#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ijc s SER 81 N 0.00 0.22 0.04 7.72 0.01 -1.26 -4.95 113.70 115.49 3ijc s SER 81 Ca 0.00 0.26 0.05 0.00 1.31 0.00 0.00 55.95 57.58 3ijc s SER 81 Cb 0.00 0.16 -0.02 0.00 0.21 0.00 0.00 66.02 66.37 3ijc s SER 81 CO 0.00 -0.18 -0.16 -0.36 0.41 0.00 0.00 173.24 172.96 3ijc s PHE 82 N 1.53 1.35 -0.08 2.43 0.08 -1.26 0.64 117.98 122.67 3ijc s PHE 82 Ca -0.05 -0.36 0.04 0.00 0.12 0.00 0.00 56.93 56.68 3ijc s PHE 82 Cb -0.12 -0.80 -0.01 0.00 -0.57 0.00 0.00 43.02 41.52 3ijc s PHE 82 CO -0.05 0.05 -0.22 0.21 -0.10 0.00 0.00 175.22 175.10 3ijc s LYS 83 N -1.20 2.83 -0.14 0.44 2.20 0.19 -4.90 119.74 119.17 3ijc s LYS 83 Ca 0.03 -0.85 -0.29 0.00 -0.36 0.00 0.00 55.97 54.49 3ijc s LYS 83 Cb -0.08 -2.29 -0.02 0.00 -1.51 0.00 0.00 37.83 33.93 3ijc s LYS 83 CO 0.01 0.31 1.26 0.00 -0.36 0.00 0.00 175.35 176.57 3ijc n VAL 85 N 5.23 0.00 -3.61 0.00 0.24 -0.23 -4.98 118.33 114.97 3ijc n VAL 85 Ca 0.13 -0.32 -0.04 0.00 -2.04 0.00 0.00 64.34 62.07 3ijc n VAL 85 Cb 0.45 0.94 -0.01 0.00 -1.47 0.00 0.00 33.84 33.74 3ijc n VAL 85 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3ijc s ASN 86 N -1.75 -0.18 0.04 -1.34 2.47 -1.24 -4.61 114.94 108.34 3ijc s ASN 86 Ca 0.02 -0.11 -0.21 0.00 0.42 0.00 0.00 52.86 52.98 3ijc s ASN 86 Cb 0.05 0.27 0.04 0.00 -1.45 0.00 0.00 41.25 40.16 3ijc s ASN 86 CO 0.28 -0.46 0.47 -0.94 -3.72 0.00 0.00 177.10 172.73 3ijc s SER 87 N -2.60 -0.38 0.29 -4.21 1.04 -1.26 -1.77 113.70 104.81 3ijc s SER 87 Ca 0.10 0.13 -0.07 0.00 0.48 0.00 0.00 55.95 56.59 3ijc s SER 87 Cb 0.00 0.46 -0.00 0.00 0.10 0.00 0.00 66.02 66.58 3ijc s SER 87 CO -0.04 -0.67 0.45 -1.48 0.98 0.00 0.00 173.24 172.47 3ijc s LEU 88 N -1.90 0.70 -0.03 2.42 0.05 0.10 -4.96 118.68 115.05 3ijc s LEU 88 Ca -0.06 -1.23 0.02 0.00 0.05 0.00 0.00 54.13 52.91 3ijc s LEU 88 Cb -0.01 1.51 0.01 0.00 -2.05 0.00 0.00 46.19 45.65 3ijc s LEU 88 CO -0.01 -1.19 -0.08 -0.75 -0.55 0.00 0.00 176.35 173.77 3ijc s LYS 89 N -3.57 0.99 0.43 1.48 2.20 -1.26 0.54 119.74 120.55 3ijc s LYS 89 Ca 0.28 -0.25 -0.21 0.00 -0.36 0.00 0.00 55.97 55.42 3ijc s LYS 89 Cb 0.00 -0.92 -0.11 0.00 -1.51 0.00 0.00 37.83 35.29 3ijc s LYS 89 CO 0.14 0.04 0.96 -1.21 -0.36 0.00 0.00 175.35 174.92 3ijc s GLU 90 N 0.45 4.21 0.40 4.03 2.02 0.25 -4.97 118.70 125.08 3ijc s GLU 90 Ca -0.07 1.14 0.29 0.00 0.02 0.00 0.00 54.97 56.34 3ijc s GLU 90 Cb -0.11 -2.18 1.35 0.00 0.10 0.00 0.00 34.13 33.28 3ijc s GLU 90 CO 0.01 -0.05 1.86 0.38 0.02 0.00 0.00 175.26 177.48 3ijc h ASP 91 N 1.90 0.00 1.26 -0.19 3.04 -1.99 -3.18 116.42 117.27 3ijc h ASP 91 Ca -0.49 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.30 3ijc h ASP 91 Cb 1.18 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.47 3ijc h ASP 91 CO 0.61 0.00 0.00 0.00 -2.04 0.00 0.00 179.24 177.81 3ijc n HIS 92 N -2.56 0.88 -1.58 4.15 1.44 -1.26 -4.92 115.22 111.37 3ijc n HIS 92 Ca 0.00 0.28 -0.12 0.00 -2.01 0.00 0.00 57.72 55.87 3ijc n HIS 92 Cb 0.17 -0.95 -0.04 0.00 0.12 0.00 0.00 29.99 29.29 3ijc n HIS 92 CO 0.00 0.00 0.00 0.09 -2.81 0.00 0.00 176.34 173.62 3ijc n ASN 93 N -2.24 -3.33 -4.97 4.39 5.03 -1.20 -4.99 115.26 107.95 3ijc n ASN 93 Ca 0.05 0.28 -0.21 0.00 0.87 0.00 0.00 54.58 55.57 3ijc n ASN 93 Cb 0.37 -3.08 -0.02 0.00 -1.02 0.00 0.00 39.78 36.04 3ijc n ASN 93 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 3ijc s GLN 94 N -3.44 3.40 0.42 3.52 -1.52 -1.26 -4.75 119.66 116.03 3ijc s GLN 94 Ca 0.00 -0.75 -0.25 0.00 -1.95 0.00 0.00 55.36 52.40 3ijc s GLN 94 Cb 0.00 -2.86 -0.10 0.00 -0.22 0.00 0.00 33.01 29.83 3ijc s GLN 94 CO 0.00 0.36 1.28 -2.30 -0.25 0.00 0.00 175.29 174.37 3ijc n PRO 95 N -1.48 1.93 -3.05 2.91 -0.02 -1.17 -3.35 135.00 130.77 3ijc n PRO 95 Ca -0.07 0.69 -0.43 0.00 -2.02 0.00 0.00 63.50 61.66 3ijc n PRO 95 Cb 0.57 -2.39 -0.06 0.00 -0.02 0.00 0.00 33.50 31.60 3ijc n PRO 95 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3ijc s LEU 96 N -1.75 4.58 0.14 2.45 1.43 -0.75 -3.70 118.68 121.09 3ijc s LEU 96 Ca 0.61 -0.58 0.11 0.00 -1.03 0.00 0.00 54.13 53.24 3ijc s LEU 96 Cb -0.50 -2.65 -0.13 0.00 0.03 0.00 0.00 46.19 42.94 3ijc s LEU 96 CO 0.58 -0.96 1.23 -0.26 0.23 0.00 0.00 176.35 177.16 3ijc h PHE 97 N 9.05 0.00 -3.99 0.29 0.04 -1.49 -3.35 116.94 117.49 3ijc h PHE 97 Ca -0.26 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.34 3ijc h PHE 97 Cb 1.09 0.00 -0.21 0.00 2.20 0.00 0.00 35.95 39.03 3ijc h PHE 97 CO 0.79 0.82 -0.70 0.20 -0.60 0.00 0.00 178.31 178.83 3ijc s GLY 98 N -4.69 0.25 -0.10 -1.45 0.00 -1.13 -4.19 107.32 96.02 3ijc s GLY 98 Ca 0.01 -0.62 -0.09 0.00 0.00 0.00 0.00 44.72 44.02 3ijc s GLY 98 CO 0.80 -0.69 0.26 0.54 0.00 0.00 0.00 173.10 174.01 3ijc s VAL 99 N -1.60 0.00 -0.17 1.40 0.11 -1.26 -1.08 120.40 117.80 3ijc s VAL 99 Ca -0.15 -0.03 -0.05 0.00 -2.93 0.00 0.00 61.98 58.83 3ijc s VAL 99 Cb -0.09 -0.38 0.09 0.00 -1.53 0.00 0.00 36.38 34.46 3ijc s VAL 99 CO -0.01 -0.01 0.32 -1.10 -3.33 0.00 0.00 175.10 170.96 3ijc s GLN 100 N 0.07 0.23 0.45 1.54 -1.52 -0.83 -4.57 119.66 115.04 3ijc s GLN 100 Ca -0.01 0.74 -0.24 0.00 -1.95 0.00 0.00 55.36 53.90 3ijc s GLN 100 Cb -0.02 -0.12 -0.08 0.00 -0.22 0.00 0.00 33.01 32.57 3ijc s GLN 100 CO 0.00 -0.37 1.29 -0.06 -0.25 0.00 0.00 175.29 175.90 3ijc s PHE 101 N 2.48 2.70 -0.44 0.91 0.08 -1.26 -0.68 117.98 121.78 3ijc s PHE 101 Ca 0.03 1.43 -0.29 0.00 0.12 0.00 0.00 56.93 58.22 3ijc s PHE 101 Cb -0.13 -3.64 0.01 0.00 -0.57 0.00 0.00 43.02 38.70 3ijc s PHE 101 CO -0.11 -2.16 1.36 1.21 -0.10 0.00 0.00 175.22 175.42 3ijc s ASN 102 N -0.93 6.38 0.00 1.36 2.47 0.35 -4.87 114.94 119.71 3ijc s ASN 102 Ca 0.62 0.72 0.25 0.00 0.42 0.00 0.00 52.86 54.86 3ijc s ASN 102 Cb -0.36 -2.54 0.42 0.00 -1.45 0.00 0.00 41.25 37.31 3ijc s ASN 102 CO 0.45 -1.42 1.35 0.79 -3.72 0.00 0.00 177.10 174.55 3ijc n TRP 103 N 8.68 0.00 -2.44 0.43 8.01 -1.26 -4.08 117.44 126.78 3ijc n TRP 103 Ca 0.15 0.00 -0.41 0.00 -1.31 0.00 0.00 57.50 55.94 3ijc n TRP 103 Cb 0.48 -0.14 0.01 0.00 -2.01 0.00 0.00 31.31 29.65 3ijc n TRP 103 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 3ijc n HIS 104 N -1.07 2.72 0.00 -5.99 8.25 -1.26 -4.55 115.22 113.32 3ijc n HIS 104 Ca 0.08 -2.62 0.00 0.00 -0.26 0.00 0.00 57.72 54.92 3ijc n HIS 104 Cb 0.35 -1.37 0.00 0.00 1.12 0.00 0.00 29.99 30.09 3ijc n HIS 104 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3ijc n SER 105 N 0.41 0.00 -2.24 0.41 2.88 -1.26 -4.58 113.62 109.23 3ijc n SER 105 Ca 0.51 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 58.04 3ijc n SER 105 Cb 0.26 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.72 3ijc n SER 105 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 3ijc n LYS 106 N 0.00 0.86 -3.91 -1.46 5.02 -1.26 -5.15 118.16 112.27 3ijc n LYS 106 Ca 0.00 -0.26 -0.35 0.00 -2.02 0.00 0.00 58.31 55.68 3ijc n LYS 106 Cb 0.00 -0.03 -0.14 0.00 -0.02 0.00 0.00 35.03 34.84 3ijc n LYS 106 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3ijc s LEU 111 N 0.00 3.92 -0.10 -0.35 1.43 -1.26 -4.60 118.68 117.72 3ijc s LEU 111 Ca 0.05 -1.28 0.01 0.00 -1.03 0.00 0.00 54.13 51.88 3ijc s LEU 111 Cb -0.00 -1.71 -0.02 0.00 0.03 0.00 0.00 46.19 44.48 3ijc s LEU 111 CO 0.03 -0.26 -0.12 -0.69 0.23 0.00 0.00 176.35 175.54 3ijc s VAL 112 N 1.25 3.19 0.08 -1.59 1.01 -1.26 -0.08 120.40 123.01 3ijc s VAL 112 Ca -0.05 -0.64 0.06 0.00 0.00 0.00 0.00 61.98 61.35 3ijc s VAL 112 Cb -0.20 -2.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.84 3ijc s VAL 112 CO -0.01 0.55 -0.17 0.72 0.00 0.00 0.00 175.10 176.19 3ijc s PHE 113 N -0.12 1.43 -0.04 5.22 -0.12 -0.65 -0.49 117.98 123.22 3ijc s PHE 113 Ca -0.01 -0.45 -0.02 0.00 -0.05 0.00 0.00 56.93 56.40 3ijc s PHE 113 Cb -0.14 -0.79 -0.04 0.00 -0.63 0.00 0.00 43.02 41.42 3ijc s PHE 113 CO 0.03 0.11 0.10 0.00 -0.05 0.00 0.00 175.22 175.42 3ijc s ALA 114 N -1.27 3.66 0.12 1.99 0.00 0.15 -1.44 121.76 124.97 3ijc s ALA 114 Ca 0.01 -0.80 0.11 0.00 0.00 0.00 0.00 51.96 51.28 3ijc s ALA 114 Cb -0.10 -1.69 -0.04 0.00 0.00 0.00 0.00 23.12 21.30 3ijc s ALA 114 CO 0.03 0.68 -0.26 0.95 0.00 0.00 0.00 175.76 177.15 3ijc s THR 115 N -1.15 2.31 -0.07 0.00 -4.23 0.31 -1.96 115.64 110.85 3ijc s THR 115 Ca 0.21 -1.70 0.01 0.00 -1.18 0.00 0.00 61.69 59.03 3ijc s THR 115 Cb -0.12 -2.01 0.02 0.00 1.34 0.00 0.00 72.50 71.72 3ijc s THR 115 CO 0.12 0.12 -0.09 0.68 -0.54 0.00 0.00 174.62 174.91 3ijc s VAL 116 N -1.04 0.90 -0.13 2.29 -7.23 -0.24 -1.16 120.40 113.78 3ijc s VAL 116 Ca 0.14 -0.31 -0.33 0.00 -1.81 0.00 0.00 61.98 59.66 3ijc s VAL 116 Cb -0.10 -0.87 0.13 0.00 0.56 0.00 0.00 36.38 36.10 3ijc s VAL 116 CO 0.06 0.31 1.21 -0.83 -0.31 0.00 0.00 175.10 175.54 3ijc s GLY 117 N 0.95 -0.33 0.00 2.32 0.00 -1.06 -1.32 107.32 107.89 3ijc s GLY 117 Ca -0.10 1.30 0.00 0.00 0.00 0.00 0.00 44.72 45.92 3ijc s GLY 117 CO 0.00 0.40 0.00 -1.26 0.00 0.00 0.00 173.10 172.25 3ijc n SER 118 N -0.21 0.00 -2.23 1.64 2.88 -1.24 -1.41 113.62 113.05 3ijc n SER 118 Ca -0.02 0.00 -0.28 0.00 -1.33 0.00 0.00 58.87 57.23 3ijc n SER 118 Cb 0.60 0.00 0.13 0.00 -0.75 0.00 0.00 64.21 64.19 3ijc n SER 118 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 3ijc n ASN 119 N -0.11 5.53 -4.22 -3.46 2.04 -1.23 -1.21 115.26 112.60 3ijc n ASN 119 Ca 0.00 -3.70 -0.12 0.00 -0.44 0.00 0.00 54.58 50.31 3ijc n ASN 119 Cb 0.00 -0.88 -0.10 0.00 -2.53 0.00 0.00 39.78 36.27 3ijc n ASN 119 CO 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 177.26 176.82 3ijc s ARG 120 N -3.55 1.05 -0.04 -3.83 1.70 -0.50 -1.15 118.95 112.63 3ijc s ARG 120 Ca 0.60 -1.50 0.03 0.00 -0.47 0.00 0.00 55.73 54.40 3ijc s ARG 120 Cb 0.49 -0.16 0.00 0.00 -0.57 0.00 0.00 34.95 34.71 3ijc s ARG 120 CO 0.05 -0.14 -0.13 0.54 -1.08 0.00 0.00 175.30 174.53 3ijc s VAL 121 N -3.73 1.12 -0.06 4.99 0.11 -0.42 -2.56 120.40 119.85 3ijc s VAL 121 Ca 0.23 -0.53 0.04 0.00 -2.93 0.00 0.00 61.98 58.79 3ijc s VAL 121 Cb 0.06 -0.99 -0.00 0.00 -1.53 0.00 0.00 36.38 33.92 3ijc s VAL 121 CO 0.03 0.34 -0.19 -0.89 -3.33 0.00 0.00 175.10 171.05 3ijc s THR 122 N 0.22 1.65 -0.16 5.04 2.01 -0.31 -1.08 115.64 123.01 3ijc s THR 122 Ca -0.06 -0.82 -0.08 0.00 0.31 0.00 0.00 61.69 61.05 3ijc s THR 122 Cb -0.11 -1.43 -0.04 0.00 0.01 0.00 0.00 72.50 70.93 3ijc s THR 122 CO 0.02 0.47 0.12 -0.76 -0.69 0.00 0.00 174.62 173.78 3ijc s LEU 123 N 0.18 4.23 0.12 4.42 1.02 -0.89 -0.53 118.68 127.22 3ijc s LEU 123 Ca -0.09 0.32 0.07 0.00 0.02 0.00 0.00 54.13 54.44 3ijc s LEU 123 Cb -0.14 -2.06 -0.04 0.00 0.02 0.00 0.00 46.19 43.97 3ijc s LEU 123 CO 0.04 0.29 -0.16 -0.31 0.02 0.00 0.00 176.35 176.23 3ijc s TYR 124 N -0.30 1.50 -0.11 0.29 2.02 -0.52 -1.48 117.35 118.75 3ijc s TYR 124 Ca 0.11 -0.50 0.03 0.00 -0.37 0.00 0.00 57.07 56.34 3ijc s TYR 124 Cb -0.12 -0.79 0.01 0.00 -0.40 0.00 0.00 41.96 40.66 3ijc s TYR 124 CO 0.01 0.17 -0.20 -2.00 -1.57 0.00 0.00 175.55 171.96 3ijc s GLU 125 N -2.38 2.69 0.05 -0.62 2.12 0.05 -1.63 118.70 118.98 3ijc s GLU 125 Ca 0.07 -0.74 -0.30 0.00 0.36 0.00 0.00 54.97 54.36 3ijc s GLU 125 Cb -0.07 -2.15 -0.05 0.00 0.26 0.00 0.00 34.13 32.13 3ijc s GLU 125 CO 0.04 0.05 1.13 0.00 -0.54 0.00 0.00 175.26 175.93 3ijc s HIS 127 N 0.97 1.90 1.11 0.00 3.76 0.46 -4.33 115.29 119.15 3ijc s HIS 127 Ca 0.56 -1.09 -0.13 0.00 -0.15 0.00 0.00 55.06 54.25 3ijc s HIS 127 Cb -0.27 -1.29 0.25 0.00 1.11 0.00 0.00 32.58 32.37 3ijc s HIS 127 CO 0.29 -0.08 1.06 -1.54 -0.85 0.00 0.00 174.74 173.62 3ijc s SER 128 N -3.60 1.61 -1.48 1.40 1.04 -1.26 -2.87 113.70 108.55 3ijc s SER 128 Ca 0.27 1.24 -0.13 0.00 0.48 0.00 0.00 55.95 57.80 3ijc s SER 128 Cb 0.05 -1.92 0.10 0.00 0.10 0.00 0.00 66.02 64.35 3ijc s SER 128 CO 0.14 -3.77 0.70 0.00 0.98 0.00 0.00 173.24 171.29 3ijc n GLN 129 N -4.60 -3.84 -1.16 4.02 3.00 -1.26 -2.02 117.38 111.52 3ijc n GLN 129 Ca 0.05 0.48 -0.05 0.00 -0.01 0.00 0.00 57.00 57.46 3ijc n GLN 129 Cb 0.56 -5.24 -0.02 0.00 0.00 0.00 0.00 30.24 25.54 3ijc n GLN 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 