.70 116.71 3ij1 s SER 433 Ca 0.00 1.16 0.03 0.00 0.48 0.00 0.00 55.95 57.61 3ij1 s SER 433 Cb 0.00 -2.33 0.01 0.00 0.10 0.00 0.00 66.02 63.80 3ij1 s SER 433 CO 0.00 -0.39 -0.13 -0.63 0.98 0.00 0.00 173.24 173.07 3ij1 s ILE 434 N -2.35 1.22 -0.13 -1.02 1.01 0.19 -1.52 121.20 118.61 3ij1 s ILE 434 Ca 0.52 -0.54 0.03 0.00 0.00 0.00 0.00 60.65 60.66 3ij1 s ILE 434 Cb -0.10 -1.10 0.01 0.00 0.01 0.00 0.00 42.46 41.28 3ij1 s ILE 434 CO 0.30 0.37 -0.22 0.26 0.00 0.00 0.00 174.94 175.66 3ij1 s TRP 435 N 0.55 2.56 -0.22 3.97 0.52 0.48 -1.26 118.94 125.55 3ij1 s TRP 435 Ca -0.13 -1.23 -0.06 0.00 0.02 0.00 0.00 56.10 54.70 3ij1 s TRP 435 Cb -0.15 -1.74 -0.03 0.00 -1.15 0.00 0.00 33.47 30.40 3ij1 s TRP 435 CO 0.04 -0.55 0.02 0.50 0.02 0.00 0.00 176.95 176.98 3ij1 s ARG 436 N 0.72 3.64 -0.16 4.98 3.52 -0.43 -1.33 118.95 129.88 3ij1 s ARG 436 Ca -0.10 -0.50 0.01 0.00 -0.13 0.00 0.00 55.73 55.01 3ij1 s ARG 436 Cb -0.16 -3.16 0.01 0.00 -1.56 0.00 0.00 34.95 30.08 3ij1 s ARG 436 CO 0.01 -0.05 -0.19 -1.58 -0.81 0.00 0.00 175.30 172.68 3ij1 s TRP 437 N 1.18 2.75 -0.09 5.12 0.52 0.23 -0.89 118.94 127.76 3ij1 s TRP 437 Ca 0.03 -1.34 -0.03 0.00 0.02 0.00 0.00 56.10 54.79 3ij1 s TRP 437 Cb -0.14 -1.88 -0.03 0.00 -1.15 0.00 0.00 33.47 30.26 3ij1 s TRP 437 CO 0.02 -0.64 0.03 -0.51 0.02 0.00 0.00 176.95 175.87 3ij1 s ASP 438 N 1.00 5.43 0.00 2.95 1.11 0.18 -0.26 116.67 127.09 3ij1 s ASP 438 Ca -0.02 0.19 0.25 0.00 0.18 0.00 0.00 52.55 53.15 3ij1 s ASP 438 Cb -0.15 -1.58 1.49 0.00 1.07 0.00 0.00 42.92 43.75 3ij1 s ASP 438 CO -0.05 0.38 1.85 -1.14 1.18 0.00 0.00 175.17 177.39