3ijc n GLY 130 N -1.36 0.58 3.71 1.08 0.00 -1.24 -4.96 105.19 102.99 3ijc n GLY 130 Ca 0.03 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 3ijc n GLY 130 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3ijc s GLU 131 N -2.30 4.16 -0.45 1.61 2.12 -0.86 -4.58 118.70 118.41 3ijc s GLU 131 Ca 0.00 2.50 -0.07 0.00 0.36 0.00 0.00 54.97 57.76 3ijc s GLU 131 Cb 0.00 -3.34 0.11 0.00 0.26 0.00 0.00 34.13 31.16 3ijc s GLU 131 CO 0.00 -0.75 0.30 0.42 -0.54 0.00 0.00 175.26 174.69 3ijc s ILE 132 N 1.90 3.94 -0.30 -3.70 1.01 -1.26 -0.40 121.20 122.38 3ijc s ILE 132 Ca 0.75 -1.83 -0.25 0.00 0.00 0.00 0.00 60.65 59.32 3ijc s ILE 132 Cb -0.46 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.41 3ijc s ILE 132 CO 0.33 -0.73 0.85 -0.60 0.00 0.00 0.00 174.94 174.80 3ijc s ARG 133 N 1.30 4.01 0.06 2.79 3.52 -0.54 -4.88 118.95 125.21 3ijc s ARG 133 Ca 0.06 0.73 -0.31 0.00 -0.13 0.00 0.00 55.73 56.09 3ijc s ARG 133 Cb -0.25 -3.72 -0.07 0.00 -1.56 0.00 0.00 34.95 29.35 3ijc s ARG 133 CO -0.02 -0.71 1.45 -1.17 -0.81 0.00 0.00 175.30 174.05 3ijc s LEU 134 N 3.08 4.35 0.00 -0.88 2.96 -1.26 -0.77 118.68 126.16 3ijc s LEU 134 Ca 0.35 2.27 0.00 0.00 -0.22 0.00 0.00 54.13 56.54 3ijc s LEU 134 Cb -0.14 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.98 3ijc s LEU 134 CO 0.12 -0.73 0.00 0.18 -1.32 0.00 0.00 176.35 174.60 3ijc n LEU 135 N 4.90 0.01 -3.66 -0.68 4.77 -0.55 -4.95 117.00 116.83 3ijc n LEU 135 Ca 0.13 0.00 -0.15 0.00 -0.03 0.00 0.00 56.01 55.96 3ijc n LEU 135 Cb 0.42 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.44 3ijc n LEU 135 CO 0.59 0.00 0.20 -1.58 -1.33 0.00 0.00 177.39 175.27 3ijc s GLN 136 N 0.00 0.83 0.14 3.23 0.74 -1.24 -5.01 119.66 118.35 3ijc s GLN 136 Ca 0.00 0.00 0.07 0.00 0.05 0.00 0.00 55.36 55.48 3ijc s GLN 136 Cb 0.00 0.38 -0.04 0.00 1.10 0.00 0.00 33.01 34.45 3ijc s GLN 136 CO 0.00 -0.24 -0.03 -1.12 -0.55 0.00 0.00 175.29 173.35 3ijc s SER 137 N -1.25 4.71 -0.22 6.67 0.01 -1.26 -2.09 113.70 120.27 3ijc s SER 137 Ca -0.12 -0.35 -0.12 0.00 1.31 0.00 0.00 55.95 56.67 3ijc s SER 137 Cb -0.03 -1.00 -0.05 0.00 0.21 0.00 0.00 66.02 65.15 3ijc s SER 137 CO 0.07 0.13 0.21 -0.47 0.41 0.00 0.00 173.24 173.58 3ijc s TYR 138 N -1.51 3.36 -0.21 2.43 5.04 -0.24 -4.93 117.35 121.29 3ijc s TYR 138 Ca 0.25 0.35 -0.02 0.00 -2.44 0.00 0.00 57.07 55.22 3ijc s TYR 138 Cb -0.10 -2.29 0.01 0.00 0.35 0.00 0.00 41.96 39.92 3ijc s TYR 138 CO 0.17 0.13 -0.09 0.08 -1.34 0.00 0.00 175.55 174.50 3ijc s VAL 139 N 0.87 2.91 0.36 3.14 1.01 -1.26 -1.30 120.40 126.12 3ijc s VAL 139 Ca 0.10 -0.71 -0.28 0.00 0.00 0.00 0.00 61.98 61.09 3ijc s VAL 139 Cb -0.13 -2.33 -0.11 0.00 0.00 0.00 0.00 36.38 33.82 3ijc s VAL 139 CO 0.03 0.42 1.41 -0.62 0.00 0.00 0.00 175.10 176.34 3ijc s ASP 140 N 1.40 6.53 0.49 3.32 -1.08 -0.30 -4.92 116.67 122.11 3ijc s ASP 140 Ca 0.05 2.89 0.19 0.00 -0.52 0.00 0.00 52.55 55.15 3ijc s ASP 140 Cb -0.14 -2.66 1.23 0.00 -1.46 0.00 0.00 42.92 39.88 3ijc s ASP 140 CO -0.06 -0.73 2.03 0.00 0.52 0.00 0.00 175.17 176.93 3ijc h ALA 141 N 3.16 2.19 -1.82 3.66 0.00 -1.99 -3.37 119.26 121.09 3ijc h ALA 141 Ca -0.50 -0.01 -0.58 0.00 0.00 0.00 0.00 54.91 53.82 3ijc h ALA 141 Cb 1.23 -0.02 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 3ijc h ALA 141 CO 0.65 -0.29 0.76 0.34 0.00 0.00 0.00 179.25 180.71 3ijc s ASP 142 N -6.46 6.58 0.29 0.00 -1.08 -1.26 -4.89 116.67 109.85 3ijc s ASP 142 Ca -0.06 0.33 0.21 0.00 -0.52 0.00 0.00 52.55 52.51 3ijc s ASP 142 Cb 0.19 -2.50 1.06 0.00 -1.46 0.00 0.00 42.92 40.21 3ijc s ASP 142 CO 0.72 -1.15 1.64 0.00 0.52 0.00 0.00 175.17 176.91 3ijc n ALA 143 N 7.50 1.22 0.99 3.66 0.00 -1.26 -2.23 120.51 130.39 3ijc n ALA 143 Ca 0.09 0.16 0.12 0.00 0.00 0.00 0.00 53.44 53.81 3ijc n ALA 143 Cb 0.49 -1.32 0.16 0.00 0.00 0.00 0.00 19.45 18.77 3ijc n ALA 143 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 3ijc n ASP 144 N -2.21 0.62 -4.75 0.00 8.00 -1.26 -4.83 116.55 112.12 3ijc n ASP 144 Ca -0.00 -0.42 -0.39 0.00 0.71 0.00 0.00 54.79 54.68 3ijc n ASP 144 Cb 0.09 0.44 0.03 0.00 -0.02 0.00 0.00 41.12 41.66 3ijc n ASP 144 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 3ijc n GLU 145 N -1.51 1.88 -3.68 -1.24 4.07 -0.94 -4.93 120.64 114.29 3ijc n GLU 145 Ca 0.05 0.68 -0.27 0.00 -0.06 0.00 0.00 57.16 57.56 3ijc n GLU 145 Cb 0.34 -2.59 -0.16 0.00 -0.06 0.00 0.00 31.44 28.96 3ijc n GLU 145 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 3ijc s ASN 146 N -0.76 2.81 0.13 4.31 3.84 -1.26 -3.58 114.94 120.43 3ijc s ASN 146 Ca 0.68 -0.82 -0.30 0.00 0.21 0.00 0.00 52.86 52.63 3ijc s ASN 146 Cb -0.43 -0.47 -0.06 0.00 -0.55 0.00 0.00 41.25 39.74 3ijc s ASN 146 CO 0.52 -0.34 1.03 -0.36 -2.79 0.00 0.00 177.10 175.16 3ijc s PHE 147 N 1.96 3.71 -0.09 0.43 0.08 -0.35 -0.15 117.98 123.56 3ijc s PHE 147 Ca 0.01 1.70 0.11 0.00 0.12 0.00 0.00 56.93 58.87 3ijc s PHE 147 Cb -0.17 -3.16 -0.16 0.00 -0.57 0.00 0.00 43.02 38.96 3ijc s PHE 147 CO -0.11 -0.18 0.10 0.66 -0.10 0.00 0.00 175.22 175.60 3ijc n TYR 148 N 2.74 0.00 -3.53 0.36 4.01 -0.54 -4.03 117.16 116.16 3ijc n TYR 148 Ca 0.03 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.66 3ijc n TYR 148 Cb 0.48 -0.52 -0.03 0.00 -0.31 0.00 0.00 39.34 38.95 3ijc n TYR 148 CO 0.00 0.00 0.00 -0.08 -0.46 0.00 0.00 176.86 176.32 3ijc s THR 149 N -2.44 0.03 0.20 -0.72 -1.32 -1.01 -3.96 115.64 106.41 3ijc s THR 149 Ca -0.06 -0.30 -0.09 0.00 -1.21 0.00 0.00 61.69 60.04 3ijc s THR 149 Cb 0.05 -1.13 -0.01 0.00 -1.51 0.00 0.00 72.50 69.90 3ijc s THR 149 CO 0.51 -0.13 0.33 0.00 -2.21 0.00 0.00 174.62 173.11 3ijc s ALA 151 N -4.02 -1.64 0.19 0.00 0.00 -0.21 -4.85 121.76 111.23 3ijc s ALA 151 Ca 0.23 1.93 -0.03 0.00 0.00 0.00 0.00 51.96 54.10 3ijc s ALA 151 Cb 0.03 -1.13 -0.05 0.00 0.00 0.00 0.00 23.12 21.97 3ijc s ALA 151 CO 0.06 -0.32 0.40 -1.58 0.00 0.00 0.00 175.76 174.32 3ijc s TRP 152 N 0.63 3.48 0.22 0.00 0.52 -1.26 -0.42 118.94 122.11 3ijc s TRP 152 Ca -0.02 0.45 -0.07 0.00 0.02 0.00 0.00 56.10 56.48 3ijc s TRP 152 Cb -0.05 -1.94 0.03 0.00 -1.15 0.00 0.00 33.47 30.36 3ijc s TRP 152 CO -0.04 0.38 0.42 -2.37 0.02 0.00 0.00 176.95 175.36 3ijc n THR 153 N -0.39 0.00 -4.06 2.01 5.66 -0.73 -4.79 114.28 111.99 3ijc n THR 153 Ca -0.03 -0.70 -0.33 0.00 -3.05 0.00 0.00 64.05 59.94 3ijc n THR 153 Cb 0.53 0.59 -0.06 0.00 -1.55 0.00 0.00 70.33 69.84 3ijc n THR 153 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 3ijc s TYR 154 N -4.71 3.33 -0.18 1.09 2.02 -1.26 -0.68 117.35 116.96 3ijc s TYR 154 Ca 0.11 0.23 -0.29 0.00 -0.37 0.00 0.00 57.07 56.75 3ijc s TYR 154 Cb -0.02 -1.75 -0.00 0.00 -0.40 0.00 0.00 41.96 39.79 3ijc s TYR 154 CO 0.08 0.57 1.10 0.34 -1.57 0.00 0.00 175.55 176.07 3ijc s ASP 155 N -1.83 7.08 0.34 2.29 -1.08 0.15 -4.75 116.67 118.86 3ijc s ASP 155 Ca 0.24 1.52 0.15 0.00 -0.52 0.00 0.00 52.55 53.95 3ijc s ASP 155 Cb -0.12 -2.54 0.57 0.00 -1.46 0.00 0.00 42.92 39.36 3ijc s ASP 155 CO 0.16 -0.64 1.70 0.77 0.52 0.00 0.00 175.17 177.67 3ijc h SER 156 N 7.57 0.00 0.40 -0.34 4.64 -1.93 -0.40 113.55 123.49 3ijc h SER 156 Ca -0.24 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 60.81 3ijc h SER 156 Cb 1.10 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 63.20 3ijc h SER 156 CO 0.95 0.47 -1.18 0.78 -0.87 0.00 0.00 176.83 176.98 3ijc h ASN 157 N 0.00 0.59 -0.07 4.97 2.35 -1.98 -3.38 115.58 118.07 3ijc h ASN 157 Ca -0.00 -0.56 0.00 0.00 -0.55 0.00 0.00 56.30 55.18 3ijc h ASN 157 Cb 0.94 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 39.13 3ijc h ASN 157 CO 0.06 1.40 0.00 0.35 -1.65 0.00 0.00 177.43 177.59 3ijc n THR 158 N -3.67 0.24 -0.08 2.81 -2.24 -1.24 -5.00 114.28 105.11 3ijc n THR 158 Ca -0.10 -0.62 0.00 0.00 -2.27 0.00 0.00 64.05 61.06 3ijc n THR 158 Cb 0.97 1.01 0.00 0.00 -2.10 0.00 0.00 70.33 70.20 3ijc n THR 158 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3ijc n SER 159 N 0.40 0.00 -4.86 3.42 3.41 -0.16 -4.98 113.62 110.85 3ijc n SER 159 Ca 0.06 0.00 -0.31 0.00 -0.26 0.00 0.00 58.87 58.35 3ijc n SER 159 Cb 0.24 -1.50 0.01 0.00 -0.26 0.00 0.00 64.21 62.71 3ijc n SER 159 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 3ijc s HIS 160 N -0.89 3.53 0.54 7.33 3.76 -1.25 -4.56 115.29 123.73 3ijc s HIS 160 Ca 0.00 1.33 -0.21 0.00 -0.15 0.00 0.00 55.06 56.04 3ijc s HIS 160 Cb 0.00 -2.76 -0.05 0.00 1.11 0.00 0.00 32.58 30.88 3ijc s HIS 160 CO 0.00 -0.73 1.20 -2.14 -0.85 0.00 0.00 174.74 172.22 3ijc s PRO 161 N -5.01 3.31 0.17 8.40 0.02 -1.26 0.30 135.00 140.93 3ijc s PRO 161 Ca 0.56 1.83 0.06 0.00 0.02 0.00 0.00 61.00 63.47 3ijc s PRO 161 Cb -0.11 -2.14 -0.04 0.00 0.02 0.00 0.00 34.50 32.22 3ijc s PRO 161 CO 0.51 -0.93 -0.13 -0.51 -0.33 0.00 0.00 177.00 175.61 3ijc s LEU 162 N -3.62 2.52 -0.11 -5.54 1.43 0.14 -4.38 118.68 109.13 3ijc s LEU 162 Ca 0.71 -0.98 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 3ijc s LEU 162 Cb -0.30 -0.55 0.02 0.00 0.03 0.00 0.00 46.19 45.39 3ijc s LEU 162 CO 0.34 -0.22 -0.09 -0.22 0.23 0.00 0.00 176.35 176.40 3ijc s LEU 163 N -3.10 1.29 -0.12 1.79 2.96 -0.27 -1.77 118.68 119.46 3ijc s LEU 163 Ca 0.18 -0.32 -0.16 0.00 -0.22 0.00 0.00 54.13 53.61 3ijc s LEU 163 Cb -0.00 -0.86 -0.04 0.00 0.50 0.00 0.00 46.19 45.78 3ijc s LEU 163 CO 0.04 -0.09 0.40 0.00 -1.32 0.00 0.00 176.35 175.38 3ijc s ALA 164 N 1.53 3.53 0.05 5.97 0.00 0.44 -0.50 121.76 132.79 3ijc s ALA 164 Ca 0.02 -0.29 0.06 0.00 0.00 0.00 0.00 51.96 51.75 3ijc s ALA 164 Cb -0.13 -2.53 -0.02 0.00 0.00 0.00 0.00 23.12 20.43 3ijc s ALA 164 CO -0.07 0.07 -0.17 0.54 0.00 0.00 0.00 175.76 176.14 3ijc s VAL 165 N 0.43 1.32 0.20 0.00 0.11 -0.18 -1.04 120.40 121.23 3ijc s VAL 165 Ca 0.22 -1.14 -0.20 0.00 -2.93 0.00 0.00 61.98 57.93 3ijc s VAL 165 Cb -0.14 -1.19 0.04 0.00 -1.53 0.00 0.00 36.38 33.56 3ijc s VAL 165 CO 0.08 0.03 0.59 0.00 -3.33 0.00 0.00 175.10 172.47 3ijc s ALA 166 N -0.91 -1.26 0.00 1.54 0.00 -1.00 -0.19 121.76 119.94 3ijc s ALA 166 Ca 0.03 0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.04 3ijc s ALA 166 Cb -0.09 0.86 0.00 0.00 0.00 0.00 0.00 23.12 23.89 3ijc s ALA 166 CO 0.02 -0.83 0.00 0.41 0.00 0.00 0.00 175.76 175.35 3ijc n GLY 167 N -0.38 2.12 0.37 0.00 0.00 -1.26 -1.47 105.19 104.57 3ijc n GLY 167 Ca -0.12 0.11 0.00 0.00 0.00 0.00 0.00 46.02 46.02 3ijc n GLY 167 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3ijc h SER 168 N 0.00 1.07 0.62 1.61 4.64 -0.81 -0.76 113.55 119.91 3ijc h SER 168 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3ijc h SER 168 Cb 0.00 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 61.85 3ijc h SER 168 CO 0.00 0.73 0.00 0.54 -0.87 0.00 0.00 176.83 177.23 3ijc n ARG 169 N -4.46 0.09 -2.71 4.77 1.74 -1.26 -3.37 116.66 111.45 3ijc n ARG 169 Ca 0.14 0.32 -0.15 0.00 -0.77 0.00 0.00 57.85 57.39 3ijc n ARG 169 Cb 0.11 -1.67 0.02 0.00 -1.02 0.00 0.00 32.46 29.90 3ijc n ARG 169 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3ijc n GLY 170 N 0.03 -0.14 3.28 -0.13 0.00 -0.72 -4.25 105.19 103.26 3ijc n GLY 170 Ca 0.03 -0.18 -0.33 0.00 0.00 0.00 0.00 46.02 45.54 3ijc n GLY 170 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ijc s ILE 171 N -2.94 2.68 -0.24 -0.61 1.01 -1.26 -4.17 121.20 115.66 3ijc s ILE 171 Ca 0.18 -0.78 -0.24 0.00 0.00 0.00 0.00 60.65 59.81 3ijc s ILE 171 Cb -0.08 -2.12 -0.01 0.00 0.01 0.00 0.00 42.46 40.27 3ijc s ILE 171 CO 0.22 0.52 0.82 -0.63 0.00 0.00 0.00 174.94 175.88 3ijc s ILE 172 N 0.66 4.84 -0.20 2.92 1.01 -0.53 -4.27 121.20 125.64 3ijc s ILE 172 Ca -0.08 1.55 -0.09 0.00 0.00 0.00 0.00 60.65 62.02 3ijc s ILE 172 Cb -0.16 -4.11 -0.05 0.00 0.01 0.00 0.00 42.46 38.16 3ijc s ILE 172 CO 0.02 -0.07 0.12 -0.13 0.00 0.00 0.00 174.94 174.88 3ijc s ARG 173 N 2.82 4.12 -0.35 2.79 1.81 0.74 -1.19 118.95 129.68 3ijc s ARG 173 Ca 0.34 -0.26 -0.13 0.00 -1.72 0.00 0.00 55.73 53.97 3ijc s ARG 173 Cb -0.15 -3.38 -0.01 0.00 -0.45 0.00 0.00 34.95 30.96 3ijc s ARG 173 CO 0.07 0.27 0.25 0.42 -0.68 0.00 0.00 175.30 175.63 3ijc s ILE 174 N 0.43 5.24 -0.16 1.52 -1.09 0.39 -1.01 121.20 126.52 3ijc s ILE 174 Ca 0.07 -0.30 -0.03 0.00 -2.23 0.00 0.00 60.65 58.16 3ijc s ILE 174 Cb -0.12 -3.73 -0.02 0.00 -1.58 0.00 0.00 42.46 37.01 3ijc s ILE 174 CO -0.01 -0.06 -0.07 -0.63 -1.23 0.00 0.00 174.94 172.95 3ijc s ILE 175 N 1.71 3.51 -0.36 2.92 1.01 0.35 0.66 121.20 131.00 3ijc s ILE 175 Ca 0.06 -0.48 -0.29 0.00 0.00 0.00 0.00 60.65 59.94 3ijc s ILE 175 Cb -0.18 -2.53 -0.00 0.00 0.01 0.00 0.00 42.46 39.76 3ijc s ILE 175 CO 0.10 0.49 1.54 0.21 0.00 0.00 0.00 174.94 177.28 3ijc s ASN 176 N 0.60 6.24 0.56 3.58 3.84 0.10 -1.11 114.94 128.75 3ijc s ASN 176 Ca -0.04 1.08 0.34 0.00 0.21 0.00 0.00 52.86 54.45 3ijc s ASN 176 Cb -0.15 -2.54 1.45 0.00 -0.55 0.00 0.00 41.25 39.47 3ijc s ASN 176 CO 0.03 -1.47 2.01 1.55 -2.79 0.00 0.00 177.10 176.43 3ijc h PRO 177 N 11.22 0.00 0.55 0.43 0.13 -1.87 0.46 132.00 142.91 3ijc h PRO 177 Ca -0.30 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.80 3ijc h PRO 177 Cb 1.13 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.26 3ijc h PRO 177 CO 1.06 0.00 -0.27 0.82 -0.23 0.00 0.00 178.00 179.38 3ijc h ILE 178 N 0.00 0.39 -0.00 -3.56 2.04 -1.91 -3.35 117.51 111.12 3ijc h ILE 178 Ca 0.00 -0.25 0.00 0.00 1.00 0.00 0.00 64.86 65.61 3ijc h ILE 178 Cb 0.47 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.04 3ijc h ILE 178 CO 0.00 0.04 -0.78 0.35 0.00 0.00 0.00 178.15 177.75 3ijc n THR 179 N -5.35 0.00 -1.60 -0.27 -2.24 -1.18 -4.96 114.28 98.68 3ijc n THR 179 Ca -0.12 -0.06 -0.18 0.00 -2.27 0.00 0.00 64.05 61.42 3ijc n THR 179 Cb 0.33 0.90 -0.07 0.00 -2.10 0.00 0.00 70.33 69.38 3ijc n THR 179 CO 0.00 0.00 0.00 0.23 -0.57 0.00 0.00 175.07 174.73 3ijc n MET 180 N -1.18 -1.44 -2.38 -0.78 2.81 0.16 -4.99 117.12 109.33 3ijc n MET 180 Ca 0.06 1.06 -0.39 0.00 -1.81 0.00 0.00 57.70 56.62 3ijc n MET 180 Cb 0.36 -5.43 -0.03 0.00 -0.71 0.00 0.00 33.22 27.41 3ijc n MET 180 CO 0.00 0.00 0.00 -0.65 1.51 0.00 0.00 175.97 176.83 3ijc s GLN 181 N -3.66 4.35 -0.29 0.03 -0.21 -1.20 -4.67 119.66 114.02 3ijc s GLN 181 Ca 0.00 1.83 -0.23 0.00 0.02 0.00 0.00 55.36 56.98 3ijc s GLN 181 Cb 0.00 -2.92 -0.00 0.00 1.00 0.00 0.00 33.01 31.08 3ijc s GLN 181 CO 0.00 -0.05 0.75 0.00 -2.12 0.00 0.00 175.29 173.87 3ijc h ILE 183 N 5.53 0.90 -2.07 0.00 3.07 -0.14 -3.49 117.51 121.31 3ijc h ILE 183 Ca -0.25 -2.66 0.20 0.00 1.55 0.00 0.00 64.86 63.70 3ijc h ILE 183 Cb 1.10 2.54 -0.11 0.00 -0.27 0.00 0.00 36.82 40.08 3ijc h ILE 183 CO 0.85 0.70 0.59 -1.59 -1.05 0.00 0.00 178.15 177.64 3ijc s LYS 184 N -2.60 0.88 0.06 0.16 -2.85 -1.20 -5.03 119.74 109.16 3ijc s LYS 184 Ca -0.10 -0.45 -0.04 0.00 -1.00 0.00 0.00 55.97 54.37 3ijc s LYS 184 Cb 0.07 0.32 -0.02 0.00 -2.06 0.00 0.00 37.83 36.15 3ijc s LYS 184 CO 0.82 -0.40 0.07 -3.38 0.10 0.00 0.00 175.35 172.55 3ijc s HIS 185 N -3.00 0.34 -0.04 1.78 -3.43 -1.26 -0.46 115.29 109.22 3ijc s HIS 185 Ca 0.11 -0.82 0.04 0.00 -0.80 0.00 0.00 55.06 53.59 3ijc s HIS 185 Cb 0.00 -0.24 -0.00 0.00 -1.43 0.00 0.00 32.58 30.91 3ijc s HIS 185 CO -0.02 -0.44 -0.15 0.71 -2.00 0.00 0.00 174.74 172.85 3ijc s TYR 186 N -3.73 1.48 -0.10 0.38 2.02 -0.34 -4.98 117.35 112.09 3ijc s TYR 186 Ca 0.05 -0.42 0.04 0.00 -0.37 0.00 0.00 57.07 56.37 3ijc s TYR 186 Cb 0.06 -1.01 -0.00 0.00 -0.40 0.00 0.00 41.96 40.60 3ijc s TYR 186 CO -0.10 -0.15 -0.24 0.08 -1.57 0.00 0.00 175.55 173.58 3ijc s VAL 187 N 0.11 2.10 0.00 0.71 1.01 -1.26 -1.45 120.40 121.62 3ijc s VAL 187 Ca -0.04 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 60.93 3ijc s VAL 187 Cb -0.11 -1.80 0.00 0.00 0.00 0.00 0.00 36.38 34.47 3ijc s VAL 187 CO 0.02 0.56 0.00 0.61 0.00 0.00 0.00 175.10 176.29 3ijc n GLY 188 N 3.48 0.78 0.25 4.51 0.00 -1.26 -4.89 105.19 108.06 3ijc n GLY 188 Ca -0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.96 3ijc n GLY 188 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ijc n HIS 189 N 0.00 0.00 -0.71 1.61 8.25 -1.26 -5.00 115.22 118.10 3ijc n HIS 189 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 3ijc n HIS 189 Cb 0.00 -0.12 0.00 0.00 1.12 0.00 0.00 29.99 30.99 3ijc n HIS 189 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3ijc n GLY 190 N 1.33 1.00 3.69 -1.41 0.00 -1.26 -5.09 105.19 103.44 3ijc n GLY 190 Ca 0.13 -0.46 -0.29 0.00 0.00 0.00 0.00 46.02 45.40 3ijc n GLY 190 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3ijc s ASN 191 N -2.46 5.00 0.28 1.61 0.01 -1.26 -4.38 114.94 113.73 3ijc s ASN 191 Ca 0.00 -0.24 -0.29 0.00 -0.71 0.00 0.00 52.86 51.62 3ijc s ASN 191 Cb 0.00 -1.17 -0.14 0.00 0.41 0.00 0.00 41.25 40.36 3ijc s ASN 191 CO 0.00 0.14 1.20 0.00 -1.51 0.00 0.00 177.10 176.93 3ijc n ALA 192 N 0.27 0.41 -2.65 0.60 0.00 -1.22 -3.99 120.51 113.94 3ijc n ALA 192 Ca -0.10 0.40 -0.38 0.00 0.00 0.00 0.00 53.44 53.36 3ijc n ALA 192 Cb 0.53 -2.14 -0.11 0.00 0.00 0.00 0.00 19.45 17.73 3ijc n ALA 192 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ijc s ILE 193 N -0.72 5.17 -0.17 0.00 1.01 -0.37 -0.31 121.20 125.82 3ijc s ILE 193 Ca 0.62 0.10 0.19 0.00 0.00 0.00 0.00 60.65 61.56 3ijc s ILE 193 Cb -0.67 -3.47 -0.09 0.00 0.01 0.00 0.00 42.46 38.23 3ijc s ILE 193 CO 0.57 0.24 0.87 0.59 0.00 0.00 0.00 174.94 177.22 3ijc n ASN 194 N 5.04 0.78 -3.67 3.58 3.02 -0.20 -4.06 115.26 119.76 3ijc n ASN 194 Ca -0.14 0.33 -0.15 0.00 -0.03 0.00 0.00 54.58 54.59 3ijc n ASN 194 Cb 0.52 0.41 -0.08 0.00 -0.61 0.00 0.00 39.78 40.01 3ijc n ASN 194 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 3ijc s GLU 195 N -3.13 0.74 -0.03 3.52 2.56 -1.22 -4.81 118.70 116.33 3ijc s GLU 195 Ca -0.02 0.39 0.07 0.00 0.00 0.00 0.00 54.97 55.40 3ijc s GLU 195 Cb 0.09 0.35 -0.02 0.00 2.00 0.00 0.00 34.13 36.56 3ijc s GLU 195 CO 0.81 -0.16 -0.23 -0.51 -0.56 0.00 0.00 175.26 174.61 3ijc s LEU 196 N -0.48 2.04 -0.06 2.70 1.43 -1.26 -1.15 118.68 121.90 3ijc s LEU 196 Ca -0.06 -0.42 -0.05 0.00 -1.03 0.00 0.00 54.13 52.57 3ijc s LEU 196 Cb -0.03 -1.19 0.02 0.00 0.03 0.00 0.00 46.19 45.02 3ijc s LEU 196 CO 0.04 0.26 0.14 -0.54 0.23 0.00 0.00 176.35 176.49 3ijc s LYS 197 N -0.42 0.15 0.00 1.70 -0.14 -0.12 -4.76 119.74 116.15 3ijc s LYS 197 Ca 0.06 0.23 -0.10 0.00 -1.36 0.00 0.00 55.97 54.79 3ijc s LYS 197 Cb -0.10 0.04 -0.05 0.00 -1.68 0.00 0.00 37.83 36.04 3ijc s LYS 197 CO 0.00 -0.04 0.33 -0.06 -0.76 0.00 0.00 175.35 174.82 3ijc s PHE 198 N 0.26 3.64 0.32 3.18 0.08 -1.26 -0.46 117.98 123.74 3ijc s PHE 198 Ca -0.01 0.77 -0.28 0.00 0.12 0.00 0.00 56.93 57.52 3ijc s PHE 198 Cb -0.03 -2.13 -0.13 0.00 -0.57 0.00 0.00 43.02 40.17 3ijc s PHE 198 CO -0.01 0.62 1.28 1.58 -0.10 0.00 0.00 175.22 178.59 3ijc n HIS 199 N 1.46 2.17 0.27 0.36 -0.00 -0.18 -4.92 115.22 114.39 3ijc n HIS 199 Ca -0.13 0.55 0.16 0.00 -0.00 0.00 0.00 57.72 58.30 3ijc n HIS 199 Cb 0.53 -2.41 0.62 0.00 -0.00 0.00 0.00 29.99 28.74 3ijc n HIS 199 CO 0.00 0.00 0.00 -1.00 -0.00 0.00 0.00 176.34 175.34 3ijc h PRO 200 N 2.70 0.00 0.00 1.57 0.13 -1.87 -3.31 132.00 131.22 3ijc h PRO 200 Ca -0.45 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 3ijc h PRO 200 Cb 1.29 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.41 3ijc h PRO 200 CO 0.64 0.04 -1.46 0.54 -0.23 0.00 0.00 178.00 177.53 3ijc n ARG 201 N -3.15 1.14 -3.97 0.86 5.12 -1.26 -4.92 116.66 110.48 3ijc n ARG 201 Ca 0.01 -0.05 -0.31 0.00 -1.93 0.00 0.00 57.85 55.57 3ijc n ARG 201 Cb 0.34 -1.21 -0.15 0.00 -1.16 0.00 0.00 32.46 30.28 3ijc n ARG 201 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 3ijc s ASP 202 N -3.37 4.37 0.19 0.55 -1.08 -1.25 -4.99 116.67 111.10 3ijc s ASP 202 Ca -0.03 -1.68 0.17 0.00 -0.52 0.00 0.00 52.55 50.48 3ijc s ASP 202 Cb 0.04 -1.40 0.81 0.00 -1.46 0.00 0.00 42.92 40.92 3ijc s ASP 202 CO 0.35 -0.31 1.52 -0.81 0.52 0.00 0.00 175.17 176.44 3ijc n PRO 203 N 4.47 0.11 0.03 4.34 -0.04 -1.26 -2.37 135.00 140.29 3ijc n PRO 203 Ca -0.05 0.49 0.13 0.00 -0.04 0.00 0.00 63.50 64.03 3ijc n PRO 203 Cb 0.42 -1.78 0.39 0.00 -0.04 0.00 0.00 33.50 32.49 3ijc n PRO 203 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3ijc n ASN 204 N -2.00 0.42 -4.38 3.54 4.13 -1.26 -4.56 115.26 111.16 3ijc n ASN 204 Ca 0.01 0.22 -0.44 0.00 1.68 0.00 0.00 54.58 56.04 3ijc n ASN 204 Cb 0.11 -0.20 -0.08 0.00 -1.54 0.00 0.00 39.78 38.07 3ijc n ASN 204 CO 0.00 0.00 0.00 -0.76 0.28 0.00 0.00 177.26 176.78 3ijc s LEU 205 N -3.50 5.60 -0.19 3.41 1.43 -1.00 -0.80 118.68 123.63 3ijc s LEU 205 Ca 0.11 -1.35 -0.06 0.00 -1.03 0.00 0.00 54.13 51.80 3ijc s LEU 205 Cb 0.16 -2.17 -0.03 0.00 0.03 0.00 0.00 46.19 44.19 3ijc s LEU 205 CO 0.63 -0.64 0.02 -0.22 0.23 0.00 0.00 176.35 176.36 3ijc s LEU 206 N 1.62 3.40 -0.21 1.79 2.96 -0.10 -1.01 118.68 127.15 3ijc s LEU 206 Ca 0.04 -0.13 -0.10 0.00 -0.22 0.00 0.00 54.13 53.73 3ijc s LEU 206 Cb -0.24 -1.86 -0.05 0.00 0.50 0.00 0.00 46.19 44.54 3ijc s LEU 206 CO 0.06 0.09 0.12 -0.22 -1.32 0.00 0.00 176.35 175.09 3ijc s LEU 207 N 0.82 4.10 0.04 -0.68 2.96 0.39 0.10 118.68 126.43 3ijc s LEU 207 Ca 0.01 0.17 0.09 0.00 -0.22 0.00 0.00 54.13 54.18 3ijc s LEU 207 Cb -0.14 -2.07 -0.03 0.00 0.50 0.00 0.00 46.19 44.45 3ijc s LEU 207 CO 0.02 0.15 -0.25 -0.94 -1.32 0.00 0.00 176.35 174.02 3ijc s SER 208 N 0.52 3.28 -0.03 3.68 1.04 -0.16 -0.95 113.70 121.09 3ijc s SER 208 Ca 0.07 -0.56 0.07 0.00 0.48 0.00 0.00 55.95 56.02 3ijc s SER 208 Cb -0.12 -0.35 -0.02 0.00 0.10 0.00 0.00 66.02 65.63 3ijc s SER 208 CO -0.00 0.26 -0.25 0.68 0.98 0.00 0.00 173.24 174.91 3ijc s VAL 209 N -0.82 1.97 0.10 5.02 -7.23 -0.30 -0.99 120.40 118.15 3ijc s VAL 209 Ca 0.12 -1.06 0.06 0.00 -1.81 0.00 0.00 61.98 59.30 3ijc s VAL 209 Cb -0.10 -1.64 -0.03 0.00 0.56 0.00 0.00 36.38 35.16 3ijc s VAL 209 CO 0.02 0.56 -0.16 -0.55 -0.31 0.00 0.00 175.10 174.66 3ijc s SER 210 N -0.50 2.07 0.66 4.85 0.15 -0.55 -1.03 113.70 119.35 3ijc s SER 210 Ca 0.07 -0.70 0.33 0.00 0.70 0.00 0.00 55.95 56.36 3ijc s SER 210 Cb -0.10 -0.09 1.82 0.00 -1.71 0.00 0.00 66.02 65.94 3ijc s SER 210 CO -0.00 -0.05 2.04 0.50 1.20 0.00 0.00 173.24 176.93 3ijc h LYS 211 N 3.99 0.00 -0.30 5.44 3.64 -0.85 -1.57 116.57 126.92 3ijc h LYS 211 Ca -0.42 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 3ijc h LYS 211 Cb 1.19 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.01 3ijc h LYS 211 CO 0.43 0.00 0.00 -0.40 -2.27 0.00 0.00 179.45 177.21 3ijc n ASP 212 N -3.03 0.84 0.00 4.20 5.68 -1.26 -4.08 116.55 118.90 3ijc n ASP 212 Ca -0.02 -2.03 0.00 0.00 -0.50 0.00 0.00 54.79 52.24 3ijc n ASP 212 Cb 0.31 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 40.12 3ijc n ASP 212 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3ijc n HIS 213 N -0.12 0.00 -4.16 2.11 8.25 -0.81 -5.01 115.22 115.49 3ijc n HIS 213 Ca 0.04 0.00 -0.29 0.00 -0.26 0.00 0.00 57.72 57.21 3ijc n HIS 213 Cb 0.16 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.19 3ijc n HIS 213 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 3ijc s ALA 214 N -3.25 3.23 0.03 -1.41 0.00 -1.25 -3.99 121.76 115.12 3ijc s ALA 214 Ca 0.00 -1.20 -0.01 0.00 0.00 0.00 0.00 51.96 50.75 3ijc s ALA 214 Cb 0.00 -1.11 -0.04 0.00 0.00 0.00 0.00 23.12 21.97 3ijc s ALA 214 CO 0.00 0.63 0.19 -0.51 0.00 0.00 0.00 175.76 176.07 3ijc s LEU 215 N -2.48 4.34 -0.02 0.00 1.02 -0.33 -1.49 118.68 119.72 3ijc s LEU 215 Ca 0.26 0.29 0.04 0.00 0.02 0.00 0.00 54.13 54.74 3ijc s LEU 215 Cb -0.11 -2.78 -0.00 0.00 0.02 0.00 0.00 46.19 43.32 3ijc s LEU 215 CO 0.18 0.21 -0.13 -0.13 0.02 0.00 0.00 176.35 176.50 3ijc s ARG 216 N -2.24 1.24 -0.21 1.70 0.52 -0.16 -0.03 118.95 119.77 3ijc s ARG 216 Ca 0.31 -0.46 -0.06 0.00 -0.52 0.00 0.00 55.73 55.01 3ijc s ARG 216 Cb -0.13 -1.15 -0.03 0.00 0.52 0.00 0.00 34.95 34.17 3ijc s ARG 216 CO 0.23 0.22 0.02 -1.17 0.02 0.00 0.00 175.30 174.62 3ijc s LEU 217 N -0.04 3.37 0.07 2.53 2.96 0.42 -0.99 118.68 127.00 3ijc s LEU 217 Ca -0.00 -0.16 0.07 0.00 -0.22 0.00 0.00 54.13 53.82 3ijc s LEU 217 Cb -0.08 -1.86 -0.04 0.00 0.50 0.00 0.00 46.19 44.71 3ijc s LEU 217 CO 0.01 0.06 -0.14 0.26 -1.32 0.00 0.00 176.35 175.22 3ijc s TRP 218 N 1.01 2.64 -0.37 5.38 0.52 0.12 0.26 118.94 128.50 3ijc s TRP 218 Ca 0.02 -0.20 -0.08 0.00 0.02 0.00 0.00 56.10 55.86 3ijc s TRP 218 Cb -0.14 -1.45 0.04 0.00 -1.15 0.00 0.00 33.47 30.77 3ijc s TRP 218 CO 0.02 0.34 0.17 1.21 0.02 0.00 0.00 176.95 178.71 3ijc s ASN 219 N -1.80 5.51 0.00 2.95 3.84 0.37 -0.92 114.94 124.90 3ijc s ASN 219 Ca 0.17 -1.18 0.28 0.00 0.21 0.00 0.00 52.86 52.34 3ijc s ASN 219 Cb -0.11 -1.94 1.08 0.00 -0.55 0.00 0.00 41.25 39.73 3ijc s ASN 219 CO 0.09 -0.39 1.76 2.30 -2.79 0.00 0.00 177.10 178.07 3ijc n ILE 220 N 4.89 0.01 -0.05 -5.21 -5.35 0.02 -0.43 119.36 113.24 3ijc n ILE 220 Ca -0.12 -0.24 -0.15 0.00 -0.27 0.00 0.00 62.75 61.97 3ijc n ILE 220 Cb 0.45 0.44 -0.13 0.00 -1.74 0.00 0.00 39.64 38.66 3ijc n ILE 220 CO 0.00 0.00 0.00 -0.61 -1.76 0.00 0.00 176.55 174.18 3ijc h GLN 221 N 2.22 0.05 -0.06 6.28 4.15 -1.93 -3.38 115.11 122.44 3ijc h GLN 221 Ca 0.00 -0.08 0.00 0.00 0.77 0.00 0.00 58.65 59.34 3ijc h GLN 221 Cb 0.47 0.03 0.00 0.00 0.21 0.00 0.00 27.48 28.19 3ijc h GLN 221 CO 0.00 1.01 0.00 0.25 -1.93 0.00 0.00 178.83 178.16 3ijc n THR 222 N -4.55 0.04 -3.51 2.39 -2.24 -1.21 -4.99 114.28 100.22 3ijc n THR 222 Ca -0.10 -0.50 -0.20 0.00 -2.27 0.00 0.00 64.05 60.98 3ijc n THR 222 Cb 0.52 1.37 0.08 0.00 -2.10 0.00 0.00 70.33 70.20 3ijc n THR 222 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 3ijc n ASP 223 N 1.26 -3.37 -4.31 3.42 8.00 0.43 -4.96 116.55 117.02 3ijc n ASP 223 Ca 0.15 -0.61 -0.32 0.00 0.71 0.00 0.00 54.79 54.72 3ijc n ASP 223 Cb 0.58 -5.02 -0.16 0.00 -0.02 0.00 0.00 41.12 36.50 3ijc n ASP 223 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3ijc s THR 224 N -3.36 2.27 -0.46 -3.53 -4.23 -0.79 -4.98 115.64 100.55 3ijc s THR 224 Ca 0.19 -1.00 -0.28 0.00 -1.18 0.00 0.00 61.69 59.42 3ijc s THR 224 Cb -0.09 -1.84 0.01 0.00 1.34 0.00 0.00 72.50 71.92 3ijc s THR 224 CO 0.74 0.57 1.48 -0.22 -0.54 0.00 0.00 174.62 176.65 3ijc s LEU 225 N -0.29 3.50 -0.02 4.79 2.96 -1.26 -0.48 118.68 127.88 3ijc s LEU 225 Ca 0.01 0.67 -0.21 0.00 -0.22 0.00 0.00 54.13 54.37 3ijc s LEU 225 Cb -0.13 -3.32 -0.26 0.00 0.50 0.00 0.00 46.19 42.98 3ijc s LEU 225 CO 0.02 -1.61 1.02 0.58 -1.32 0.00 0.00 176.35 175.05 3ijc h VAL 226 N 6.50 1.48 -2.64 1.68 2.07 -0.53 -3.38 116.25 121.43 3ijc h VAL 226 Ca -0.28 -2.18 -0.07 0.00 0.82 0.00 0.00 66.70 64.98 3ijc h VAL 226 Cb 1.11 2.81 -0.18 0.00 -1.52 0.00 0.00 31.29 33.51 3ijc h VAL 226 CO 1.12 0.62 -0.00 0.00 0.02 0.00 0.00 177.57 179.33 3ijc s ALA 227 N -2.96 -1.30 -0.18 1.67 0.00 -1.11 -1.53 121.76 116.35 3ijc s ALA 227 Ca -0.14 0.71 -0.01 0.00 0.00 0.00 0.00 51.96 52.52 3ijc s ALA 227 Cb 0.02 0.21 0.00 0.00 0.00 0.00 0.00 23.12 23.35 3ijc s ALA 227 CO 0.81 -0.41 -0.13 0.42 0.00 0.00 0.00 175.76 176.45 3ijc s ILE 228 N -1.86 2.70 -0.39 0.00 1.01 -0.19 -0.44 121.20 122.04 3ijc s ILE 228 Ca -0.09 -0.73 -0.12 0.00 0.00 0.00 0.00 60.65 59.71 3ijc s ILE 228 Cb -0.01 -2.18 0.03 0.00 0.01 0.00 0.00 42.46 40.31 3ijc s ILE 228 CO 0.03 0.49 0.24 -0.36 0.00 0.00 0.00 174.94 175.34 3ijc s PHE 229 N 1.19 3.25 0.00 3.97 0.08 0.96 -0.99 117.98 126.44 3ijc s PHE 229 Ca 0.02 -0.96 0.00 0.00 0.12 0.00 0.00 56.93 56.11 3ijc s PHE 229 Cb -0.14 -2.56 0.00 0.00 -0.57 0.00 0.00 43.02 39.75 3ijc s PHE 229 CO -0.05 -0.67 0.00 0.41 -0.10 0.00 0.00 175.22 174.81 3ijc n GLY 230 N 5.03 1.94 0.00 4.36 0.00 -0.42 -1.18 105.19 114.92 3ijc n GLY 230 Ca -0.11 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.03 3ijc n GLY 230 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ijc n GLY 231 N -0.64 0.13 0.35 -0.02 0.00 -1.26 -3.84 105.19 99.92 3ijc n GLY 231 Ca 0.00 -1.43 -0.09 0.00 0.00 0.00 0.00 46.02 44.50 3ijc n GLY 231 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3ijc h VAL 232 N 0.00 0.22 -0.42 1.61 2.07 -1.92 -2.92 116.25 114.90 3ijc h VAL 232 Ca 0.00 0.00 -0.31 0.00 0.82 0.00 0.00 66.70 67.21 3ijc h VAL 232 Cb 0.00 0.22 -0.27 0.00 -1.52 0.00 0.00 31.29 29.72 3ijc h VAL 232 CO 0.00 0.00 -0.73 -0.62 0.02 0.00 0.00 177.57 176.24 3ijc n GLU 233 N -5.42 2.57 -0.44 1.57 -0.58 0.13 -5.05 120.64 113.42 3ijc n GLU 233 Ca -0.01 -3.70 0.00 0.00 -0.42 0.00 0.00 57.16 53.03 3ijc n GLU 233 Cb 0.34 -1.88 0.00 0.00 -0.57 0.00 0.00 31.44 29.33 3ijc n GLU 233 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ijc n GLY 234 N -0.79 0.42 3.76 0.62 0.00 -1.10 -4.32 105.19 103.77 3ijc n GLY 234 Ca 0.30 -1.89 -0.40 0.00 0.00 0.00 0.00 46.02 44.03 3ijc n GLY 234 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3ijc n HIS 235 N -1.32 2.71 0.06 1.61 8.25 -1.26 -4.81 115.22 120.47 3ijc n HIS 235 Ca 0.00 0.45 0.12 0.00 -0.26 0.00 0.00 57.72 58.03 3ijc n HIS 235 Cb 0.00 -2.47 0.25 0.00 1.12 0.00 0.00 29.99 28.89 3ijc n HIS 235 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3ijc n ARG 236 N 0.01 2.59 -3.20 -0.41 5.12 -1.26 -4.77 116.66 114.73 3ijc n ARG 236 Ca 0.04 -2.43 -0.08 0.00 -1.93 0.00 0.00 57.85 53.45 3ijc n ARG 236 Cb 0.40 -1.53 0.01 0.00 -1.16 0.00 0.00 32.46 30.18 3ijc n ARG 236 CO 0.00 0.00 0.00 -3.47 -1.93 0.00 0.00 177.63 172.23 3ijc n ASP 237 N 1.55 -1.52 -4.55 0.55 -0.08 -1.26 -4.93 116.55 106.31 3ijc n ASP 237 Ca 0.21 -2.29 -0.51 0.00 -1.51 0.00 0.00 54.79 50.69 3ijc n ASP 237 Cb 0.61 2.60 -0.05 0.00 2.34 0.00 0.00 41.12 46.62 3ijc n ASP 237 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 3ijc n GLU 238 N -0.42 0.84 -2.92 -0.67 1.02 -1.26 -4.26 120.64 112.97 3ijc n GLU 238 Ca -0.04 0.30 -0.41 0.00 -0.02 0.00 0.00 57.16 56.99 3ijc n GLU 238 Cb 0.45 -1.77 -0.04 0.00 -0.02 0.00 0.00 31.44 30.06 3ijc n GLU 238 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3ijc s VAL 239 N -0.15 4.96 -0.18 2.62 1.01 -0.66 -1.39 120.40 126.60 3ijc s VAL 239 Ca 0.77 1.65 0.16 0.00 0.00 0.00 0.00 61.98 64.55 3ijc s VAL 239 Cb -0.95 -4.13 -0.22 0.00 0.00 0.00 0.00 36.38 31.08 3ijc s VAL 239 CO 0.53 0.17 0.05 0.18 0.00 0.00 0.00 175.10 176.03 3ijc n LEU 240 N 4.18 0.12 -3.75 3.92 4.77 -0.43 -4.05 117.00 121.76 3ijc n LEU 240 Ca 0.02 -0.01 -0.10 0.00 -0.03 0.00 0.00 56.01 55.90 3ijc n LEU 240 Cb 0.51 0.40 -0.05 0.00 -2.33 0.00 0.00 43.42 41.94 3ijc n LEU 240 CO 0.49 0.47 0.08 -0.55 -1.33 0.00 0.00 177.39 176.55 3ijc s SER 241 N -5.29 -0.11 0.13 -1.43 0.15 -1.11 -4.39 113.70 101.66 3ijc s SER 241 Ca -0.10 -0.51 -0.24 0.00 0.70 0.00 0.00 55.95 55.80 3ijc s SER 241 Cb 0.06 0.45 0.07 0.00 -1.71 0.00 0.00 66.02 64.89 3ijc s SER 241 CO 0.74 -0.86 0.72 0.00 1.20 0.00 0.00 173.24 175.04 3ijc s ALA 242 N -3.85 -1.62 -0.18 5.45 0.00 -1.26 -1.89 121.76 118.42 3ijc s ALA 242 Ca 0.06 0.51 -0.14 0.00 0.00 0.00 0.00 51.96 52.40 3ijc s ALA 242 Cb 0.02 0.74 0.05 0.00 0.00 0.00 0.00 23.12 23.93 3ijc s ALA 242 CO -0.09 -0.80 0.46 0.34 0.00 0.00 0.00 175.76 175.67 3ijc s ASP 243 N -2.71 -0.50 0.36 0.00 2.15 0.04 -4.87 116.67 111.14 3ijc s ASP 243 Ca 0.04 0.94 -0.26 0.00 0.43 0.00 0.00 52.55 53.70 3ijc s ASP 243 Cb -0.02 0.91 -0.09 0.00 -0.30 0.00 0.00 42.92 43.43 3ijc s ASP 243 CO -0.09 -0.17 1.09 -0.31 -0.17 0.00 0.00 175.17 175.52 3ijc s TYR 244 N 0.57 3.33 1.12 -5.34 2.02 -1.26 -1.39 117.35 116.39 3ijc s TYR 244 Ca -0.03 1.64 -0.19 0.00 -0.37 0.00 0.00 57.07 58.13 3ijc s TYR 244 Cb -0.04 -3.23 0.28 0.00 -0.40 0.00 0.00 41.96 38.56 3ijc s TYR 244 CO -0.03 -0.74 1.03 -0.40 -1.57 0.00 0.00 175.55 173.83 3ijc n ASP 245 N 0.36 -1.84 -0.21 2.29 5.75 -0.24 -4.65 116.55 118.00 3ijc n ASP 245 Ca 0.03 -1.15 -0.01 0.00 -0.01 0.00 0.00 54.79 53.65 3ijc n ASP 245 Cb 0.47 -0.93 0.09 0.00 -1.03 0.00 0.00 41.12 39.73 3ijc n ASP 245 CO 0.00 0.00 0.00 0.25 -0.11 0.00 0.00 177.20 177.34 3ijc h LEU 246 N 0.00 0.38 0.00 -2.12 5.85 -1.91 -2.10 115.31 115.41 3ijc h LEU 246 Ca -0.38 0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.39 3ijc h LEU 246 Cb 1.16 -0.02 0.00 0.00 0.37 0.00 0.00 40.66 42.17 3ijc h LEU 246 CO 0.25 0.24 -0.38 0.18 -0.34 0.00 0.00 178.44 178.39 3ijc n LEU 247 N -4.89 0.40 -1.64 2.25 4.77 -1.26 -4.79 117.00 111.84 3ijc n LEU 247 Ca 0.08 0.16 -0.13 0.00 -0.03 0.00 0.00 56.01 56.09 3ijc n LEU 247 Cb 0.21 -0.31 0.01 0.00 -2.33 0.00 0.00 43.42 41.00 3ijc n LEU 247 CO 0.26 0.07 -0.08 0.61 -1.33 0.00 0.00 177.39 176.92 3ijc n GLY 248 N 1.48 -0.08 0.13 -0.72 0.00 -0.79 -4.70 105.19 100.50 3ijc n GLY 248 Ca 0.06 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 45.85 3ijc n GLY 248 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ijc h GLU 249 N -0.41 0.00 -3.19 1.61 5.08 -1.92 -3.45 114.58 112.29 3ijc h GLU 249 Ca -0.30 0.00 -0.07 0.00 -1.00 0.00 0.00 59.36 57.99 3ijc h GLU 249 Cb 1.22 0.00 -0.15 0.00 0.50 0.00 0.00 28.75 30.32 3ijc h GLU 249 CO 0.34 0.10 -0.10 -1.59 -1.00 0.00 0.00 179.01 176.77 3ijc s LYS 250 N -3.21 0.98 -0.07 2.33 -2.85 -1.26 0.35 119.74 116.01 3ijc s LYS 250 Ca 0.00 -0.51 0.04 0.00 -1.00 0.00 0.00 55.97 54.50 3ijc s LYS 250 Cb 0.09 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.29 3ijc s LYS 250 CO 0.78 -0.35 -0.19 0.42 0.10 0.00 0.00 175.35 176.10 3ijc s ILE 251 N -3.04 1.65 -0.16 3.79 1.01 -0.11 -1.08 121.20 123.26 3ijc s ILE 251 Ca -0.02 -0.80 -0.06 0.00 0.00 0.00 0.00 60.65 59.77 3ijc s ILE 251 Cb 0.00 -1.43 -0.04 0.00 0.01 0.00 0.00 42.46 41.01 3ijc s ILE 251 CO -0.06 0.47 0.05 -0.32 0.00 0.00 0.00 174.94 175.08 3ijc s MET 252 N 0.26 3.75 0.32 2.79 1.75 -0.49 -0.20 119.30 127.49 3ijc s MET 252 Ca -0.11 -0.34 0.10 0.00 -1.25 0.00 0.00 55.69 54.09 3ijc s MET 252 Cb -0.15 -3.13 -0.06 0.00 2.84 0.00 0.00 34.83 34.33 3ijc s MET 252 CO 0.05 0.39 -0.11 -1.54 -0.65 0.00 0.00 175.02 173.16 3ijc s SER 253 N 0.03 3.77 0.13 1.11 1.04 0.76 -0.78 113.70 119.76 3ijc s SER 253 Ca 0.05 -1.11 -0.19 0.00 0.48 0.00 0.00 55.95 55.19 3ijc s SER 253 Cb -0.12 -0.37 0.05 0.00 0.10 0.00 0.00 66.02 65.67 3ijc s SER 253 CO 0.01 -0.13 0.47 0.00 0.98 0.00 0.00 173.24 174.57 3ijc n GLY 255 N -0.26 2.16 0.25 0.00 0.00 -1.01 -1.31 105.19 105.01 3ijc n GLY 255 Ca -0.16 -0.84 0.16 0.00 0.00 0.00 0.00 46.02 45.18 3ijc n GLY 255 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 3ijc h MET 256 N 0.00 0.00 0.00 1.61 2.86 -1.46 0.23 114.93 118.17 3ijc h MET 256 Ca 0.00 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 3ijc h MET 256 Cb 0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 3ijc h MET 256 CO 0.00 0.00 0.00 -0.40 1.06 0.00 0.00 176.91 177.57 3ijc n ASP 257 N -3.00 0.00 0.00 1.22 5.68 -1.26 -4.48 116.55 114.71 3ijc n ASP 257 Ca 0.01 -1.33 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 3ijc n ASP 257 Cb 0.34 0.00 0.00 0.00 -1.14 0.00 0.00 41.12 40.32 3ijc n ASP 257 CO 0.00 0.00 0.00 1.41 -1.33 0.00 0.00 177.20 177.28 3ijc n HIS 258 N -0.59 0.00 -3.83 2.11 8.25 -0.99 -5.00 115.22 115.16 3ijc n HIS 258 Ca 0.03 0.00 -0.30 0.00 -0.26 0.00 0.00 57.72 57.20 3ijc n HIS 258 Cb 0.01 -0.97 -0.04 0.00 1.12 0.00 0.00 29.99 30.12 3ijc n HIS 258 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 3ijc s SER 259 N -2.32 6.39 -0.15 0.41 1.04 -1.26 -4.58 113.70 113.24 3ijc s SER 259 Ca 0.00 0.35 -0.02 0.00 0.48 0.00 0.00 55.95 56.76 3ijc s SER 259 Cb 0.00 -1.99 -0.02 0.00 0.10 0.00 0.00 66.02 64.11 3ijc s SER 259 CO 0.00 0.09 -0.08 -0.76 0.98 0.00 0.00 173.24 173.47 3ijc s LEU 260 N -2.79 2.96 -0.03 2.42 1.02 -0.32 -2.41 118.68 119.53 3ijc s LEU 260 Ca 0.37 -0.24 0.03 0.00 0.02 0.00 0.00 54.13 54.31 3ijc s LEU 260 Cb -0.12 -1.69 -0.00 0.00 0.02 0.00 0.00 46.19 44.39 3ijc s LEU 260 CO 0.27 0.16 -0.12 -0.54 0.02 0.00 0.00 176.35 176.14 3ijc s LYS 261 N 0.42 1.20 -0.08 1.70 1.02 0.06 -0.89 119.74 123.17 3ijc s LYS 261 Ca -0.07 -0.41 -0.14 0.00 0.02 0.00 0.00 55.97 55.36 3ijc s LYS 261 Cb -0.15 -1.10 -0.05 0.00 -0.52 0.00 0.00 37.83 36.01 3ijc s LYS 261 CO 0.04 0.17 0.36 -1.17 -0.92 0.00 0.00 175.35 173.83 3ijc s LEU 262 N 0.08 4.36 -0.18 3.17 2.96 -0.41 -0.17 118.68 128.49 3ijc s LEU 262 Ca -0.02 0.75 -0.02 0.00 -0.22 0.00 0.00 54.13 54.62 3ijc s LEU 262 Cb -0.09 -2.49 0.05 0.00 0.50 0.00 0.00 46.19 44.16 3ijc s LEU 262 CO 0.01 0.21 -0.00 0.26 -1.32 0.00 0.00 176.35 175.50 3ijc s TRP 263 N -0.30 1.36 0.03 5.38 0.52 0.73 -0.05 118.94 126.60 3ijc s TRP 263 Ca 0.21 -0.99 -0.30 0.00 0.02 0.00 0.00 56.10 55.04 3ijc s TRP 263 Cb -0.15 -1.16 -0.04 0.00 -1.15 0.00 0.00 33.47 30.98 3ijc s TRP 263 CO 0.09 -0.61 1.01 1.03 0.02 0.00 0.00 176.95 178.49 3ijc s ARG 264 N 1.74 4.56 0.00 4.98 0.52 -1.26 -0.93 118.95 128.56 3ijc s ARG 264 Ca -0.01 1.48 0.05 0.00 -0.52 0.00 0.00 55.73 56.73 3ijc s ARG 264 Cb -0.17 -3.43 0.12 0.00 0.52 0.00 0.00 34.95 31.99 3ijc s ARG 264 CO -0.07 -0.05 1.04 0.44 0.02 0.00 0.00 175.30 176.68 3ijc n ILE 265 N 3.75 0.84 -0.69 1.52 -5.35 0.16 -4.34 119.36 115.24 3ijc n ILE 265 Ca 0.06 -0.92 0.09 0.00 -0.27 0.00 0.00 62.75 61.71 3ijc n ILE 265 Cb 0.50 0.60 0.36 0.00 -1.74 0.00 0.00 39.64 39.35 3ijc n ILE 265 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 3ijc n ASN 266 N -0.00 4.86 -4.71 7.28 6.94 -0.97 -3.92 115.26 124.73 3ijc n ASN 266 Ca 0.05 -2.56 -0.33 0.00 -0.02 0.00 0.00 54.58 51.72 3ijc n ASN 266 Cb 0.29 -0.59 0.12 0.00 -2.36 0.00 0.00 39.78 37.24 3ijc n ASN 266 CO 0.00 0.00 0.00 -0.94 -1.03 0.00 0.00 177.26 175.29 3ijc s SER 267 N -0.96 3.81 0.24 0.53 1.04 -1.26 -4.80 113.70 112.31 3ijc s SER 267 Ca 0.51 2.20 -0.05 0.00 0.48 0.00 0.00 55.95 59.08 3ijc s SER 267 Cb 0.34 -2.57 0.35 0.00 0.10 0.00 0.00 66.02 64.24 3ijc s SER 267 CO 0.22 -2.51 1.83 0.11 0.98 0.00 0.00 173.24 173.87 3ijc h LYS 268 N -0.98 0.83 0.41 4.02 1.57 -1.98 -0.34 116.57 120.09 3ijc h LYS 268 Ca -0.45 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.27 3ijc h LYS 268 Cb 1.27 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 33.37 3ijc h LYS 268 CO 0.47 0.55 -0.45 -0.09 -0.57 0.00 0.00 179.45 179.36 3ijc h ARG 269 N 0.85 -0.85 -0.62 3.15 2.43 -1.97 -0.29 114.38 117.09 3ijc h ARG 269 Ca 0.37 0.06 -0.03 0.00 -0.81 0.00 0.00 59.98 59.57 3ijc h ARG 269 Cb 0.26 0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 29.97 3ijc h ARG 269 CO -0.21 -0.56 0.25 0.52 -1.51 0.00 0.00 179.97 178.46 3ijc h MET 270 N -0.88 0.92 -0.60 0.20 2.86 -1.79 -1.47 114.93 114.18 3ijc h MET 270 Ca -0.04 -0.17 -0.03 0.00 -2.06 0.00 0.00 59.70 57.41 3ijc h MET 270 Cb 0.79 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.27 3ijc h MET 270 CO -0.09 0.78 0.27 0.52 1.06 0.00 0.00 176.91 179.45 3ijc h MET 271 N 0.86 0.86 -0.38 1.72 2.86 -1.00 -0.93 114.93 118.92 3ijc h MET 271 Ca 0.21 -0.12 -0.16 0.00 -2.06 0.00 0.00 59.70 57.57 3ijc h MET 271 Cb 0.20 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 3ijc h MET 271 CO -0.02 0.68 -0.39 -0.97 1.06 0.00 0.00 176.91 177.27 3ijc h ASN 272 N 0.85 0.99 -0.30 1.22 -1.24 -0.84 -1.91 115.58 114.35 3ijc h ASN 272 Ca 0.21 -0.46 -0.12 0.00 0.71 0.00 0.00 56.30 56.64 3ijc h ASN 272 Cb 0.13 -0.28 -0.01 0.00 0.73 0.00 0.00 38.32 38.88 3ijc h ASN 272 CO -0.02 1.25 -0.24 0.00 -1.29 0.00 0.00 177.43 177.13 3ijc h ALA 273 N 0.79 0.85 -0.33 1.57 0.00 -0.81 -0.89 119.26 120.44 3ijc h ALA 273 Ca 0.06 -0.38 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 3ijc h ALA 273 Cb 0.98 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 3ijc h ALA 273 CO 0.10 0.64 0.12 0.82 0.00 0.00 0.00 179.25 180.92 3ijc h ILE 274 N 0.68 1.20 -0.63 0.00 2.04 -1.12 -1.48 117.51 118.20 3ijc h ILE 274 Ca 0.09 -0.62 0.02 0.00 1.00 0.00 0.00 64.86 65.35 3ijc h ILE 274 Cb 0.76 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.78 3ijc h ILE 274 CO 0.06 0.21 0.40 0.50 0.00 0.00 0.00 178.15 179.32 3ijc h LYS 275 N 0.39 0.78 -0.58 2.37 3.64 -1.11 -2.33 116.57 119.71 3ijc h LYS 275 Ca 0.11 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.39 3ijc h LYS 275 Cb 0.22 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 31.83 3ijc h LYS 275 CO -0.01 0.52 0.16 0.93 -2.27 0.00 0.00 179.45 178.78 3ijc h GLU 276 N 0.80 0.90 -0.79 1.90 4.39 -1.03 -2.51 114.58 118.24 3ijc h GLU 276 Ca 0.24 -0.18 0.05 0.00 0.34 0.00 0.00 59.36 59.81 3ijc h GLU 276 Cb -0.04 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 28.43 3ijc h GLU 276 CO -0.08 0.79 0.52 0.66 -1.16 0.00 0.00 179.01 179.74 3ijc h SER 277 N 0.86 0.79 0.82 1.42 4.64 -0.74 -0.88 113.55 120.46 3ijc h SER 277 Ca 0.19 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.42 3ijc h SER 277 Cb 0.29 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.19 3ijc h SER 277 CO -0.00 0.53 -0.44 1.88 -0.87 0.00 0.00 176.83 177.92 3ijc h TYR 278 N 0.91 0.00 -0.01 4.77 -1.99 -1.06 -3.07 116.97 116.52 3ijc h TYR 278 Ca 0.33 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.06 3ijc h TYR 278 Cb 0.15 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.88 3ijc h TYR 278 CO -0.00 0.44 -0.08 -0.25 -0.00 0.00 0.00 178.16 178.27 3ijc n ASP 279 N -3.58 0.73 -4.61 3.88 8.00 -0.40 -4.86 116.55 115.70 3ijc n ASP 279 Ca -0.00 -0.94 -0.40 0.00 0.71 0.00 0.00 54.79 54.15 3ijc n ASP 279 Cb 0.54 -0.01 -0.08 0.00 -0.02 0.00 0.00 41.12 41.55 3ijc n ASP 279 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 3ijc s TYR 280 N -2.26 3.26 -0.23 1.24 5.04 -0.80 -5.03 117.35 118.57 3ijc s TYR 280 Ca 0.34 0.58 -0.02 0.00 -2.44 0.00 0.00 57.07 55.54 3ijc s TYR 280 Cb 0.21 -2.74 0.07 0.00 0.35 0.00 0.00 41.96 39.85 3ijc s TYR 280 CO 0.42 -0.31 0.04 1.21 -1.34 0.00 0.00 175.55 175.57 3ijc s ASN 281 N 1.57 3.40 0.62 4.32 3.84 -1.26 -4.89 114.94 122.54 3ijc s ASN 281 Ca 0.21 -1.12 0.34 0.00 0.21 0.00 0.00 52.86 52.50 3ijc s ASN 281 Cb -0.16 -0.78 1.97 0.00 -0.55 0.00 0.00 41.25 41.73 3ijc s ASN 281 CO 0.10 -0.32 2.25 1.55 -2.79 0.00 0.00 177.10 177.89 3ijc h PRO 282 N 8.15 0.00 0.00 0.43 0.13 -1.92 0.11 132.00 138.90 3ijc h PRO 282 Ca -0.16 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.95 3ijc h PRO 282 Cb 1.08 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.21 3ijc h PRO 282 CO 0.39 0.00 -0.10 -0.91 -0.23 0.00 0.00 178.00 177.14 3ijc h ASN 283 N 0.00 0.00 -0.24 1.44 -0.26 -1.98 -3.25 115.58 111.28 3ijc h ASN 283 Ca 0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 3ijc h ASN 283 Cb 0.11 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.37 3ijc h ASN 283 CO -0.00 0.10 0.00 0.29 -1.06 0.00 0.00 177.43 176.76 3ijc n LYS 284 N -3.27 2.08 -3.92 0.81 4.76 0.02 -5.02 118.16 113.63 3ijc n LYS 284 Ca 0.00 -1.95 -0.09 0.00 -2.87 0.00 0.00 58.31 53.40 3ijc n LYS 284 Cb 0.35 -1.40 -0.07 0.00 -1.84 0.00 0.00 35.03 32.07 3ijc n LYS 284 CO 0.00 0.00 0.00 -0.08 -1.37 0.00 0.00 177.40 175.95 3ijc s THR 285 N -1.36 0.07 -0.22 -0.18 -1.32 -1.21 -5.03 115.64 106.38 3ijc s THR 285 Ca 0.29 -1.29 0.22 0.00 -1.21 0.00 0.00 61.69 59.70 3ijc s THR 285 Cb 0.18 -1.73 -0.24 0.00 -1.51 0.00 0.00 72.50 69.20 3ijc s THR 285 CO 0.25 -0.34 0.68 0.59 -2.21 0.00 0.00 174.62 173.59 3ijc n ASN 286 N -0.20 0.31 -4.81 8.08 4.13 -1.26 -4.88 115.26 116.63 3ijc n ASN 286 Ca -0.09 -0.06 -0.33 0.00 1.68 0.00 0.00 54.58 55.78 3ijc n ASN 286 Cb 0.63 1.50 -0.01 0.00 -1.54 0.00 0.00 39.78 40.35 3ijc n ASN 286 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 3ijc s ARG 287 N -3.41 3.61 0.75 3.52 1.70 -1.26 -5.07 118.95 118.79 3ijc s ARG 287 Ca -0.04 1.20 -0.11 0.00 -0.47 0.00 0.00 55.73 56.31 3ijc s ARG 287 Cb 0.13 -2.07 0.04 0.00 -0.57 0.00 0.00 34.95 32.48 3ijc s ARG 287 CO 0.87 -0.57 1.08 -1.25 -1.08 0.00 0.00 175.30 174.35 3ijc s PRO 288 N -3.80 2.50 -0.05 3.89 0.04 -1.26 -4.94 135.00 131.39 3ijc s PRO 288 Ca 0.64 0.69 -0.25 0.00 0.04 0.00 0.00 61.00 62.11 3ijc s PRO 288 Cb -0.15 -1.96 -0.03 0.00 0.04 0.00 0.00 34.50 32.40 3ijc s PRO 288 CO 0.30 -1.34 0.78 0.12 0.04 0.00 0.00 177.00 176.91 3ijc s PHE 289 N -3.17 3.60 -0.24 0.56 5.36 -1.26 -5.02 117.98 117.82 3ijc s PHE 289 Ca 0.59 1.38 -0.17 0.00 -0.96 0.00 0.00 56.93 57.78 3ijc s PHE 289 Cb -0.14 -2.90 -0.03 0.00 -0.34 0.00 0.00 43.02 39.61 3ijc s PHE 289 CO 0.54 0.06 0.45 0.42 -1.46 0.00 0.00 175.22 175.23 3ijc s ILE 290 N 0.88 5.13 0.47 3.12 1.01 -1.26 -4.97 121.20 125.58 3ijc s ILE 290 Ca 0.42 0.78 -0.20 0.00 0.00 0.00 0.00 60.65 61.64 3ijc s ILE 290 Cb -0.19 -3.77 -0.09 0.00 0.01 0.00 0.00 42.46 38.42 3ijc s ILE 290 CO 0.21 0.16 0.99 -0.44 0.00 0.00 0.00 174.94 175.86 3ijc s SER 291 N 1.36 6.66 0.08 3.58 0.01 -1.26 -4.98 113.70 119.14 3ijc s SER 291 Ca 0.20 1.75 -0.30 0.00 1.31 0.00 0.00 55.95 58.91 3ijc s SER 291 Cb -0.15 -2.54 -0.05 0.00 0.21 0.00 0.00 66.02 63.48 3ijc s SER 291 CO 0.09 -0.56 1.01 -1.10 0.41 0.00 0.00 173.24 173.09 3ijc s GLN 292 N -3.36 4.61 -0.43 12.44 -1.52 -0.59 -4.95 119.66 125.86 3ijc s GLN 292 Ca 0.63 1.52 -0.12 0.00 -1.95 0.00 0.00 55.36 55.43 3ijc s GLN 292 Cb -0.12 -3.38 0.06 0.00 -0.22 0.00 0.00 33.01 29.35 3ijc s GLN 292 CO 0.19 0.06 0.31 0.15 -0.25 0.00 0.00 175.29 175.74 3ijc s LYS 293 N 0.38 2.82 -0.47 2.91 3.01 -1.26 -1.02 119.74 126.12 3ijc s LYS 293 Ca 0.50 -1.31 -0.16 0.00 -1.01 0.00 0.00 55.97 53.99 3ijc s LYS 293 Cb -0.24 -3.93 0.06 0.00 -1.01 0.00 0.00 37.83 32.71 3ijc s LYS 293 CO 0.30 -0.92 0.42 0.42 0.51 0.00 0.00 175.35 176.08 3ijc s ILE 294 N 1.56 5.18 -0.89 2.17 -1.09 -0.16 -4.93 121.20 123.04 3ijc s ILE 294 Ca 0.03 -0.89 0.23 0.00 -2.23 0.00 0.00 60.65 57.80 3ijc s ILE 294 Cb -0.22 -4.12 -0.09 0.00 -1.58 0.00 0.00 42.46 36.45 3ijc s ILE 294 CO 0.05 -0.56 1.18 1.41 -1.23 0.00 0.00 174.94 175.79 3ijc n HIS 295 N 5.35 0.08 -3.85 3.97 8.25 -1.25 -1.31 115.22 126.46 3ijc n HIS 295 Ca -0.11 0.02 -0.28 0.00 -0.26 0.00 0.00 57.72 57.09 3ijc n HIS 295 Cb 0.45 -0.24 -0.16 0.00 1.12 0.00 0.00 29.99 31.15 3ijc n HIS 295 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 3ijc s PHE 296 N -3.05 1.58 0.70 4.41 0.08 -1.26 0.18 117.98 120.61 3ijc s PHE 296 Ca 0.08 -1.09 -0.13 0.00 0.12 0.00 0.00 56.93 55.92 3ijc s PHE 296 Cb 0.16 -1.25 0.02 0.00 -0.57 0.00 0.00 43.02 41.38 3ijc s PHE 296 CO 0.77 -0.63 1.08 -1.25 -0.10 0.00 0.00 175.22 175.10 3ijc s PRO 297 N 1.67 2.71 0.00 0.24 0.04 -1.26 -4.97 135.00 133.43 3ijc s PRO 297 Ca -0.01 1.19 0.29 0.00 0.04 0.00 0.00 61.00 62.51 3ijc s PRO 297 Cb -0.16 -1.95 1.25 0.00 0.04 0.00 0.00 34.50 33.68 3ijc s PRO 297 CO -0.07 -1.30 1.86 -0.25 0.04 0.00 0.00 177.00 177.28 3ijc n ASP 298 N -2.92 1.09 -3.63 6.66 8.00 0.93 -4.82 116.55 121.85 3ijc n ASP 298 Ca 0.09 -1.32 -0.04 0.00 0.71 0.00 0.00 54.79 54.23 3ijc n ASP 298 Cb 0.53 0.00 -0.05 0.00 -0.02 0.00 0.00 41.12 41.58 3ijc n ASP 298 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 3ijc s PHE 299 N -2.04 -0.10 -0.09 1.24 5.36 -1.25 -2.64 117.98 118.47 3ijc s PHE 299 Ca 0.40 0.19 -0.13 0.00 -0.96 0.00 0.00 56.93 56.43 3ijc s PHE 299 Cb 0.21 0.48 0.03 0.00 -0.34 0.00 0.00 43.02 43.40 3ijc s PHE 299 CO 0.36 -0.08 0.32 0.45 -1.46 0.00 0.00 175.22 174.80 3ijc s SER 300 N -0.83 -0.29 -0.02 6.13 0.15 -1.26 -1.28 113.70 116.30 3ijc s SER 300 Ca 0.07 0.46 -0.05 0.00 0.70 0.00 0.00 55.95 57.13 3ijc s SER 300 Cb -0.02 0.55 0.00 0.00 -1.71 0.00 0.00 66.02 64.85 3ijc s SER 300 CO -0.08 -0.23 0.12 0.28 1.20 0.00 0.00 173.24 174.53 3ijc s THR 301 N -0.34 0.06 -0.25 6.45 -1.32 -0.07 -4.96 115.64 115.20 3ijc s THR 301 Ca -0.05 -0.46 0.13 0.00 -1.21 0.00 0.00 61.69 60.11 3ijc s THR 301 Cb -0.03 -0.32 0.31 0.00 -1.51 0.00 0.00 72.50 70.94 3ijc s THR 301 CO 0.02 -0.25 1.22 0.54 -2.21 0.00 0.00 174.62 173.93 3ijc n ARG 302 N 2.05 2.37 -0.59 7.08 1.74 -1.26 -1.17 116.66 126.87 3ijc n ARG 302 Ca -0.19 -2.36 0.09 0.00 -0.77 0.00 0.00 57.85 54.62 3ijc n ARG 302 Cb 0.57 -1.47 0.35 0.00 -1.02 0.00 0.00 32.46 30.89 3ijc n ARG 302 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3ijc n ASP 303 N -0.66 4.68 -0.10 0.55 8.00 -1.26 -4.38 116.55 123.39 3ijc n ASP 303 Ca 0.14 -2.43 -0.15 0.00 0.71 0.00 0.00 54.79 53.05 3ijc n ASP 303 Cb 0.60 -0.57 -0.05 0.00 -0.02 0.00 0.00 41.12 41.09 3ijc n ASP 303 CO 0.00 0.00 0.00 -0.38 -0.39 0.00 0.00 177.20 176.43 3ijc n ILE 304 N 1.10 1.44 -4.23 0.53 2.08 -1.26 -5.05 119.36 113.97 3ijc n ILE 304 Ca 0.25 -0.03 -0.24 0.00 0.56 0.00 0.00 62.75 63.29 3ijc n ILE 304 Cb 0.87 -2.11 -0.08 0.00 -0.75 0.00 0.00 39.64 37.58 3ijc n ILE 304 CO 0.00 0.00 0.00 -1.00 0.56 0.00 0.00 176.55 176.11 3ijc s HIS 305 N -2.68 2.61 -0.30 1.39 3.76 -1.26 -5.05 115.29 113.76 3ijc s HIS 305 Ca -0.30 -0.44 0.15 0.00 -0.15 0.00 0.00 55.06 54.32 3ijc s HIS 305 Cb 0.07 -1.62 0.46 0.00 1.11 0.00 0.00 32.58 32.60 3ijc s HIS 305 CO 0.41 0.39 1.36 0.54 -0.85 0.00 0.00 174.74 176.58 3ijc n ARG 306 N -1.06 2.77 -2.27 1.40 5.12 -1.26 -5.00 116.66 116.35 3ijc n ARG 306 Ca -0.03 -2.65 -0.04 0.00 -1.93 0.00 0.00 57.85 53.20 3ijc n ARG 306 Cb 0.62 -1.69 0.01 0.00 -1.16 0.00 0.00 32.46 30.24 3ijc n ARG 306 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 3ijc n ASN 307 N -0.42 -0.86 -4.51 0.55 2.85 -1.26 -5.08 115.26 106.53 3ijc n ASN 307 Ca 0.19 -1.70 -0.53 0.00 -0.11 0.00 0.00 54.58 52.42 3ijc n ASN 307 Cb 0.77 1.46 -0.06 0.00 1.24 0.00 0.00 39.78 43.20 3ijc n ASN 307 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 3ijc n TYR 308 N -0.23 0.63 -3.61 1.20 4.01 -1.26 -4.30 117.16 113.59 3ijc n TYR 308 Ca -0.03 0.90 -0.40 0.00 -0.16 0.00 0.00 57.90 58.21 3ijc n TYR 308 Cb 0.25 -2.13 -0.11 0.00 -0.31 0.00 0.00 39.34 37.03 3ijc n TYR 308 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 3ijc s VAL 309 N -0.26 4.54 -1.82 -0.72 1.01 0.76 -4.05 120.40 119.86 3ijc s VAL 309 Ca 0.79 -0.80 0.16 0.00 0.00 0.00 0.00 61.98 62.13 3ijc s VAL 309 Cb -1.05 -3.50 0.25 0.00 0.00 0.00 0.00 36.38 32.08 3ijc s VAL 309 CO 0.55 -0.19 1.15 -0.90 0.00 0.00 0.00 175.10 175.71 3ijc n ASP 310 N 4.99 2.73 -3.64 3.32 5.75 -0.64 -2.94 116.55 126.13 3ijc n ASP 310 Ca -0.12 -1.80 -0.09 0.00 -0.01 0.00 0.00 54.79 52.77 3ijc n ASP 310 Cb 0.46 -0.12 -0.07 0.00 -1.03 0.00 0.00 41.12 40.36 3ijc n ASP 310 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ijc s VAL 312 N 0.89 0.08 -0.10 0.00 0.11 -1.26 -1.83 120.40 118.28 3ijc s VAL 312 Ca -0.04 -0.69 -0.14 0.00 -2.93 0.00 0.00 61.98 58.18 3ijc s VAL 312 Cb -0.05 -0.36 0.03 0.00 -1.53 0.00 0.00 36.38 34.48 3ijc s VAL 312 CO -0.09 -0.38 0.36 -0.60 -3.33 0.00 0.00 175.10 171.06 3ijc s ARG 313 N -1.28 0.51 0.31 1.54 6.06 0.18 -4.53 118.95 121.74 3ijc s ARG 313 Ca -0.14 0.31 -0.27 0.00 -2.50 0.00 0.00 55.73 53.14 3ijc s ARG 313 Cb -0.08 0.24 -0.09 0.00 0.06 0.00 0.00 34.95 35.08 3ijc s ARG 313 CO 0.01 -0.09 0.98 -1.58 -2.50 0.00 0.00 175.30 172.12 3ijc s TRP 314 N -0.26 3.67 -0.55 5.12 0.52 -1.26 -0.60 118.94 125.58 3ijc s TRP 314 Ca -0.04 1.78 0.04 0.00 0.02 0.00 0.00 56.10 57.90 3ijc s TRP 314 Cb -0.03 -3.02 0.15 0.00 -1.15 0.00 0.00 33.47 29.41 3ijc s TRP 314 CO 0.02 0.01 0.34 -1.17 0.02 0.00 0.00 176.95 176.17 3ijc s LEU 315 N -1.88 3.80 0.00 2.99 2.96 0.20 -4.84 118.68 121.91 3ijc s LEU 315 Ca 0.49 -3.22 0.00 0.00 -0.22 0.00 0.00 54.13 51.18 3ijc s LEU 315 Cb -0.23 -1.37 0.00 0.00 0.50 0.00 0.00 46.19 45.10 3ijc s LEU 315 CO 0.29 -0.18 0.00 0.61 -1.32 0.00 0.00 176.35 175.74 3ijc n GLY 316 N 2.79 3.59 0.40 7.98 0.00 -1.26 -1.84 105.19 116.85 3ijc n GLY 316 Ca 0.13 -0.07 0.13 0.00 0.00 0.00 0.00 46.02 46.21 3ijc n GLY 316 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3ijc n ASP 317 N 8.62 1.48 -4.95 1.61 8.00 -1.26 -4.76 116.55 125.30 3ijc n ASP 317 Ca 0.00 -1.22 -0.23 0.00 0.71 0.00 0.00 54.79 54.05 3ijc n ASP 317 Cb 0.00 0.18 0.02 0.00 -0.02 0.00 0.00 41.12 41.30 3ijc n ASP 317 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ijc s LEU 318 N -2.37 3.43 -0.05 0.64 1.43 -0.77 -4.86 118.68 116.14 3ijc s LEU 318 Ca 0.26 0.26 0.05 0.00 -1.03 0.00 0.00 54.13 53.67 3ijc s LEU 318 Cb 0.19 -3.12 -0.02 0.00 0.03 0.00 0.00 46.19 43.28 3ijc s LEU 318 CO 0.48 -0.93 -0.21 -0.63 0.23 0.00 0.00 176.35 175.29 3ijc s ILE 319 N -2.71 2.43 -0.18 -0.59 -1.09 0.60 -0.63 121.20 119.02 3ijc s ILE 319 Ca 0.52 -0.94 -0.05 0.00 -2.23 0.00 0.00 60.65 57.95 3ijc s ILE 319 Cb -0.10 -1.91 -0.03 0.00 -1.58 0.00 0.00 42.46 38.84 3ijc s ILE 319 CO 0.39 0.57 -0.00 -0.76 -1.23 0.00 0.00 174.94 173.91 3ijc s LEU 320 N -0.38 3.32 0.06 2.97 1.43 0.23 -1.12 118.68 125.20 3ijc s LEU 320 Ca 0.03 -0.14 -0.05 0.00 -1.03 0.00 0.00 54.13 52.94 3ijc s LEU 320 Cb -0.12 -1.83 -0.02 0.00 0.03 0.00 0.00 46.19 44.25 3ijc s LEU 320 CO 0.02 0.11 0.07 -0.94 0.23 0.00 0.00 176.35 175.84 3ijc s SER 321 N 0.73 0.29 0.06 2.29 1.04 -0.72 -0.65 113.70 116.74 3ijc s SER 321 Ca -0.00 -0.77 0.01 0.00 0.48 0.00 0.00 55.95 55.67 3ijc s SER 321 Cb -0.14 0.25 -0.04 0.00 0.10 0.00 0.00 66.02 66.20 3ijc s SER 321 CO 0.02 -0.62 -0.05 -1.59 0.98 0.00 0.00 173.24 171.98 3ijc s LYS 322 N -3.57 0.64 0.00 4.02 -2.85 -0.76 -0.59 119.74 116.63 3ijc s LYS 322 Ca 0.03 -1.12 0.00 0.00 -1.00 0.00 0.00 55.97 53.89 3ijc s LYS 322 Cb 0.05 -0.03 0.00 0.00 -2.06 0.00 0.00 37.83 35.79 3ijc s LYS 322 CO -0.09 -0.05 0.00 0.45 0.10 0.00 0.00 175.35 175.76 3ijc n SER 323 N 0.44 1.97 -1.76 0.03 2.88 -1.26 -1.61 113.62 114.31 3ijc n SER 323 Ca -0.16 -0.05 -0.11 0.00 -1.33 0.00 0.00 58.87 57.22 3ijc n SER 323 Cb 0.59 0.00 0.17 0.00 -0.75 0.00 0.00 64.21 64.22 3ijc n SER 323 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3ijc n GLU 325 N -0.37 2.62 -3.63 0.00 1.02 -1.26 -4.28 120.64 114.74 3ijc n GLU 325 Ca 0.36 -3.07 -0.21 0.00 -0.02 0.00 0.00 57.16 54.23 3ijc n GLU 325 Cb 1.22 -2.05 0.04 0.00 -0.02 0.00 0.00 31.44 30.63 3ijc n GLU 325 CO 0.00 0.00 0.00 0.09 1.18 0.00 0.00 177.13 178.40 3ijc n ASN 326 N -0.80 -1.72 -3.64 1.62 3.02 -1.26 -5.01 115.26 107.48 3ijc n ASN 326 Ca 0.43 -0.79 -0.10 0.00 -0.03 0.00 0.00 54.58 54.09 3ijc n ASN 326 Cb 1.33 -4.27 -0.07 0.00 -0.61 0.00 0.00 39.78 36.16 3ijc n ASN 326 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3ijc s ALA 327 N -3.60 -1.76 -0.27 5.41 0.00 -1.26 -2.88 121.76 117.41 3ijc s ALA 327 Ca 0.04 2.18 -0.16 0.00 0.00 0.00 0.00 51.96 54.03 3ijc s ALA 327 Cb -0.01 -1.28 -0.03 0.00 0.00 0.00 0.00 23.12 21.79 3ijc s ALA 327 CO 0.80 -0.35 0.40 0.42 0.00 0.00 0.00 175.76 177.03 3ijc s ILE 328 N 1.13 5.15 -0.14 0.00 1.01 -0.42 -4.04 121.20 123.88 3ijc s ILE 328 Ca -0.06 0.64 -0.16 0.00 0.00 0.00 0.00 60.65 61.07 3ijc s ILE 328 Cb -0.05 -3.73 -0.04 0.00 0.01 0.00 0.00 42.46 38.65 3ijc s ILE 328 CO -0.11 0.14 0.37 -0.69 0.00 0.00 0.00 174.94 174.65 3ijc s VAL 329 N 2.11 5.26 -0.26 2.92 1.01 0.25 -0.51 120.40 131.16 3ijc s VAL 329 Ca 0.16 0.72 -0.14 0.00 0.00 0.00 0.00 61.98 62.73 3ijc s VAL 329 Cb -0.16 -3.71 -0.04 0.00 0.00 0.00 0.00 36.38 32.47 3ijc s VAL 329 CO 0.10 0.36 0.32 0.00 0.00 0.00 0.00 175.10 175.87 3ijc s TRP 331 N 1.87 0.49 0.02 0.00 1.48 -0.28 -0.01 118.94 122.50 3ijc s TRP 331 Ca 0.13 -0.82 0.01 0.00 -1.06 0.00 0.00 56.10 54.35 3ijc s TRP 331 Cb -0.16 -0.01 -0.02 0.00 -1.16 0.00 0.00 33.47 32.13 3ijc s TRP 331 CO 0.10 -0.84 -0.04 -1.59 -4.06 0.00 0.00 176.95 170.52 3ijc s LYS 332 N -4.02 0.30 0.60 3.25 -2.85 -0.13 -0.30 119.74 116.60 3ijc s LYS 332 Ca 0.23 -0.50 -0.20 0.00 -1.00 0.00 0.00 55.97 54.50 3ijc s LYS 332 Cb 0.02 -0.03 -0.03 0.00 -2.06 0.00 0.00 37.83 35.73 3ijc s LYS 332 CO 0.06 -0.01 1.29 -2.30 0.10 0.00 0.00 175.35 174.49 3ijc n PRO 333 N 1.93 1.34 0.00 1.78 -0.02 -1.26 -0.66 135.00 138.12 3ijc n PRO 333 Ca -0.21 0.51 0.00 0.00 -2.02 0.00 0.00 63.50 61.78 3ijc n PRO 333 Cb 0.56 -2.51 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 3ijc n PRO 333 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3ijc n GLY 334 N 0.89 -1.59 3.95 -1.23 0.00 0.18 -4.74 105.19 102.65 3ijc n GLY 334 Ca 0.13 -1.31 -0.23 0.00 0.00 0.00 0.00 46.02 44.61 3ijc n GLY 334 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ijc s LYS 335 N 0.00 2.58 0.46 1.61 1.02 -1.26 -2.63 119.74 121.52 3ijc s LYS 335 Ca 0.00 -0.53 0.21 0.00 0.02 0.00 0.00 55.97 55.67 3ijc s LYS 335 Cb 0.00 -2.40 1.21 0.00 -0.52 0.00 0.00 37.83 36.12 3ijc s LYS 335 CO 0.00 -0.77 1.90 1.98 -0.92 0.00 0.00 175.35 177.54 3ijc h MET 336 N -0.06 0.25 -0.10 1.68 1.85 -1.93 -0.65 114.93 115.97 3ijc h MET 336 Ca -0.44 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 58.64 3ijc h MET 336 Cb 1.29 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 33.26 3ijc h MET 336 CO 0.56 0.17 0.00 -0.85 -0.40 0.00 0.00 176.91 176.39 3ijc n GLU 337 N -4.43 2.31 -2.52 0.39 0.00 -1.26 -4.97 120.64 110.16 3ijc n GLU 337 Ca 0.16 -1.98 -0.42 0.00 0.00 0.00 0.00 57.16 54.92 3ijc n GLU 337 Cb 0.69 -1.46 -0.03 0.00 0.00 0.00 0.00 31.44 30.64 3ijc n GLU 337 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 3ijc s ASP 338 N -1.86 7.12 0.20 -1.84 1.01 -0.25 -5.02 116.67 116.04 3ijc s ASP 338 Ca 0.30 1.79 -0.30 0.00 0.71 0.00 0.00 52.55 55.04 3ijc s ASP 338 Cb 0.20 -2.56 -0.09 0.00 1.01 0.00 0.00 42.92 41.48 3ijc s ASP 338 CO 0.30 -0.50 1.31 -0.62 0.21 0.00 0.00 175.17 175.87 3ijc s ASP 339 N 1.28 6.89 0.37 0.27 2.15 -1.26 -4.88 116.67 121.49 3ijc s ASP 339 Ca 0.55 2.41 0.12 0.00 0.43 0.00 0.00 52.55 56.06 3ijc s ASP 339 Cb -0.24 -2.61 0.91 0.00 -0.30 0.00 0.00 42.92 40.68 3ijc s ASP 339 CO 0.23 -0.53 1.86 -0.29 -0.17 0.00 0.00 175.17 176.27 3ijc h ILE 340 N 3.73 0.76 -0.00 4.11 6.09 -1.91 -1.97 117.51 128.32 3ijc h ILE 340 Ca -0.45 -0.20 0.00 0.00 -1.37 0.00 0.00 64.86 62.84 3ijc h ILE 340 Cb 1.21 0.13 0.00 0.00 0.47 0.00 0.00 36.82 38.63 3ijc h ILE 340 CO 0.77 0.11 -0.04 0.47 -3.07 0.00 0.00 178.15 176.39 3ijc n ASP 341 N -4.56 0.17 -0.39 2.19 8.00 -1.26 -2.79 116.55 117.91 3ijc n ASP 341 Ca 0.19 -0.37 0.09 0.00 0.71 0.00 0.00 54.79 55.40 3ijc n ASP 341 Cb 0.56 -0.18 -0.00 0.00 -0.02 0.00 0.00 41.12 41.48 3ijc n ASP 341 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3ijc n LYS 342 N -1.14 1.58 -1.75 -1.24 5.02 -0.75 -4.97 118.16 114.91 3ijc n LYS 342 Ca 0.15 -0.83 -0.42 0.00 -2.02 0.00 0.00 58.31 55.19 3ijc n LYS 342 Cb 0.24 -1.32 -0.03 0.00 -0.02 0.00 0.00 35.03 33.91 3ijc n LYS 342 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 3ijc s ILE 343 N -2.03 2.41 0.24 -0.18 -1.09 -1.12 -5.02 121.20 114.41 3ijc s ILE 343 Ca 0.14 0.09 0.06 0.00 -2.23 0.00 0.00 60.65 58.71 3ijc s ILE 343 Cb 0.14 -3.06 -0.03 0.00 -1.58 0.00 0.00 42.46 37.93 3ijc s ILE 343 CO 0.44 0.00 0.30 -0.54 -1.23 0.00 0.00 174.94 173.92 3ijc s LYS 344 N 2.13 3.27 0.63 2.79 1.02 -1.26 -4.98 119.74 123.34 3ijc s LYS 344 Ca 0.78 -0.85 0.34 0.00 0.02 0.00 0.00 55.97 56.26 3ijc s LYS 344 Cb -0.47 -2.79 1.89 0.00 -0.52 0.00 0.00 37.83 35.95 3ijc s LYS 344 CO 0.34 0.43 2.15 -1.35 -0.92 0.00 0.00 175.35 176.00 3ijc h PRO 345 N 1.35 0.00 -0.00 -1.68 0.11 -1.82 -1.81 132.00 128.15 3ijc h PRO 345 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 3ijc h PRO 345 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 3ijc h PRO 345 CO 0.61 0.00 -0.04 -1.13 -0.21 0.00 0.00 178.00 177.23 3ijc n SER 346 N -3.38 0.47 -4.68 -2.05 3.41 -1.26 -4.58 113.62 101.55 3ijc n SER 346 Ca -0.01 -0.85 -0.50 0.00 -0.26 0.00 0.00 58.87 57.25 3ijc n SER 346 Cb 0.25 -0.05 -0.05 0.00 -0.26 0.00 0.00 64.21 64.10 3ijc n SER 346 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 3ijc n GLU 347 N -0.78 1.90 0.01 4.33 4.07 -0.68 -4.86 120.64 124.62 3ijc n GLU 347 Ca 0.18 0.69 0.11 0.00 -0.06 0.00 0.00 57.16 58.09 3ijc n GLU 347 Cb 0.23 -2.49 -0.04 0.00 -0.06 0.00 0.00 31.44 29.08 3ijc n GLU 347 CO 0.00 0.00 0.00 0.43 -0.06 0.00 0.00 177.13 177.50 3ijc n SER 348 N 5.94 0.64 -4.83 4.31 7.64 -1.26 -4.77 113.62 121.29 3ijc n SER 348 Ca 0.23 -0.46 -0.32 0.00 1.01 0.00 0.00 58.87 59.33 3ijc n SER 348 Cb 0.25 1.03 -0.06 0.00 -1.01 0.00 0.00 64.21 64.42 3ijc n SER 348 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 3ijc s ASN 349 N -3.63 5.89 0.27 6.43 0.02 -1.26 -5.03 114.94 117.63 3ijc s ASN 349 Ca 0.04 0.16 0.06 0.00 -1.02 0.00 0.00 52.86 52.10 3ijc s ASN 349 Cb 0.15 -1.72 -0.06 0.00 0.02 0.00 0.00 41.25 39.64 3ijc s ASN 349 CO 0.84 0.22 -0.06 0.68 0.02 0.00 0.00 177.10 178.80 3ijc s VAL 350 N -1.33 1.58 -0.08 1.60 -7.23 -1.24 0.49 120.40 114.18 3ijc s VAL 350 Ca 0.28 -2.12 0.01 0.00 -1.81 0.00 0.00 61.98 58.33 3ijc s VAL 350 Cb -0.12 -2.41 0.02 0.00 0.56 0.00 0.00 36.38 34.43 3ijc s VAL 350 CO 0.20 -0.32 -0.09 -0.89 -0.31 0.00 0.00 175.10 173.69 3ijc s THR 351 N -3.05 0.97 -0.22 5.32 2.01 0.17 -4.78 115.64 116.05 3ijc s THR 351 Ca 0.29 -0.32 -0.20 0.00 0.31 0.00 0.00 61.69 61.77 3ijc s THR 351 Cb 0.04 -0.96 -0.02 0.00 0.01 0.00 0.00 72.50 71.57 3ijc s THR 351 CO 0.11 0.34 0.61 -0.63 -0.69 0.00 0.00 174.62 174.36 3ijc s ILE 352 N 1.22 5.02 -0.71 1.82 -1.09 -1.26 -0.95 121.20 125.25 3ijc s ILE 352 Ca -0.05 1.12 0.20 0.00 -2.23 0.00 0.00 60.65 59.69 3ijc s ILE 352 Cb -0.14 -3.92 -0.24 0.00 -1.58 0.00 0.00 42.46 36.58 3ijc s ILE 352 CO -0.02 0.08 0.74 0.18 -1.23 0.00 0.00 174.94 174.69 3ijc n LEU 353 N 5.31 0.70 0.00 2.97 4.32 0.98 -4.99 117.00 126.30 3ijc n LEU 353 Ca -0.02 -0.38 0.00 0.00 -0.02 0.00 0.00 56.01 55.60 3ijc n LEU 353 Cb 0.49 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.29 3ijc n LEU 353 CO 0.43 0.17 0.00 0.61 -1.22 0.00 0.00 177.39 177.39 3ijc n GLY 354 N 1.44 1.13 3.18 -0.72 0.00 -1.10 -3.73 105.19 105.39 3ijc n GLY 354 Ca 0.02 -0.87 -0.11 0.00 0.00 0.00 0.00 46.02 45.06 3ijc n GLY 354 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ijc s ARG 355 N -2.00 0.31 -0.43 1.61 3.52 -1.26 -1.30 118.95 119.39 3ijc s ARG 355 Ca 0.00 0.75 -0.11 0.00 -0.13 0.00 0.00 55.73 56.24 3ijc s ARG 355 Cb 0.00 -0.01 0.07 0.00 -1.56 0.00 0.00 34.95 33.46 3ijc s ARG 355 CO 0.00 -0.18 0.30 -0.06 -0.81 0.00 0.00 175.30 174.54 3ijc s PHE 356 N 1.63 3.30 0.43 5.12 0.08 0.33 -4.96 117.98 123.90 3ijc s PHE 356 Ca -0.07 -1.32 -0.08 0.00 0.12 0.00 0.00 56.93 55.58 3ijc s PHE 356 Cb -0.10 -2.99 -0.05 0.00 -0.57 0.00 0.00 43.02 39.31 3ijc s PHE 356 CO -0.11 -0.82 0.76 -0.51 -0.10 0.00 0.00 175.22 174.44 3ijc s ASP 357 N 2.23 6.41 0.06 1.36 1.01 -1.26 -1.31 116.67 125.18 3ijc s ASP 357 Ca 0.03 1.02 -0.02 0.00 0.71 0.00 0.00 52.55 54.29 3ijc s ASP 357 Cb -0.23 -2.28 0.01 0.00 1.01 0.00 0.00 42.92 41.43 3ijc s ASP 357 CO 0.04 -0.46 0.13 0.00 0.21 0.00 0.00 175.17 175.08 3ijc n TYR 358 N -1.68 -1.20 -4.28 4.23 0.18 -1.14 -4.98 117.16 108.30 3ijc n TYR 358 Ca 0.01 -0.30 -0.21 0.00 1.88 0.00 0.00 57.90 59.28 3ijc n TYR 358 Cb 0.54 0.15 -0.12 0.00 -0.38 0.00 0.00 39.34 39.53 3ijc n TYR 358 CO 0.00 0.00 0.00 -1.12 -2.08 0.00 0.00 176.86 173.66 3ijc s SER 359 N -1.33 2.37 -1.14 9.48 0.01 -1.26 -4.79 113.70 117.03 3ijc s SER 359 Ca 0.03 -0.77 -0.04 0.00 1.31 0.00 0.00 55.95 56.48 3ijc s SER 359 Cb -0.01 -0.12 -0.03 0.00 0.21 0.00 0.00 66.02 66.07 3ijc s SER 359 CO 0.02 -0.03 0.93 0.00 0.41 0.00 0.00 173.24 174.56 3ijc n GLN 360 N 0.71 -4.34 -2.99 12.44 6.02 -1.26 -4.76 117.38 123.20 3ijc n GLN 360 Ca -0.17 0.82 -0.15 0.00 -0.01 0.00 0.00 57.00 57.49 3ijc n GLN 360 Cb 0.56 -5.70 0.01 0.00 1.02 0.00 0.00 30.24 26.13 3ijc n GLN 360 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3ijc n ASP 362 N 0.57 2.09 -4.87 0.00 5.68 -1.26 -4.09 116.55 114.66 3ijc n ASP 362 Ca 0.17 -1.72 -0.30 0.00 -0.50 0.00 0.00 54.79 52.43 3ijc n ASP 362 Cb 0.66 -0.07 -0.02 0.00 -1.14 0.00 0.00 41.12 40.54 3ijc n ASP 362 CO 0.00 0.00 0.00 0.27 -1.33 0.00 0.00 177.20 176.14 3ijc s ILE 363 N -0.80 4.74 0.38 2.12 -4.36 -1.26 -4.85 121.20 117.16 3ijc s ILE 363 Ca 0.09 0.71 0.04 0.00 -0.26 0.00 0.00 60.65 61.24 3ijc s ILE 363 Cb 0.05 -3.78 -0.01 0.00 1.25 0.00 0.00 42.46 39.98 3ijc s ILE 363 CO 0.07 -0.73 0.55 -1.66 0.24 0.00 0.00 174.94 173.41 3ijc s TRP 364 N -2.63 3.16 -0.71 1.37 1.48 -1.26 -4.57 118.94 115.77 3ijc s TRP 364 Ca 0.53 -0.05 -0.03 0.00 -1.06 0.00 0.00 56.10 55.49 3ijc s TRP 364 Cb -0.10 -2.11 -0.04 0.00 -1.16 0.00 0.00 33.47 30.05 3ijc s TRP 364 CO 0.38 -0.14 0.63 0.98 -4.06 0.00 0.00 176.95 174.74 3ijc n TYR 365 N -1.81 -1.88 -3.88 1.66 9.36 -1.26 -5.06 117.16 114.29 3ijc n TYR 365 Ca 0.00 0.67 -0.30 0.00 3.32 0.00 0.00 57.90 61.60 3ijc n TYR 365 Cb 0.58 -3.62 -0.16 0.00 -0.63 0.00 0.00 39.34 35.51 3ijc n TYR 365 CO 0.00 0.00 0.00 -1.64 0.22 0.00 0.00 176.86 175.44 3ijc s MET 366 N -3.78 1.33 -0.15 2.98 -1.94 -1.26 -4.89 119.30 111.60 3ijc s MET 366 Ca 0.26 -0.89 -0.05 0.00 -1.71 0.00 0.00 55.69 53.30 3ijc s MET 366 Cb -0.03 -2.46 -0.03 0.00 2.01 0.00 0.00 34.83 34.31 3ijc s MET 366 CO 0.54 -0.64 0.01 1.03 -0.01 0.00 0.00 175.02 175.95 3ijc s ARG 367 N 1.50 3.66 0.57 2.03 0.52 -0.59 -4.79 118.95 121.86 3ijc s ARG 367 Ca -0.03 -0.42 -0.06 0.00 -0.52 0.00 0.00 55.73 54.70 3ijc s ARG 367 Cb -0.18 -3.02 -0.00 0.00 0.52 0.00 0.00 34.95 32.27 3ijc s ARG 367 CO -0.08 0.36 0.88 -0.59 0.02 0.00 0.00 175.30 175.90 3ijc s PHE 368 N 0.08 3.34 0.09 -0.53 -0.12 -1.26 -4.32 117.98 115.27 3ijc s PHE 368 Ca 0.02 0.71 -0.01 0.00 -0.05 0.00 0.00 56.93 57.61 3ijc s PHE 368 Cb -0.13 -2.65 -0.04 0.00 -0.63 0.00 0.00 43.02 39.57 3ijc s PHE 368 CO 0.02 -0.71 0.02 -1.54 -0.05 0.00 0.00 175.22 172.96 3ijc s SER 369 N -4.26 0.39 0.28 1.98 1.04 -0.14 -4.92 113.70 108.07 3ijc s SER 369 Ca 0.53 -1.11 0.12 0.00 0.48 0.00 0.00 55.95 55.96 3ijc s SER 369 Cb -0.10 0.25 -0.05 0.00 0.10 0.00 0.00 66.02 66.22 3ijc s SER 369 CO 0.46 -0.67 -0.17 0.42 0.98 0.00 0.00 173.24 174.26 3ijc s THR 370 N -3.99 2.61 1.13 2.02 -4.23 -1.26 -0.89 115.64 111.04 3ijc s THR 370 Ca 0.16 -2.33 -0.17 0.00 -1.18 0.00 0.00 61.69 58.17 3ijc s THR 370 Cb 0.08 -2.39 0.25 0.00 1.34 0.00 0.00 72.50 71.78 3ijc s THR 370 CO -0.03 -0.39 1.13 1.51 -0.54 0.00 0.00 174.62 176.29 3ijc s ASP 371 N -3.54 1.53 0.21 3.99 -4.77 -0.97 -4.72 116.67 108.40 3ijc s ASP 371 Ca 0.30 0.72 -0.10 0.00 -3.30 0.00 0.00 52.55 50.17 3ijc s ASP 371 Cb -0.05 -1.04 0.22 0.00 -1.09 0.00 0.00 42.92 40.96 3ijc s ASP 371 CO 0.16 -3.76 1.82 0.15 0.70 0.00 0.00 175.17 174.24 3ijc h PHE 372 N -2.33 0.74 -0.00 2.11 3.57 -1.85 -2.64 116.94 116.54 3ijc h PHE 372 Ca -0.47 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.05 3ijc h PHE 372 Cb 1.30 -0.23 0.00 0.00 2.79 0.00 0.00 35.95 39.81 3ijc h PHE 372 CO -1.47 0.38 -0.22 0.91 -2.23 0.00 0.00 178.31 175.68 3ijc n TRP 373 N -4.74 0.00 -3.08 0.41 7.02 -1.26 -4.93 117.44 110.86 3ijc n TRP 373 Ca 0.08 0.00 -0.23 0.00 -1.02 0.00 0.00 57.50 56.34 3ijc n TRP 373 Cb 0.14 -0.35 0.04 0.00 -2.42 0.00 0.00 31.31 28.72 3ijc n TRP 373 CO 0.00 0.00 0.00 1.04 -2.02 0.00 0.00 177.69 176.71 3ijc n GLN 374 N -1.41 -5.28 0.13 -0.99 6.02 -1.00 -4.92 117.38 109.94 3ijc n GLN 374 Ca 0.08 0.90 0.03 0.00 -0.01 0.00 0.00 57.00 58.00 3ijc n GLN 374 Cb 0.33 -5.78 0.02 0.00 1.02 0.00 0.00 30.24 25.83 3ijc n GLN 374 CO 0.00 0.00 0.00 0.87 -1.01 0.00 0.00 177.06 176.92 3ijc h LYS 375 N -1.55 0.00 -4.23 -1.09 1.57 -1.92 -3.45 116.57 105.90 3ijc h LYS 375 Ca -0.54 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.05 3ijc h LYS 375 Cb 1.37 0.00 -0.20 0.00 0.08 0.00 0.00 32.23 33.48 3ijc h LYS 375 CO 0.57 0.39 -0.71 0.00 -0.57 0.00 0.00 179.45 179.13 3ijc s MET 376 N -3.00 0.46 -0.08 3.15 0.23 -1.26 -0.10 119.30 118.70 3ijc s MET 376 Ca 0.03 -0.81 0.01 0.00 -1.03 0.00 0.00 55.69 53.89 3ijc s MET 376 Cb 0.08 -0.01 0.02 0.00 -1.53 0.00 0.00 34.83 33.39 3ijc s MET 376 CO 0.75 -0.03 -0.09 -1.17 -2.03 0.00 0.00 175.02 172.45 3ijc s LEU 377 N -1.86 1.41 -0.06 0.18 2.96 -0.41 -2.30 118.68 118.60 3ijc s LEU 377 Ca -0.08 -0.27 0.03 0.00 -0.22 0.00 0.00 54.13 53.59 3ijc s LEU 377 Cb -0.06 -0.76 0.00 0.00 0.50 0.00 0.00 46.19 45.87 3ijc s LEU 377 CO -0.02 -0.04 -0.16 0.00 -1.32 0.00 0.00 176.35 174.81 3ijc s ALA 378 N 1.10 1.49 -0.02 5.97 0.00 -0.07 0.49 121.76 130.71 3ijc s ALA 378 Ca -0.07 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.28 3ijc s ALA 378 Cb -0.14 -0.56 0.03 0.00 0.00 0.00 0.00 23.12 22.45 3ijc s ALA 378 CO -0.01 0.22 0.02 -1.17 0.00 0.00 0.00 175.76 174.82 3ijc s LEU 379 N 0.29 1.16 0.31 0.00 2.96 -0.20 -0.96 118.68 122.25 3ijc s LEU 379 Ca -0.09 0.02 -0.11 0.00 -0.22 0.00 0.00 54.13 53.73 3ijc s LEU 379 Cb -0.14 -0.11 -0.07 0.00 0.50 0.00 0.00 46.19 46.38 3ijc s LEU 379 CO 0.03 -0.11 0.67 -0.83 -1.32 0.00 0.00 176.35 174.79 3ijc s GLY 380 N 0.99 2.15 0.54 7.98 0.00 -1.26 -0.69 107.32 117.03 3ijc s GLY 380 Ca -0.09 -0.20 0.06 0.00 0.00 0.00 0.00 44.72 44.50 3ijc s GLY 380 CO -0.02 -0.03 0.46 0.54 0.00 0.00 0.00 173.10 174.04 3ijc s ASN 381 N -2.65 4.70 0.00 1.64 2.20 -0.48 -4.76 114.94 115.59 3ijc s ASN 381 Ca 0.50 -1.18 0.18 0.00 -0.94 0.00 0.00 52.86 51.42 3ijc s ASN 381 Cb -0.11 0.37 0.95 0.00 -2.00 0.00 0.00 41.25 40.46 3ijc s ASN 381 CO 0.24 -1.12 1.52 0.00 -2.94 0.00 0.00 177.10 174.79 3ijc n GLN 382 N -1.82 0.34 -0.23 3.55 10.64 0.15 -1.46 117.38 128.54 3ijc n GLN 382 Ca 0.01 0.09 0.09 0.00 -1.83 0.00 0.00 57.00 55.35 3ijc n GLN 382 Cb 0.64 -1.50 0.15 0.00 -0.86 0.00 0.00 30.24 28.67 3ijc n GLN 382 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.06 176.56 3ijc n VAL 383 N -1.20 1.84 -1.00 -0.39 0.24 -1.26 -2.65 118.33 113.91 3ijc n VAL 383 Ca 0.10 -2.37 -0.00 0.00 -2.04 0.00 0.00 64.34 60.03 3ijc n VAL 383 Cb 0.12 -0.19 -0.00 0.00 -1.47 0.00 0.00 33.84 32.30 3ijc n VAL 383 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3ijc n GLY 384 N -1.27 0.43 3.77 7.63 0.00 -1.00 -4.30 105.19 110.45 3ijc n GLY 384 Ca 0.16 -0.65 -0.38 0.00 0.00 0.00 0.00 46.02 45.14 3ijc n GLY 384 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3ijc s LYS 385 N -1.19 4.25 -0.09 1.61 2.20 -1.26 -4.64 119.74 120.62 3ijc s LYS 385 Ca 0.00 0.64 -0.02 0.00 -0.36 0.00 0.00 55.97 56.23 3ijc s LYS 385 Cb 0.00 -3.33 -0.03 0.00 -1.51 0.00 0.00 37.83 32.96 3ijc s LYS 385 CO 0.00 0.41 0.01 -0.51 -0.36 0.00 0.00 175.35 174.90 3ijc s LEU 386 N -0.28 3.63 -0.14 5.43 1.43 -0.09 -1.38 118.68 127.28 3ijc s LEU 386 Ca 0.29 0.16 0.01 0.00 -1.03 0.00 0.00 54.13 53.55 3ijc s LEU 386 Cb -0.18 -1.84 -0.00 0.00 0.03 0.00 0.00 46.19 44.20 3ijc s LEU 386 CO 0.16 0.37 -0.17 -0.31 0.23 0.00 0.00 176.35 176.63 3ijc s TYR 387 N -0.81 2.74 -0.16 0.29 2.02 0.13 -0.74 117.35 120.82 3ijc s TYR 387 Ca 0.12 -0.98 0.01 0.00 -0.37 0.00 0.00 57.07 55.86 3ijc s TYR 387 Cb -0.11 -1.85 0.02 0.00 -0.40 0.00 0.00 41.96 39.62 3ijc s TYR 387 CO 0.02 -0.42 -0.19 0.08 -1.57 0.00 0.00 175.55 173.48 3ijc s VAL 388 N 0.64 1.93 -0.15 0.71 1.01 0.70 -1.03 120.40 124.22 3ijc s VAL 388 Ca -0.09 -0.87 -0.05 0.00 0.00 0.00 0.00 61.98 60.97 3ijc s VAL 388 Cb -0.16 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 3ijc s VAL 388 CO 0.02 0.52 0.03 0.26 0.00 0.00 0.00 175.10 175.94 3ijc s TRP 389 N 1.22 3.21 -0.45 5.22 0.51 0.18 -0.33 118.94 128.50 3ijc s TRP 389 Ca 0.02 0.05 -0.25 0.00 -2.12 0.00 0.00 56.10 53.80 3ijc s TRP 389 Cb -0.14 -1.99 0.03 0.00 -0.81 0.00 0.00 33.47 30.56 3ijc s TRP 389 CO -0.10 0.22 0.89 0.34 -0.51 0.00 0.00 176.95 177.78 3ijc s ASP 390 N 0.02 6.49 0.00 2.95 2.15 0.88 -1.29 116.67 127.87 3ijc s ASP 390 Ca 0.04 0.10 0.27 0.00 0.43 0.00 0.00 52.55 53.40 3ijc s ASP 390 Cb -0.12 -2.43 0.86 0.00 -0.30 0.00 0.00 42.92 40.92 3ijc s ASP 390 CO 0.01 -0.99 1.63 0.18 -0.17 0.00 0.00 175.17 175.84 3ijc n LEU 391 N 7.00 1.67 -3.90 -1.34 4.77 0.85 -2.20 117.00 123.85 3ijc n LEU 391 Ca 0.05 -0.55 -0.42 0.00 -0.03 0.00 0.00 56.01 55.06 3ijc n LEU 391 Cb 0.48 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.56 3ijc n LEU 391 CO 0.62 0.28 2.26 1.21 -1.33 0.00 0.00 177.39 180.43 3ijc n GLU 392 N 0.24 3.22 -4.05 3.23 4.07 -1.25 -4.83 120.64 121.27 3ijc n GLU 392 Ca 0.17 -3.10 -0.10 0.00 -0.06 0.00 0.00 57.16 54.07 3ijc n GLU 392 Cb 0.39 -3.15 -0.07 0.00 -0.06 0.00 0.00 31.44 28.56 3ijc n GLU 392 CO 0.00 0.00 0.00 0.14 -0.06 0.00 0.00 177.13 177.21 3ijc s VAL 393 N 2.06 0.02 0.03 6.31 -7.23 -1.26 -5.07 120.40 115.25 3ijc s VAL 393 Ca 0.44 -1.59 0.16 0.00 -1.81 0.00 0.00 61.98 59.19 3ijc s VAL 393 Cb 0.10 -2.21 0.08 0.00 0.56 0.00 0.00 36.38 34.91 3ijc s VAL 393 CO -0.03 -0.07 1.58 -0.33 -0.31 0.00 0.00 175.10 175.94 3ijc h GLU 394 N 2.43 0.00 -3.85 4.82 5.08 -1.94 -3.45 114.58 117.67 3ijc h GLU 394 Ca -0.30 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 57.89 3ijc h GLU 394 Cb 1.24 0.00 -0.22 0.00 0.50 0.00 0.00 28.75 30.28 3ijc h GLU 394 CO 0.44 0.47 -0.66 -0.51 -1.00 0.00 0.00 179.01 177.75 3ijc s ASP 395 N -6.46 0.17 0.25 1.42 1.01 -1.26 -5.07 116.67 106.72 3ijc s ASP 395 Ca 0.02 -0.38 -0.04 0.00 0.71 0.00 0.00 52.55 52.86 3ijc s ASP 395 Cb 0.09 0.12 0.44 0.00 1.01 0.00 0.00 42.92 44.58 3ijc s ASP 395 CO 0.72 -0.28 1.77 -0.65 0.21 0.00 0.00 175.17 176.94 3ijc h PRO 396 N 4.76 0.59 0.00 8.23 0.11 -1.87 -2.23 132.00 141.59 3ijc h PRO 396 Ca -0.31 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.77 3ijc h PRO 396 Cb 1.21 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.18 3ijc h PRO 396 CO 0.42 0.39 0.00 -2.39 -0.21 0.00 0.00 178.00 176.21 3ijc n HIS 397 N -4.87 0.63 1.35 0.65 1.44 -1.24 -2.10 115.22 111.08 3ijc n HIS 397 Ca 0.14 0.30 0.12 0.00 -2.01 0.00 0.00 57.72 56.28 3ijc n HIS 397 Cb 0.36 -0.98 0.45 0.00 0.12 0.00 0.00 29.99 29.94 3ijc n HIS 397 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 3ijc n LYS 398 N -2.12 1.72 -1.56 -1.40 5.02 -0.84 -4.96 118.16 114.02 3ijc n LYS 398 Ca 0.00 -1.07 -0.45 0.00 -2.02 0.00 0.00 58.31 54.77 3ijc n LYS 398 Cb 0.09 -1.45 -0.02 0.00 -0.02 0.00 0.00 35.03 33.64 3ijc n LYS 398 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ijc n ALA 399 N 0.29 -0.59 -2.97 7.82 0.00 -0.89 -4.95 120.51 119.22 3ijc n ALA 399 Ca 0.18 0.40 -0.36 0.00 0.00 0.00 0.00 53.44 53.65 3ijc n ALA 399 Cb 0.35 -1.97 -0.12 0.00 0.00 0.00 0.00 19.45 17.72 3ijc n ALA 399 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 3ijc s LYS 400 N -1.44 3.73 -0.09 0.00 1.02 -0.94 -4.88 119.74 117.14 3ijc s LYS 400 Ca 0.60 -0.44 -0.17 0.00 0.02 0.00 0.00 55.97 55.97 3ijc s LYS 400 Cb -0.74 -3.35 -0.05 0.00 -0.52 0.00 0.00 37.83 33.18 3ijc s LYS 400 CO 0.59 -0.13 0.46 0.00 -0.92 0.00 0.00 175.35 175.36 3ijc s THR 402 N 0.28 2.35 0.03 0.00 -1.32 0.55 -4.99 115.64 112.54 3ijc s THR 402 Ca 0.25 -1.29 0.06 0.00 -1.21 0.00 0.00 61.69 59.50 3ijc s THR 402 Cb -0.15 -1.93 -0.03 0.00 -1.51 0.00 0.00 72.50 68.87 3ijc s THR 402 CO 0.11 0.38 -0.14 0.42 -2.21 0.00 0.00 174.62 173.17 3ijc s THR 403 N -0.83 3.07 -0.15 5.08 -4.23 -1.26 -0.21 115.64 117.11 3ijc s THR 403 Ca 0.12 -1.06 0.00 0.00 -1.18 0.00 0.00 61.69 59.57 3ijc s THR 403 Cb -0.10 -2.31 0.03 0.00 1.34 0.00 0.00 72.50 71.46 3ijc s THR 403 CO 0.03 0.35 -0.11 -0.76 -0.54 0.00 0.00 174.62 173.59 3ijc s LEU 404 N -1.46 1.61 0.06 4.79 1.43 0.08 -5.00 118.68 120.19 3ijc s LEU 404 Ca 0.16 -0.51 0.05 0.00 -1.03 0.00 0.00 54.13 52.80 3ijc s LEU 404 Cb -0.11 -1.05 -0.03 0.00 0.03 0.00 0.00 46.19 45.03 3ijc s LEU 404 CO 0.06 -0.10 -0.14 0.42 0.23 0.00 0.00 176.35 176.82 3ijc s THR 405 N 1.56 1.12 -0.02 5.49 -4.23 -1.26 -0.92 115.64 117.38 3ijc s THR 405 Ca 0.04 -1.15 0.02 0.00 -1.18 0.00 0.00 61.69 59.41 3ijc s THR 405 Cb -0.13 -1.05 0.01 0.00 1.34 0.00 0.00 72.50 72.67 3ijc s THR 405 CO -0.09 -0.10 -0.06 -2.28 -0.54 0.00 0.00 174.62 171.54 3ijc s HIS 406 N -1.05 0.70 0.61 3.99 2.46 -1.26 -5.01 115.29 115.73 3ijc s HIS 406 Ca -0.00 -0.16 0.34 0.00 0.47 0.00 0.00 55.06 55.70 3ijc s HIS 406 Cb -0.09 -0.54 1.97 0.00 -0.13 0.00 0.00 32.58 33.79 3ijc s HIS 406 CO 0.02 -0.10 2.26 1.12 -2.47 0.00 0.00 174.74 175.57 3ijc h HIS 407 N 6.57 0.00 -0.01 3.88 2.07 -2.01 -0.85 115.15 124.79 3ijc h HIS 407 Ca -0.34 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.18 3ijc h HIS 407 Cb 1.17 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.15 3ijc h HIS 407 CO 0.45 0.00 -0.42 1.63 -3.07 0.00 0.00 177.93 176.52 3ijc n LYS 408 N -3.60 1.17 -3.23 5.12 5.02 -1.26 -4.76 118.16 116.63 3ijc n LYS 408 Ca -0.02 -0.93 -0.46 0.00 -2.02 0.00 0.00 58.31 54.88 3ijc n LYS 408 Cb 0.12 -1.48 -0.03 0.00 -0.02 0.00 0.00 35.03 33.62 3ijc n LYS 408 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3ijc n GLY 410 N 4.72 -0.21 3.92 0.00 0.00 -1.26 -4.32 105.19 108.04 3ijc n GLY 410 Ca 0.04 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.80 3ijc n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ijc s ALA 411 N -0.34 3.54 0.23 4.61 0.00 -1.26 -4.11 121.76 124.43 3ijc s ALA 411 Ca 0.00 -0.64 -0.32 0.00 0.00 0.00 0.00 51.96 51.00 3ijc s ALA 411 Cb 0.00 -2.38 -0.12 0.00 0.00 0.00 0.00 23.12 20.61 3ijc s ALA 411 CO 0.00 -0.13 1.64 0.00 0.00 0.00 0.00 175.76 177.27 3ijc n ALA 412 N -1.86 2.40 -2.64 0.00 0.00 -1.08 -2.37 120.51 114.96 3ijc n ALA 412 Ca -0.02 0.40 -0.41 0.00 0.00 0.00 0.00 53.44 53.42 3ijc n ALA 412 Cb 0.55 -2.46 -0.06 0.00 0.00 0.00 0.00 19.45 17.48 3ijc n ALA 412 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3ijc s ILE 413 N 0.71 4.97 -0.11 0.00 1.01 -0.54 -0.71 121.20 126.54 3ijc s ILE 413 Ca 0.72 1.22 -0.01 0.00 0.00 0.00 0.00 60.65 62.59 3ijc s ILE 413 Cb -0.54 -3.97 -0.25 0.00 0.01 0.00 0.00 42.46 37.71 3ijc s ILE 413 CO 0.39 0.04 0.40 0.54 0.00 0.00 0.00 174.94 176.31 3ijc n ARG 414 N 5.51 0.72 -3.70 2.79 5.12 -0.06 -4.44 116.66 122.60 3ijc n ARG 414 Ca 0.00 0.26 -0.10 0.00 -1.93 0.00 0.00 57.85 56.08 3ijc n ARG 414 Cb 0.49 -1.71 -0.05 0.00 -1.16 0.00 0.00 32.46 30.02 3ijc n ARG 414 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 3ijc s GLN 415 N -2.56 1.00 0.12 5.56 0.74 -1.25 -1.54 119.66 121.74 3ijc s GLN 415 Ca -0.18 -0.79 0.05 0.00 0.05 0.00 0.00 55.36 54.49 3ijc s GLN 415 Cb 0.07 0.43 -0.04 0.00 1.10 0.00 0.00 33.01 34.57 3ijc s GLN 415 CO 0.77 -0.37 -0.12 0.95 -0.55 0.00 0.00 175.29 175.97 3ijc s THR 416 N -3.82 1.18 -0.09 -0.34 -4.23 -1.26 -2.27 115.64 104.81 3ijc s THR 416 Ca 0.04 -1.80 -0.07 0.00 -1.18 0.00 0.00 61.69 58.67 3ijc s THR 416 Cb 0.03 -1.58 0.03 0.00 1.34 0.00 0.00 72.50 72.32 3ijc s THR 416 CO -0.12 -0.56 0.23 -0.55 -0.54 0.00 0.00 174.62 173.09 3ijc s SER 417 N -2.67 -0.24 -0.02 3.99 0.15 -0.02 -4.65 113.70 110.24 3ijc s SER 417 Ca 0.10 0.47 -0.14 0.00 0.70 0.00 0.00 55.95 57.09 3ijc s SER 417 Cb -0.02 0.44 -0.05 0.00 -1.71 0.00 0.00 66.02 64.68 3ijc s SER 417 CO 0.02 -0.11 0.38 -0.36 1.20 0.00 0.00 173.24 174.37 3ijc s PHE 418 N 0.47 3.71 0.90 3.44 0.08 -1.26 -1.50 117.98 123.81 3ijc s PHE 418 Ca -0.03 0.94 -0.11 0.00 0.12 0.00 0.00 56.93 57.85 3ijc s PHE 418 Cb -0.04 -2.25 0.13 0.00 -0.57 0.00 0.00 43.02 40.29 3ijc s PHE 418 CO -0.02 0.65 1.12 -1.13 -0.10 0.00 0.00 175.22 175.74 3ijc n SER 419 N 1.86 0.37 0.15 1.36 3.41 -0.48 -4.62 113.62 115.69 3ijc n SER 419 Ca -0.15 0.45 0.11 0.00 -0.26 0.00 0.00 58.87 59.02 3ijc n SER 419 Cb 0.53 -1.47 0.62 0.00 -0.26 0.00 0.00 64.21 63.62 3ijc n SER 419 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 3ijc h ARG 420 N -1.66 0.08 -0.21 4.33 2.43 -1.87 -1.91 114.38 115.57 3ijc h ARG 420 Ca -0.44 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.73 3ijc h ARG 420 Cb 1.28 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.81 3ijc h ARG 420 CO 0.42 0.05 0.00 -0.40 -1.51 0.00 0.00 179.97 178.53 3ijc n ASP 421 N -4.49 1.98 -0.96 -3.80 5.68 -1.26 -4.74 116.55 108.96 3ijc n ASP 421 Ca 0.01 -1.77 -0.12 0.00 -0.50 0.00 0.00 54.79 52.41 3ijc n ASP 421 Cb 0.22 -0.13 -0.05 0.00 -1.14 0.00 0.00 41.12 40.01 3ijc n ASP 421 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 3ijc n SER 422 N 0.53 -5.15 0.03 -1.12 7.64 -0.72 -4.90 113.62 109.93 3ijc n SER 422 Ca 0.16 0.31 0.11 0.00 1.01 0.00 0.00 58.87 60.47 3ijc n SER 422 Cb 0.38 -3.75 0.05 0.00 -1.01 0.00 0.00 64.21 59.87 3ijc n SER 422 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 3ijc n SER 423 N -0.76 0.63 -3.99 6.43 3.41 -1.26 -4.83 113.62 113.24 3ijc n SER 423 Ca -0.12 -0.13 -0.19 0.00 -0.26 0.00 0.00 58.87 58.16 3ijc n SER 423 Cb 0.52 0.69 -0.15 0.00 -0.26 0.00 0.00 64.21 65.00 3ijc n SER 423 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3ijc s ILE 424 N -3.20 0.66 -0.16 -1.33 1.01 -1.26 -0.53 121.20 116.39 3ijc s ILE 424 Ca 0.04 -0.32 0.01 0.00 0.00 0.00 0.00 60.65 60.38 3ijc s ILE 424 Cb 0.14 -0.58 0.02 0.00 0.01 0.00 0.00 42.46 42.05 3ijc s ILE 424 CO 0.79 0.20 -0.20 -0.22 0.00 0.00 0.00 174.94 175.51 3ijc s LEU 425 N 0.06 2.05 -0.16 2.97 2.96 0.79 -1.38 118.68 125.98 3ijc s LEU 425 Ca -0.01 -0.61 -0.06 0.00 -0.22 0.00 0.00 54.13 53.23 3ijc s LEU 425 Cb -0.06 -1.42 -0.04 0.00 0.50 0.00 0.00 46.19 45.17 3ijc s LEU 425 CO -0.00 0.01 0.04 -0.63 -1.32 0.00 0.00 176.35 174.45 3ijc s ILE 426 N 1.18 4.60 -0.05 6.68 -1.09 -0.57 -0.63 121.20 131.33 3ijc s ILE 426 Ca 0.01 -0.11 0.06 0.00 -2.23 0.00 0.00 60.65 58.38 3ijc s ILE 426 Cb -0.14 -3.04 -0.02 0.00 -1.58 0.00 0.00 42.46 37.69 3ijc s ILE 426 CO -0.09 0.50 -0.23 0.00 -1.23 0.00 0.00 174.94 173.88 3ijc s ALA 427 N 0.10 2.27 0.16 9.38 0.00 -0.62 -0.84 121.76 132.21 3ijc s ALA 427 Ca 0.04 -1.05 0.10 0.00 0.00 0.00 0.00 51.96 51.06 3ijc s ALA 427 Cb -0.12 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.23 3ijc s ALA 427 CO 0.01 0.45 -0.23 0.14 0.00 0.00 0.00 175.76 176.13 3ijc s VAL 428 N -0.32 2.15 0.17 0.00 -7.23 -0.96 -0.49 120.40 113.72 3ijc s VAL 428 Ca 0.01 -1.90 0.03 0.00 -1.81 0.00 0.00 61.98 58.32 3ijc s VAL 428 Cb -0.13 -1.98 -0.05 0.00 0.56 0.00 0.00 36.38 34.79 3ijc s VAL 428 CO 0.02 -0.11 -0.05 0.00 -0.31 0.00 0.00 175.10 174.66 3ijc h ASP 430 N 2.70 0.00 -0.51 0.00 5.19 -1.15 -1.80 116.42 120.85 3ijc h ASP 430 Ca -0.37 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.04 3ijc h ASP 430 Cb 1.20 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.71 3ijc h ASP 430 CO 0.64 0.02 0.00 -0.90 -3.12 0.00 0.00 179.24 175.88 3ijc n ASP 431 N -3.28 4.10 -0.45 6.45 5.75 -1.26 -3.07 116.55 124.79 3ijc n ASP 431 Ca -0.02 -2.43 -0.06 0.00 -0.01 0.00 0.00 54.79 52.26 3ijc n ASP 431 Cb 0.14 -0.54 -0.03 0.00 -1.03 0.00 0.00 41.12 39.66 3ijc n ASP 431 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ijc n ALA 432 N 0.80 -0.09 -2.49 2.12 0.00 -0.78 -4.79 120.51 115.28 3ijc n ALA 432 Ca 0.21 0.10 -0.33 0.00 0.00 0.00 0.00 53.44 53.41 3ijc n ALA 432 Cb 0.80 -0.99 -0.05 0.00 0.00 0.00 0.00 19.45 19.21 3ijc n ALA 432 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 3ijc s SER 433 N -2.61 6.65 -0.06 0.00 1.04 -1.25 -0.59 113.70 116.89 3ijc s SER 433 Ca 0.00 0.86 0.05 0.00 0.48 0.00 0.00 55.95 57.35 3ijc s SER 433 Cb 0.00 -2.20 -0.02 0.00 0.10 0.00 0.00 66.02 63.90 3ijc s SER 433 CO 0.00 0.05 -0.22 -0.63 0.98 0.00 0.00 173.24 173.42 3ijc s ILE 434 N -1.60 2.31 -0.11 -1.02 1.01 0.19 -1.46 121.20 120.51 3ijc s ILE 434 Ca 0.40 -0.98 0.02 0.00 0.00 0.00 0.00 60.65 60.09 3ijc s ILE 434 Cb -0.13 -1.85 0.01 0.00 0.01 0.00 0.00 42.46 40.50 3ijc s ILE 434 CO 0.20 0.57 -0.17 0.26 0.00 0.00 0.00 174.94 175.80 3ijc s TRP 435 N -0.29 2.13 -0.20 3.97 0.52 0.36 -0.72 118.94 124.70 3ijc s TRP 435 Ca 0.01 -0.99 -0.04 0.00 0.02 0.00 0.00 56.10 55.09 3ijc s TRP 435 Cb -0.13 -1.50 -0.02 0.00 -1.15 0.00 0.00 33.47 30.67 3ijc s TRP 435 CO 0.03 -0.48 -0.02 0.50 0.02 0.00 0.00 176.95 176.99 3ijc s ARG 436 N 0.86 3.53 -0.17 4.98 3.52 -0.73 -1.59 118.95 129.35 3ijc s ARG 436 Ca -0.09 -0.56 0.01 0.00 -0.13 0.00 0.00 55.73 54.96 3ijc s ARG 436 Cb -0.15 -3.03 0.02 0.00 -1.56 0.00 0.00 34.95 30.22 3ijc s ARG 436 CO -0.00 -0.04 -0.19 -1.58 -0.81 0.00 0.00 175.30 172.68 3ijc s TRP 437 N 1.10 2.65 -0.09 5.12 0.52 0.20 -1.07 118.94 127.38 3ijc s TRP 437 Ca 0.02 -1.54 -0.03 0.00 0.02 0.00 0.00 56.10 54.56 3ijc s TRP 437 Cb -0.14 -1.85 -0.04 0.00 -1.15 0.00 0.00 33.47 30.29 3ijc s TRP 437 CO 0.01 -0.77 0.05 -0.51 0.02 0.00 0.00 176.95 175.75 3ijc s ASP 438 N 1.29 5.64 0.08 2.95 1.11 -0.44 -0.14 116.67 127.14 3ijc s ASP 438 Ca 0.04 0.25 -0.30 0.00 0.18 0.00 0.00 52.55 52.72 3ijc s ASP 438 Cb -0.13 -1.68 -0.05 0.00 1.07 0.00 0.00 42.92 42.13 3ijc s ASP 438 CO -0.12 0.38 1.07 -0.60 1.18 0.00 0.00 175.17 177.09 3ijc s ARG 439 N -0.97 4.55 0.00 8.23 3.52 0.31 -0.63 118.95 133.96 3ijc s ARG 439 Ca 0.14 1.60 0.00 0.00 -0.13 0.00 0.00 55.73 57.35 3ijc s ARG 439 Cb -0.12 -3.37 0.00 0.00 -1.56 0.00 0.00 34.95 29.91 3ijc s ARG 439 CO 0.03 -0.05 0.41 1.47 -0.81 0.00 0.00 175.30 176.35